A0A2K5XW82_MANLE Loading...

Protein O-linked-mannose beta-1,4-N-acetylglucosaminyltransferase 2

O-linked mannose beta-1,4-N-acetylglucosaminyltransferase that transfers UDP-N-acetyl-D-glucosamine to the 4-position of the mannose to generate N-acetyl-D-glucosamine-beta-1,4-O-D-mannosylprotein. Involved in the biosynthesis of the phosphorylated O-mannosyl trisaccharide (N-acetylgalactosamine-beta-3-N-acetylglucosamine-beta-4-(phosphate-6-)mannose), a carbohydrate structure present in alpha-dystroglycan (DAG1), which is required for binding laminin G-like domain-containing extracellular proteins with high affinity.

AlphaFold DB , UniProt , Accession A0A2K5XW82, Species MANLE (Mandrillus leucophaeus, Drill), Gene POMGNT2, Length 580 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	54.3	Low	72.8	Confident	219 Å²	219	111.4 Å²	111.4	100%	1.079	61%	0.608	S	S	*	*				0	117.1	0	-78.7	166.6	65.9	0	0	108.2	L3	M1-L3 PolarHBondContact O-N 3.17Å; M1-L3 VanDerWaalsContact O-N 3.14Å
2	H	65.7	Low	73.9	Confident	151 Å²	151	110.2 Å²	110.2	70%	0.699	61%	0.606	S	S	*	*			trans	-75.4	99.9	-179.2	-86.6	-81.4	0	0	0	110	S4 A5 V6	H2-S4 PolarHBondContact O-N 3.46Å; H2-S4 VanDerWaalsContact O-N 3.15Å; H2-A5 HydrophobicContact CB-CB 4.09Å; H2-A5 PolarHBondContact O-N 2.75Å; H2-V6 PolarHBondContact O-N 2.89Å
3	L	67.3	Low	74.5	Confident	126 Å²	126	107.8 Å²	107.8	66%	0.66	60%	0.602	S	S	*	*	H	α-helix	trans	-50.9	-37.3	178.4	-126	82.3	0	0	0	112	M1 A5 V6 F7	M1-L3 PolarHBondContact O-N 3.17Å; M1-L3 VanDerWaalsContact O-N 3.14Å; L3-A5 PolarHBondContact O-N 3.04Å; L3-V6 PolarHBondContact O-N 2.71Å; L3-F7 HydrophobicContact CD2-CE2 4.39Å; L3-F7 WeakPolarHBondContact O-CD2 3.4Å; L3-F7 PolarHBondContact O-N 3.15Å
4	S	67.3	Low	75.5	Confident	74 Å²	74	105.6 Å²	105.6	52%	0.517	59%	0.592	S	S	.	*	H	α-helix	trans	-63.4	-36.6	178.2	54.5	0	0	0	0	113.7	H2 N8	H2-S4 PolarHBondContact O-N 3.46Å; H2-S4 VanDerWaalsContact O-N 3.15Å; S4-N8 WeakPolarHBondContact O-CB 3.22Å; S4-N8 VanDerWaalsContact O-CG 3.32Å; S4-N8 PolarHBondContact O-N 2.87Å; S4-N8 PolarHBondContact O-ND2 3.07Å
5	A	69.6	Low	76.3	Confident	59 Å²	59	104.7 Å²	104.7	49%	0.488	59%	0.585	S	S	.	*	H	α-helix	trans	-70.8	-37.5	178.8	0	0	0	0	0	111.6	H2 L3 A9	H2-A5 HydrophobicContact CB-CB 4.09Å; H2-A5 PolarHBondContact O-N 2.75Å; L3-A5 PolarHBondContact O-N 3.04Å; A5-A9 WeakPolarHBondContact O-CB 3.29Å; A5-A9 PolarHBondContact O-N 3.05Å
6	V	76.6	Confident	76.8	Confident	79 Å²	79	101.6 Å²	101.6	48%	0.479	58%	0.577	S	S	.	*	H	α-helix	trans	-67.9	-44.9	176.2	179.9	0	0	0	0	110.6	H2 L3 N8 A9 L10	H2-V6 PolarHBondContact O-N 2.89Å; L3-V6 PolarHBondContact O-N 2.71Å; V6-N8 PolarHBondContact O-N 3.45Å; V6-A9 PolarHBondContact O-N 2.93Å; V6-L10 WeakPolarHBondContact O-CB 3.43Å; V6-L10 PolarHBondContact O-N 3.32Å
7	F	78.5	Confident	77.2	Confident	145 Å²	145	98.8 Å²	98.8	64%	0.636	57%	0.569	S	S	*	*	H	α-helix	trans	-62.3	-41.4	176.3	-95.2	-80.9	0	0	0	112.6	L3 L10 L11	L3-F7 HydrophobicContact CD2-CE2 4.39Å; L3-F7 WeakPolarHBondContact O-CD2 3.4Å; L3-F7 PolarHBondContact O-N 3.15Å; F7-L10 PolarHBondContact O-N 2.83Å; F7-L11 VanDerWaalsContact O-CB 3.28Å; F7-L11 WeakPolarHBondContact O-CB 3.34Å; F7-L11 PolarHBondContact O-N 3.32Å
8	N	78.1	Confident	77.7	Confident	103 Å²	103	98.4 Å²	98.4	55%	0.551	57%	0.568	S	S	*	*	H	α-helix	trans	-66	-42	176.7	-77.9	-16.4	0	0	0	112.2	S4 V6 L10 L11 V12	S4-N8 WeakPolarHBondContact O-CB 3.22Å; S4-N8 VanDerWaalsContact O-CG 3.32Å; S4-N8 PolarHBondContact O-N 2.87Å; S4-N8 PolarHBondContact O-ND2 3.07Å; V6-N8 PolarHBondContact O-N 3.45Å; N8-L10 PolarHBondContact O-N 2.92Å; N8-L11 PolarHBondContact O-N 2.86Å; N8-V12 WeakPolarHBondContact O-CB 3.37Å; N8-V12 VanDerWaalsContact O-CG2 3.25Å; N8-V12 WeakPolarHBondContact O-CG2 3.26Å; N8-V12 PolarHBondContact O-N 3.15Å
9	A	75.2	Confident	78.2	Confident	56 Å²	56	98.7 Å²	98.7	46%	0.463	57%	0.567	S	S	.	*	H	α-helix	trans	-61.9	-44.3	176	0	0	0	0	0	111.6	A5 V6 V12 S13	A5-A9 WeakPolarHBondContact O-CB 3.29Å; A5-A9 PolarHBondContact O-N 3.05Å; V6-A9 PolarHBondContact O-N 2.93Å; A9-V12 PolarHBondContact O-N 3.37Å; A9-S13 PolarHBondContact O-N 2.78Å; A9-S13 PolarHBondContact O-OG 2.88Å; A9-S13 VanDerWaalsContact O-OG 3.1Å
10	L	82.4	Confident	78.6	Confident	110 Å²	110	101.8 Å²	101.8	58%	0.576	57%	0.569	S	S	*	*	H	α-helix	trans	-64.3	-42.1	177.8	-127.7	135.4	0	0	0	111.7	V6 F7 N8 S13 V14	V6-L10 WeakPolarHBondContact O-CB 3.43Å; V6-L10 PolarHBondContact O-N 3.32Å; F7-L10 PolarHBondContact O-N 2.83Å; N8-L10 PolarHBondContact O-N 2.92Å; L10-S13 PolarHBondContact O-N 2.82Å; L10-V14 HydrophobicContact CD2-CG2 4.42Å; L10-V14 WeakPolarHBondContact O-CB 3.11Å; L10-V14 VanDerWaalsContact O-CG2 3.25Å; L10-V14 WeakPolarHBondContact O-CG2 3.2Å; L10-V14 PolarHBondContact O-N 3.21Å
11	L	86.1	Confident	78.9	Confident	103 Å²	103	103.5 Å²	103.5	54%	0.539	57%	0.571	S	S	.	*	H	α-helix	trans	-62.8	-43.1	177.2	-171.4	70.6	0	0	0	111.5	F7 N8 V14 L15	F7-L11 VanDerWaalsContact O-CB 3.28Å; F7-L11 WeakPolarHBondContact O-CB 3.34Å; F7-L11 PolarHBondContact O-N 3.32Å; N8-L11 PolarHBondContact O-N 2.86Å; L11-V14 PolarHBondContact O-N 2.64Å; L11-L15 HydrophobicContact CG-CD1 4.04Å; L11-L15 WeakPolarHBondContact O-CB 3.19Å; L11-L15 WeakPolarHBondContact O-CG 3.45Å; L11-L15 PolarHBondContact O-N 2.64Å
12	V	86.1	Confident	80.5	Confident	97 Å²	97	98.2 Å²	98.2	59%	0.588	54%	0.543	S	S	*	.	H	α-helix	trans	-64.7	-43.3	176.7	171.3	0	0	0	0	111.1	N8 A9 L15 A16	N8-V12 WeakPolarHBondContact O-CB 3.37Å; N8-V12 VanDerWaalsContact O-CG2 3.25Å; N8-V12 WeakPolarHBondContact O-CG2 3.26Å; N8-V12 PolarHBondContact O-N 3.15Å; A9-V12 PolarHBondContact O-N 3.37Å; V12-L15 PolarHBondContact O-N 3.46Å; V12-A16 VanDerWaalsContact O-CB 3.3Å; V12-A16 WeakPolarHBondContact O-CB 3.41Å; V12-A16 PolarHBondContact O-N 3.01Å
13	S	81.9	Confident	81.5	Confident	79 Å²	79	94.4 Å²	94.4	55%	0.552	53%	0.531	S	S	*	.	H	α-helix	trans	-64.3	-40.4	176.8	-62.2	0	0	0	0	112.6	A9 L10 A16 A17	A9-S13 PolarHBondContact O-N 2.78Å; A9-S13 PolarHBondContact O-OG 2.88Å; A9-S13 VanDerWaalsContact O-OG 3.1Å; L10-S13 PolarHBondContact O-N 2.82Å; S13-A16 PolarHBondContact O-N 3Å; S13-A17 WeakPolarHBondContact O-CB 3.39Å; S13-A17 PolarHBondContact O-N 3.43Å
14	V	87.3	Confident	82.3	Confident	77 Å²	77	95.9 Å²	95.9	47%	0.467	53%	0.527	S	S	.	.	H	α-helix	trans	-67.9	-44.5	176.8	172.1	0	0	0	0	110.8	L10 L11 A16 A17 V18	L10-V14 HydrophobicContact CD2-CG2 4.42Å; L10-V14 WeakPolarHBondContact O-CB 3.11Å; L10-V14 VanDerWaalsContact O-CG2 3.25Å; L10-V14 WeakPolarHBondContact O-CG2 3.2Å; L10-V14 PolarHBondContact O-N 3.21Å; L11-V14 PolarHBondContact O-N 2.64Å; V14-A16 VanDerWaalsContact C-N 3.33Å; V14-A16 PolarHBondContact O-N 3.48Å; V14-A17 PolarHBondContact O-N 3.03Å; V14-V18 HydrophobicContact CG1-CG2 4.38Å; V14-V18 WeakPolarHBondContact O-CB 3.41Å; V14-V18 VanDerWaalsContact O-CG2 3.27Å; V14-V18 WeakPolarHBondContact O-CG2 3.45Å; V14-V18 PolarHBondContact O-N 2.89Å
15	L	88.6	Confident	83.1	Confident	93 Å²	93	97.2 Å²	97.2	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-60.1	-42.9	174.9	-84.8	161.3	0	0	0	111.7	L11 V12 V18 L19	L11-L15 HydrophobicContact CG-CD1 4.04Å; L11-L15 WeakPolarHBondContact O-CB 3.19Å; L11-L15 WeakPolarHBondContact O-CG 3.45Å; L11-L15 PolarHBondContact O-N 2.64Å; V12-L15 PolarHBondContact O-N 3.46Å; L15-V18 PolarHBondContact O-N 3.14Å; L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 VanDerWaalsContact O-CG 3.27Å; L15-L19 WeakPolarHBondContact O-CG 3.25Å; L15-L19 PolarHBondContact O-N 3.41Å
16	A	83.4	Confident	84	Confident	54 Å²	54	103 Å²	103	45%	0.446	54%	0.537	S	S	.	.	H	α-helix	trans	-62.6	-43.3	176.2	0	0	0	0	0	112	V12 S13 V14 L19 W20	V12-A16 VanDerWaalsContact O-CB 3.3Å; V12-A16 WeakPolarHBondContact O-CB 3.41Å; V12-A16 PolarHBondContact O-N 3.01Å; S13-A16 PolarHBondContact O-N 3Å; V14-A16 VanDerWaalsContact C-N 3.33Å; V14-A16 PolarHBondContact O-N 3.48Å; A16-L19 PolarHBondContact O-N 3Å; A16-W20 VanDerWaalsContact O-CB 3.29Å; A16-W20 WeakPolarHBondContact O-CB 3.48Å; A16-W20 PolarHBondContact O-N 3.43Å
17	A	83.8	Confident	84.2	Confident	55 Å²	55	104.8 Å²	104.8	46%	0.455	54%	0.54	S	S	.	.	H	α-helix	trans	-65.7	-39.2	177.1	0	0	0	0	0	112.6	S13 V14 K21	S13-A17 WeakPolarHBondContact O-CB 3.39Å; S13-A17 PolarHBondContact O-N 3.43Å; V14-A17 PolarHBondContact O-N 3.03Å; A17-K21 WeakPolarHBondContact O-CB 3.28Å; A17-K21 PolarHBondContact O-N 3.1Å
18	V	85.9	Confident	84.3	Confident	91 Å²	91	103.4 Å²	103.4	55%	0.552	54%	0.536	S	S	*	.	H	α-helix	trans	-68.1	-43.7	176.5	171.6	0	0	0	0	110.9	V14 L15 K21 H22	V14-V18 HydrophobicContact CG1-CG2 4.38Å; V14-V18 WeakPolarHBondContact O-CB 3.41Å; V14-V18 VanDerWaalsContact O-CG2 3.27Å; V14-V18 WeakPolarHBondContact O-CG2 3.45Å; V14-V18 PolarHBondContact O-N 2.89Å; L15-V18 PolarHBondContact O-N 3.14Å; V18-K21 PolarHBondContact O-N 2.96Å; V18-H22 WeakPolarHBondContact O-CB 3.33Å; V18-H22 PolarHBondContact O-N 2.86Å
19	L	87.3	Confident	84.4	Confident	104 Å²	104	100.6 Å²	100.6	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-43.3	175.6	-76.1	167.7	0	0	0	111.4	L15 A16 K21 H22 V23	L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 VanDerWaalsContact O-CG 3.27Å; L15-L19 WeakPolarHBondContact O-CG 3.25Å; L15-L19 PolarHBondContact O-N 3.41Å; A16-L19 PolarHBondContact O-N 3Å; L19-K21 PolarHBondContact O-N 3.37Å; L19-H22 PolarHBondContact O-N 2.96Å; L19-V23 WeakPolarHBondContact O-CG2 3.33Å; L19-V23 PolarHBondContact O-N 2.89Å
20	W	85.7	Confident	84.6	Confident	161 Å²	161	100.3 Å²	100.3	61%	0.61	52%	0.524	S	S	*	.	H	α-helix	trans	-60.2	-45.5	175.4	-180	67.5	0	0	0	111.9	A16 H22 V23 R24	A16-W20 VanDerWaalsContact O-CB 3.29Å; A16-W20 WeakPolarHBondContact O-CB 3.48Å; A16-W20 PolarHBondContact O-N 3.43Å; W20-H22 VanDerWaalsContact C-N 3.33Å; W20-H22 PolarHBondContact O-N 3.37Å; W20-V23 PolarHBondContact O-N 3.45Å; W20-R24 PolarHBondContact O-N 3.38Å
21	K	85.7	Confident	84.3	Confident	138 Å²	138	98.3 Å²	98.3	60%	0.6	52%	0.517	S	S	*	.	H	α-helix	trans	-64.1	-38.1	176.1	-168.8	175.5	-177.6	179.7	0	112.1	A17 V18 L19 L25	A17-K21 WeakPolarHBondContact O-CB 3.28Å; A17-K21 PolarHBondContact O-N 3.1Å; V18-K21 PolarHBondContact O-N 2.96Å; L19-K21 PolarHBondContact O-N 3.37Å; K21-L25 HydrophobicContact CG-CD1 4.27Å; K21-L25 WeakPolarHBondContact O-CB 3.3Å; K21-L25 WeakPolarHBondContact O-CG 3.27Å; K21-L25 PolarHBondContact O-N 3.5Å
22	H	88.9	Confident	83.6	Confident	107 Å²	107	97.5 Å²	97.5	50%	0.495	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-45.3	176.8	-176.9	68.9	0	0	0	111.8	V18 L19 W20 L25 R26	V18-H22 WeakPolarHBondContact O-CB 3.33Å; V18-H22 PolarHBondContact O-N 2.86Å; L19-H22 PolarHBondContact O-N 2.96Å; W20-H22 VanDerWaalsContact C-N 3.33Å; W20-H22 PolarHBondContact O-N 3.37Å; H22-L25 PolarHBondContact O-N 2.87Å; H22-R26 WeakPolarHBondContact O-CB 3.3Å; H22-R26 PolarHBondContact O-N 3.47Å
23	V	86.4	Confident	83.2	Confident	72 Å²	72	99.6 Å²	99.6	44%	0.436	52%	0.516	S	S	.	.	H	α-helix	trans	-60	-47.4	175.3	172	0	0	0	0	110.5	L19 W20 L25 R26 E27	L19-V23 WeakPolarHBondContact O-CG2 3.33Å; L19-V23 PolarHBondContact O-N 2.89Å; W20-V23 PolarHBondContact O-N 3.45Å; V23-L25 VanDerWaalsContact C-N 3.35Å; V23-L25 PolarHBondContact O-N 3.48Å; V23-R26 WeakPolarHBondContact O-CB 3.39Å; V23-R26 PolarHBondContact O-N 2.88Å; V23-R26 VanDerWaalsContact O-N 3.09Å; V23-E27 HydrophobicContact CG1-CG 4.41Å; V23-E27 WeakPolarHBondContact O-CG 3.34Å; V23-E27 PolarHBondContact O-N 3.13Å
24	R	84.6	Confident	82.7	Confident	156 Å²	156	101.9 Å²	101.9	59%	0.589	52%	0.518	S	S	*	.	H	α-helix	trans	-58.7	-42.8	176.9	-116.8	-166.6	-176	-166.4	3.9	113.2	W20 R26 H28	W20-R24 PolarHBondContact O-N 3.38Å; R24-R26 VanDerWaalsContact C-N 3.3Å; R24-H28 WeakPolarHBondContact O-CB 3.49Å; R24-H28 PolarHBondContact O-N 3.43Å
25	L	82.9	Confident	81.7	Confident	103 Å²	103	103.8 Å²	103.8	54%	0.539	52%	0.522	S	S	.	.	H	α-helix	trans	-66.1	-36.2	177.1	-79.4	167.3	0	0	0	111.6	K21 H22 V23 A29	K21-L25 HydrophobicContact CG-CD1 4.27Å; K21-L25 WeakPolarHBondContact O-CB 3.3Å; K21-L25 WeakPolarHBondContact O-CG 3.27Å; K21-L25 PolarHBondContact O-N 3.5Å; H22-L25 PolarHBondContact O-N 2.87Å; V23-L25 VanDerWaalsContact C-N 3.35Å; V23-L25 PolarHBondContact O-N 3.48Å; L25-A29 VanDerWaalsContact O-CB 3.29Å; L25-A29 WeakPolarHBondContact O-CB 3.32Å; L25-A29 PolarHBondContact O-N 3.45Å
26	R	88.6	Confident	80.7	Confident	179 Å²	179	103.8 Å²	103.8	68%	0.675	52%	0.522	S	S	*	.	H	α-helix	trans	-72	-40.6	179.1	-147.5	-176.5	-170.8	-172	3.1	111.9	H22 V23 R24 A29 A30	H22-R26 WeakPolarHBondContact O-CB 3.3Å; H22-R26 PolarHBondContact O-N 3.47Å; V23-R26 WeakPolarHBondContact O-CB 3.39Å; V23-R26 PolarHBondContact O-N 2.88Å; V23-R26 VanDerWaalsContact O-N 3.09Å; R24-R26 VanDerWaalsContact C-N 3.3Å; R26-A29 PolarHBondContact O-N 3.16Å; R26-A30 WeakPolarHBondContact O-CB 3.35Å; R26-A30 PolarHBondContact O-N 3.23Å
27	E	81.7	Confident	79.9	Confident	117 Å²	117	103.5 Å²	103.5	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-61	-48.6	171.3	-73.8	173.6	170.3	0	0	110.4	V23 A29 A30 T31	V23-E27 HydrophobicContact CG1-CG 4.41Å; V23-E27 WeakPolarHBondContact O-CG 3.34Å; V23-E27 PolarHBondContact O-N 3.13Å; E27-A29 VanDerWaalsContact C-N 3.33Å; E27-A29 PolarHBondContact O-N 3.46Å; E27-A30 WeakPolarHBondContact O-CB 3.36Å; E27-A30 PolarHBondContact O-N 2.83Å; E27-A30 VanDerWaalsContact O-N 3.14Å; E27-T31 PolarHBondContact O-N 3.06Å; E27-T31 PolarHBondContact O-OG1 2.94Å
28	H	80	Confident	78.7	Confident	117 Å²	117	105.8 Å²	105.8	54%	0.542	52%	0.524	S	S	.	.	H	α-helix	trans	-61.5	-39.6	177.6	-169.4	58.9	0	0	0	112.8	R24 T31 L32	R24-H28 WeakPolarHBondContact O-CB 3.49Å; R24-H28 PolarHBondContact O-N 3.43Å; H28-T31 PolarHBondContact O-N 3.36Å; H28-L32 WeakPolarHBondContact O-CB 3.45Å; H28-L32 WeakPolarHBondContact O-CG 3.47Å; H28-L32 PolarHBondContact O-N 3.47Å
29	A	80.4	Confident	77.1	Confident	43 Å²	43	104 Å²	104	36%	0.355	52%	0.523	S	S	.	.	H	α-helix	trans	-65.3	-41	174	0	0	0	0	0	112	L25 R26 E27 T31 L32 E33	L25-A29 VanDerWaalsContact O-CB 3.29Å; L25-A29 WeakPolarHBondContact O-CB 3.32Å; L25-A29 PolarHBondContact O-N 3.45Å; R26-A29 PolarHBondContact O-N 3.16Å; E27-A29 VanDerWaalsContact C-N 3.33Å; E27-A29 PolarHBondContact O-N 3.46Å; A29-T31 VanDerWaalsContact C-N 3.34Å; A29-L32 PolarHBondContact O-N 2.69Å; A29-E33 WeakPolarHBondContact O-CB 3.37Å; A29-E33 WeakPolarHBondContact O-CG 3.47Å; A29-E33 PolarHBondContact O-N 2.93Å
30	A	79.6	Confident	75.5	Confident	50 Å²	50	107.2 Å²	107.2	41%	0.413	53%	0.528	S	S	.	.	H	α-helix	trans	-64.3	-39.2	175.1	0	0	0	0	0	111.7	R26 E27 E33 E34	R26-A30 WeakPolarHBondContact O-CB 3.35Å; R26-A30 PolarHBondContact O-N 3.23Å; E27-A30 WeakPolarHBondContact O-CB 3.36Å; E27-A30 PolarHBondContact O-N 2.83Å; E27-A30 VanDerWaalsContact O-N 3.14Å; A30-E33 PolarHBondContact O-N 2.84Å; A30-E34 WeakPolarHBondContact O-CB 3.3Å; A30-E34 PolarHBondContact O-N 2.86Å
31	T	74.9	Confident	73.6	Confident	69 Å²	69	107.4 Å²	107.4	42%	0.423	54%	0.535	S	S	.	.	H	α-helix	trans	-63.3	-44.4	173.6	-41	0	0	0	0	111.2	E27 H28 A29 E33 E34 E35	E27-T31 PolarHBondContact O-N 3.06Å; E27-T31 PolarHBondContact O-OG1 2.94Å; H28-T31 PolarHBondContact O-N 3.36Å; A29-T31 VanDerWaalsContact C-N 3.34Å; T31-E33 PolarHBondContact O-N 3.26Å; T31-E34 PolarHBondContact O-N 2.57Å; T31-E35 WeakPolarHBondContact O-CB 3.42Å; T31-E35 WeakPolarHBondContact O-CG 3.39Å; T31-E35 PolarHBondContact O-N 3.04Å
32	L	71.7	Confident	71.5	Confident	86 Å²	86	104.2 Å²	104.2	45%	0.45	54%	0.535	S	S	.	.	H	α-helix	trans	-64.6	-37.9	176	-79.3	164.1	0	0	0	112.3	H28 A29 L36	H28-L32 WeakPolarHBondContact O-CB 3.45Å; H28-L32 WeakPolarHBondContact O-CG 3.47Å; H28-L32 PolarHBondContact O-N 3.47Å; A29-L32 PolarHBondContact O-N 2.69Å; L32-L36 WeakPolarHBondContact O-CB 3.34Å; L32-L36 PolarHBondContact O-N 3.37Å
33	E	78.7	Confident	69.4	Low	141 Å²	141	104.5 Å²	104.5	66%	0.659	54%	0.544	S	S	*	.	H	α-helix	trans	-67.4	-38.5	174.5	-78.3	-179.1	173.5	0	0	111.8	A29 A30 T31 L36 A37	A29-E33 WeakPolarHBondContact O-CB 3.37Å; A29-E33 WeakPolarHBondContact O-CG 3.47Å; A29-E33 PolarHBondContact O-N 2.93Å; A30-E33 PolarHBondContact O-N 2.84Å; T31-E33 PolarHBondContact O-N 3.26Å; E33-L36 PolarHBondContact O-N 2.88Å; E33-A37 WeakPolarHBondContact O-CB 3.36Å; E33-A37 PolarHBondContact O-N 2.96Å
34	E	71.6	Confident	67	Low	126 Å²	126	109.8 Å²	109.8	59%	0.589	56%	0.564	S	S	*	*	H	α-helix	trans	-67.5	-42.8	174.4	-168	173.4	-172.5	0	0	111.3	A30 T31 L36 A37 L38	A30-E34 WeakPolarHBondContact O-CB 3.3Å; A30-E34 PolarHBondContact O-N 2.86Å; T31-E34 PolarHBondContact O-N 2.57Å; E34-L36 VanDerWaalsContact C-N 3.35Å; E34-L36 PolarHBondContact O-N 3.29Å; E34-A37 PolarHBondContact O-N 3.16Å; E34-L38 HydrophobicContact CG-CD1 4.22Å; E34-L38 WeakPolarHBondContact O-CB 3.38Å; E34-L38 VanDerWaalsContact O-CG 3.24Å; E34-L38 WeakPolarHBondContact O-CG 3.48Å; E34-L38 PolarHBondContact O-N 2.81Å
35	E	65.7	Low	64.9	Low	118 Å²	118	107.7 Å²	107.7	55%	0.551	57%	0.571	S	S	*	*	H	α-helix	trans	-61.5	-41	171.7	-76.6	-175.4	168.3	0	0	112	T31 G39	T31-E35 WeakPolarHBondContact O-CB 3.42Å; T31-E35 WeakPolarHBondContact O-CG 3.39Å; T31-E35 PolarHBondContact O-N 3.04Å; E35-G39 PolarHBondContact O-N 2.97Å
36	L	66.9	Low	62.9	Low	93 Å²	93	106.9 Å²	106.9	49%	0.487	58%	0.579	S	S	.	*	H	α-helix	trans	-68.1	-37.9	175.8	-164	87.9	0	0	0	111.2	L32 E33 E34 G39 R40	L32-L36 WeakPolarHBondContact O-CB 3.34Å; L32-L36 PolarHBondContact O-N 3.37Å; E33-L36 PolarHBondContact O-N 2.88Å; E34-L36 VanDerWaalsContact C-N 3.35Å; E34-L36 PolarHBondContact O-N 3.29Å; L36-G39 PolarHBondContact O-N 3.09Å; L36-R40 WeakPolarHBondContact O-CB 3.45Å; L36-R40 WeakPolarHBondContact O-CG 3.43Å; L36-R40 PolarHBondContact O-N 3.15Å
37	A	67.3	Low	60.5	Low	48 Å²	48	104.4 Å²	104.4	40%	0.397	59%	0.586	S	S	.	*	H	α-helix	trans	-69.1	-41.7	176.8	0	0	0	0	0	111.6	E33 E34 R40 Q41	E33-A37 WeakPolarHBondContact O-CB 3.36Å; E33-A37 PolarHBondContact O-N 2.96Å; E34-A37 PolarHBondContact O-N 3.16Å; A37-R40 CarbonylContact O-C 3.56Å; A37-R40 PolarHBondContact O-N 2.97Å; A37-Q41 PolarHBondContact O-N 3.28Å
38	L	57.5	Low	58.9	Low	103 Å²	103	102.6 Å²	102.6	54%	0.539	59%	0.591	S	S	.	*	H	α-helix	trans	-64.6	-40.4	171.9	-73	167.1	0	0	0	111.3	E34 R40 Q41 A42	E34-L38 HydrophobicContact CG-CD1 4.22Å; E34-L38 WeakPolarHBondContact O-CB 3.38Å; E34-L38 VanDerWaalsContact O-CG 3.24Å; E34-L38 WeakPolarHBondContact O-CG 3.48Å; E34-L38 PolarHBondContact O-N 2.81Å; L38-R40 VanDerWaalsContact C-N 3.29Å; L38-R40 PolarHBondContact O-N 3.33Å; L38-Q41 PolarHBondContact O-N 2.9Å; L38-A42 WeakPolarHBondContact O-CB 3.21Å; L38-A42 PolarHBondContact O-N 3.24Å
39	G	52.8	Low	57.6	Low	52 Å²	52	104.1 Å²	104.1	54%	0.536	60%	0.602	S	S	.	*	H	α-helix	trans	-64.3	-30.9	172.7	0	0	0	0	0	113.4	E35 L36	E35-G39 PolarHBondContact O-N 2.97Å; L36-G39 PolarHBondContact O-N 3.09Å
40	R	53.9	Low	56.8	Low	173 Å²	173	113.7 Å²	113.7	65%	0.653	63%	0.629	S	S	*	*	H	α-helix	trans	-80.8	-34.6	174.7	-75.8	171.7	176.8	-178.1	0.3	112.8	L36 A37 L38 A42 T43	L36-R40 WeakPolarHBondContact O-CB 3.45Å; L36-R40 WeakPolarHBondContact O-CG 3.43Å; L36-R40 PolarHBondContact O-N 3.15Å; A37-R40 CarbonylContact O-C 3.56Å; A37-R40 PolarHBondContact O-N 2.97Å; L38-R40 VanDerWaalsContact C-N 3.29Å; L38-R40 PolarHBondContact O-N 3.33Å; R40-A42 VanDerWaalsContact C-N 3.31Å; R40-T43 PolarHBondContact O-N 3.38Å; R40-T43 PolarHBondContact O-OG1 3.12Å
41	Q	45.1	Very low	56.7	Low	164 Å²	164	113.7 Å²	113.7	77%	0.766	62%	0.622	S	S	*	*	H	α-helix	trans	-73.6	-19.4	173.6	-90.6	-179.9	-16.2	0	0	113.3	A37 L38 T43	A37-Q41 PolarHBondContact O-N 3.28Å; L38-Q41 PolarHBondContact O-N 2.9Å; Q41-T43 PolarHBondContact O-N 3.43Å
42	A	42.8	Very low	57.4	Low	71 Å²	71	114.8 Å²	114.8	59%	0.587	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	23.8	168.4	0	0	0	0	0	113.7	L38 R40 E44	L38-A42 WeakPolarHBondContact O-CB 3.21Å; L38-A42 PolarHBondContact O-N 3.24Å; R40-A42 VanDerWaalsContact C-N 3.31Å; A42-E44 PolarHBondContact O-N 2.98Å; A42-E44 VanDerWaalsContact O-N 3.11Å
43	T	44.8	Very low	58.4	Low	114 Å²	114	114.9 Å²	114.9	70%	0.699	62%	0.62	S	S	*	*			trans	-85.6	63.4	170.7	39.7	0	0	0	0	111.1	R40 Q41	R40-T43 PolarHBondContact O-N 3.38Å; R40-T43 PolarHBondContact O-OG1 3.12Å; Q41-T43 PolarHBondContact O-N 3.43Å
44	E	34.9	Very low	59.1	Low	183 Å²	183	112.6 Å²	112.6	86%	0.855	62%	0.618	S	S	*	*			trans	-162.9	93.1	137	-107.7	-173.7	-170.7	0	0	107	A42 A46	A42-E44 PolarHBondContact O-N 2.98Å; A42-E44 VanDerWaalsContact O-N 3.11Å; E44-A46 PolarHBondContact O-N 3.36Å
45	P	41.2	Very low	60.1	Low	112 Å²	112	112.4 Å²	112.4	73%	0.727	62%	0.615	S	S	*	*			trans	-62.7	126.2	170	24.3	-30	0	0	0	108.1
46	A	40	Very low	61.5	Low	85 Å²	85	107 Å²	107	70%	0.702	59%	0.59	S	S	*	*			trans	-42.6	138	158.2	0	0	0	0	0	108.1	E44 A48	E44-A46 PolarHBondContact O-N 3.36Å; A46-A48 PolarHBondContact O-N 2.93Å
47	P	39.8	Very low	62.8	Low	127 Å²	127	104.5 Å²	104.5	83%	0.825	58%	0.577	S	S	*	*			trans	-54.1	107.8	-168.1	20.1	-31.2	0	0	0	108.8	L49	P47-L49 PolarHBondContact O-N 3.36Å
48	A	47	Very low	64.1	Low	79 Å²	79	107.2 Å²	107.2	65%	0.653	58%	0.582	S	S	*	*			trans	-54.1	121.4	174.3	0	0	0	0	0	105.6	A46 R50	A46-A48 PolarHBondContact O-N 2.93Å; A48-R50 VanDerWaalsContact C-N 3.29Å; A48-R50 PolarHBondContact O-N 2.92Å
49	L	53.4	Low	65.9	Low	149 Å²	149	105.5 Å²	105.5	78%	0.78	57%	0.572	S	S	*	*			trans	-53.5	100.4	176.4	-122.1	117.5	0	0	0	106.8	P47 I51	P47-L49 PolarHBondContact O-N 3.36Å; L49-I51 PolarHBondContact O-N 3.44Å
50	R	63.1	Low	68	Low	244 Å²	244	103 Å²	103	92%	0.921	55%	0.546	S	S	*	.			trans	-71.5	104.6	-174.1	-133.2	-178.7	-176.2	-177	1.2	105.5	A48 D52	A48-R50 VanDerWaalsContact C-N 3.29Å; A48-R50 PolarHBondContact O-N 2.92Å; R50-D52 PolarHBondContact O-N 2.98Å; R50-D52 VanDerWaalsContact O-N 3.14Å
51	I	77.4	Confident	69.9	Low	51 Å²	51	97.7 Å²	97.7	26%	0.262	53%	0.53	S	S	.	.			trans	-65.3	116.8	174.1	-67.5	-173.3	0	0	0	107.2	L49 Y53 A56 F148 P150	L49-I51 PolarHBondContact O-N 3.44Å; I51-Y53 PolarHBondContact O-N 3.27Å; I51-A56 HydrophobicContact CG2-CB 3.53Å; I51-F148 HydrophobicContact CD1-CB 3.75Å; I51-F148 HydrophobicContact CG2-CB 3.99Å; I51-F148 HydrophobicContact CG2-CG 4.32Å; I51-P150 HydrophobicContact CD1-CB 4.01Å; I51-P150 HydrophobicContact CG1-CB 4.12Å
52	D	89.4	Confident	72.3	Confident	92 Å²	92	95.1 Å²	95.1	49%	0.492	52%	0.518	S	S	.	.			trans	-66.2	100.4	166.5	179.1	-15.5	0	0	0	107.9	R50 P54 K55 A56	R50-D52 PolarHBondContact O-N 2.98Å; R50-D52 VanDerWaalsContact O-N 3.14Å; D52-P54 VanDerWaalsContact OD1-CD 3.24Å; D52-P54 WeakPolarHBondContact OD1-CD 3.36Å; D52-K55 HydrophobicContact CB-CB 3.91Å; D52-K55 VanDerWaalsContact CG-CB 3.44Å; D52-K55 PolarHBondContact O-N 2.99Å; D52-K55 PolarHBondContact OD1-N 3.35Å; D52-A56 WeakPolarHBondContact O-CB 3.41Å; D52-A56 PolarHBondContact O-N 3.39Å
53	Y	92.3	Very high	74.8	Confident	88 Å²	88	92 Å²	92	35%	0.345	49%	0.493	S	S	.	.	H	α-helix	trans	-59.4	-52.1	-172.3	175.5	-77.1	0	0	0	112.7	I51 K55 A56 L57 P146 F148	I51-Y53 PolarHBondContact O-N 3.27Å; Y53-K55 VanDerWaalsContact C-N 3.26Å; Y53-K55 PolarHBondContact O-N 3.32Å; Y53-A56 PolarHBondContact O-N 2.94Å; Y53-L57 HydrophobicContact CE1-CB 4.42Å; Y53-L57 HydrophobicContact CE1-CD2 3.98Å; Y53-L57 WeakPolarHBondContact O-CB 3.22Å; Y53-L57 PolarHBondContact O-N 3.45Å; Y53-P146 VanDerWaalsContact CE2-O 3.28Å; Y53-P146 WeakPolarHBondContact CE2-O 3.11Å; Y53-F148 AromaticContact CD2-CD2 3.85Å; Y53-F148 HydrophobicContact CD2-CD2 3.85Å; Y53-F148 HydrophobicContact CD2-CE2 4.07Å; Y53-F148 HydrophobicContact CE2-CD2 4.1Å; Y53-F148 HydrophobicContact CE2-CE2 4.05Å
54	P	93.6	Very high	77.2	Confident	93 Å²	93	86.6 Å²	86.6	60%	0.604	46%	0.46	S	S	*	.	H	α-helix	trans	-52.7	-44.8	175.6	-27.9	32.7	0	0	0	112.8	D52 L57 Q58	D52-P54 VanDerWaalsContact OD1-CD 3.24Å; D52-P54 WeakPolarHBondContact OD1-CD 3.36Å; P54-L57 PolarHBondContact O-N 2.87Å; P54-Q58 WeakPolarHBondContact O-CB 3.13Å; P54-Q58 PolarHBondContact O-N 2.98Å
55	K	94	Very high	80.2	Confident	122 Å²	122	77.9 Å²	77.9	53%	0.53	42%	0.419	S	S	.	.	H	α-helix	trans	-66.8	-44.5	179.4	-174.6	175	-178.4	175.9	0	112.4	D52 Y53 L57 Q58 I59	D52-K55 HydrophobicContact CB-CB 3.91Å; D52-K55 VanDerWaalsContact CG-CB 3.44Å; D52-K55 PolarHBondContact O-N 2.99Å; D52-K55 PolarHBondContact OD1-N 3.35Å; Y53-K55 VanDerWaalsContact C-N 3.26Å; Y53-K55 PolarHBondContact O-N 3.32Å; K55-L57 VanDerWaalsContact C-N 3.35Å; K55-Q58 PolarHBondContact O-N 2.87Å; K55-I59 HydrophobicContact CG-CD1 3.95Å; K55-I59 VanDerWaalsContact O-CG1 3.22Å; K55-I59 WeakPolarHBondContact O-CG1 3.49Å; K55-I59 PolarHBondContact O-N 2.98Å
56	A	94.1	Very high	83	Confident	3 Å²	3	75 Å²	75	3%	0.025	40%	0.396	C	S	.	.	H	α-helix	trans	-62.6	-42.1	177.6	0	0	0	0	0	112	I51 D52 Y53 I59 L60 W83 F148	I51-A56 HydrophobicContact CG2-CB 3.53Å; D52-A56 WeakPolarHBondContact O-CB 3.41Å; D52-A56 PolarHBondContact O-N 3.39Å; Y53-A56 PolarHBondContact O-N 2.94Å; A56-I59 PolarHBondContact O-N 3.43Å; A56-L60 WeakPolarHBondContact O-CB 3.26Å; A56-L60 PolarHBondContact O-N 3.39Å; A56-W83 HydrophobicContact CB-CH2 3.74Å; A56-W83 HydrophobicContact CB-CZ3 3.74Å; A56-F148 HydrophobicContact CB-CD1 4.12Å; A56-F148 HydrophobicContact CB-CD2 3.91Å; A56-F148 HydrophobicContact CB-CE1 4.02Å; A56-F148 HydrophobicContact CB-CE2 3.81Å; A56-F148 HydrophobicContact CB-CG 4.07Å; A56-F148 HydrophobicContact CB-CZ 3.87Å
57	L	95.4	Very high	85.7	Confident	42 Å²	42	71 Å²	71	22%	0.22	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-45.2	174.9	-178.8	61.8	0	0	0	111.3	Y53 P54 K55 L60 M61 P146 F148	Y53-L57 HydrophobicContact CE1-CB 4.42Å; Y53-L57 HydrophobicContact CE1-CD2 3.98Å; Y53-L57 WeakPolarHBondContact O-CB 3.22Å; Y53-L57 PolarHBondContact O-N 3.45Å; P54-L57 PolarHBondContact O-N 2.87Å; K55-L57 VanDerWaalsContact C-N 3.35Å; L57-L60 PolarHBondContact O-N 2.85Å; L57-M61 HydrophobicContact CD1-CG 3.97Å; L57-M61 HydrophobicContact CD1-SD 3.88Å; L57-M61 HydrophobicContact CD2-SD 4.31Å; L57-M61 HydrophobicContact CG-CG 4.26Å; L57-M61 HydrophobicContact CG-SD 3.78Å; L57-M61 VanDerWaalsContact O-CB 3.3Å; L57-M61 WeakPolarHBondContact O-CB 3.44Å; L57-M61 VanDerWaalsContact O-CG 3.25Å; L57-M61 WeakPolarHBondContact O-CG 3.47Å; L57-M61 PolarHBondContact O-N 3.37Å; L57-P146 HydrophobicContact CD1-CG 3.83Å; L57-F148 HydrophobicContact CB-CE2 4.23Å; L57-F148 HydrophobicContact CB-CZ 4.32Å
58	Q	94.5	Very high	88.5	Confident	105 Å²	105	67.6 Å²	67.6	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-60.2	-47.7	176.6	-173.9	179.5	7.3	0	0	111.6	P54 K55 L60 M61 E62	P54-Q58 WeakPolarHBondContact O-CB 3.13Å; P54-Q58 PolarHBondContact O-N 2.98Å; K55-Q58 PolarHBondContact O-N 2.87Å; Q58-L60 VanDerWaalsContact C-N 3.32Å; Q58-L60 PolarHBondContact O-N 2.9Å; Q58-M61 PolarHBondContact O-N 2.96Å; Q58-E62 HydrophobicContact CG-CG 4.31Å; Q58-E62 VanDerWaalsContact CG-OE1 3.23Å; Q58-E62 WeakPolarHBondContact CG-OE1 3.46Å; Q58-E62 PolarHBondContact NE2-OE1 3.5Å; Q58-E62 WeakPolarHBondContact O-CB 3.27Å; Q58-E62 PolarHBondContact O-N 3.36Å
59	I	94.8	Very high	90.8	Very high	66 Å²	66	64.6 Å²	64.6	34%	0.338	31%	0.313	S	S	.	.	H	α-helix	trans	-57.8	-45.8	177.9	-69.3	164.4	0	0	0	110.8	K55 A56 G63 W83	K55-I59 HydrophobicContact CG-CD1 3.95Å; K55-I59 VanDerWaalsContact O-CG1 3.22Å; K55-I59 WeakPolarHBondContact O-CG1 3.49Å; K55-I59 PolarHBondContact O-N 2.98Å; A56-I59 PolarHBondContact O-N 3.43Å; I59-G63 VanDerWaalsContact O-CA 3.28Å; I59-G63 WeakPolarHBondContact O-CA 3.22Å; I59-G63 PolarHBondContact O-N 2.89Å; I59-W83 HydrophobicContact CB-CZ2 4.32Å; I59-W83 HydrophobicContact CD1-CZ2 4.14Å; I59-W83 HydrophobicContact CG2-CZ2 3.9Å; I59-W83 VanDerWaalsContact CG2-NE1 3.28Å
60	L	95.9	Very high	92.8	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-69.4	-39.1	179.6	176.6	64.5	0	0	0	112	A56 L57 Q58 G64 W83 F96 L140 F148 C228	A56-L60 WeakPolarHBondContact O-CB 3.26Å; A56-L60 PolarHBondContact O-N 3.39Å; L57-L60 PolarHBondContact O-N 2.85Å; Q58-L60 VanDerWaalsContact C-N 3.32Å; Q58-L60 PolarHBondContact O-N 2.9Å; L60-G64 VanDerWaalsContact O-CA 3.27Å; L60-G64 WeakPolarHBondContact O-CA 3.43Å; L60-G64 PolarHBondContact O-N 3.09Å; L60-W83 HydrophobicContact CD1-CB 3.61Å; L60-F96 HydrophobicContact CD1-CB 4.23Å; L60-F96 HydrophobicContact CD1-CD2 3.89Å; L60-F96 HydrophobicContact CD1-CG 4.43Å; L60-F96 HydrophobicContact CD2-CD2 4.43Å; L60-F96 HydrophobicContact CG-CD2 4.47Å; L60-L140 HydrophobicContact CD1-CD1 4.46Å; L60-L140 HydrophobicContact CD2-CD1 3.73Å; L60-L140 HydrophobicContact CD2-CD2 4.12Å; L60-L140 HydrophobicContact CG-CD1 3.59Å; L60-F148 HydrophobicContact CD2-CE1 4.1Å; L60-F148 HydrophobicContact CD2-CZ 4.3Å; L60-C228 HydrophobicContact CD2-CB 4.47Å
61	M	95.4	Very high	94.1	Very high	61 Å²	61	50.5 Å²	50.5	30%	0.3	27%	0.268	S	S	.	.	H	α-helix	trans	-69.3	-36.1	179.7	-76.6	-177.3	67.2	0	0	113.4	L57 Q58 A137 L140 R141	L57-M61 HydrophobicContact CD1-CG 3.97Å; L57-M61 HydrophobicContact CD1-SD 3.88Å; L57-M61 HydrophobicContact CD2-SD 4.31Å; L57-M61 HydrophobicContact CG-CG 4.26Å; L57-M61 HydrophobicContact CG-SD 3.78Å; L57-M61 VanDerWaalsContact O-CB 3.3Å; L57-M61 WeakPolarHBondContact O-CB 3.44Å; L57-M61 VanDerWaalsContact O-CG 3.25Å; L57-M61 WeakPolarHBondContact O-CG 3.47Å; L57-M61 PolarHBondContact O-N 3.37Å; Q58-M61 PolarHBondContact O-N 2.96Å; M61-A137 VanDerWaalsContact O-CB 3.27Å; M61-A137 WeakPolarHBondContact O-CB 3.25Å; M61-L140 HydrophobicContact CG-CB 4.32Å; M61-L140 HydrophobicContact CG-CD1 4.01Å; M61-R141 HydrophobicContact CE-CG 3.94Å
62	E	94.3	Very high	94.6	Very high	110 Å²	110	59 Å²	59	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-91.2	-45.9	-179.1	-67	175.5	-171.3	0	0	111.9	Q58 N99	Q58-E62 HydrophobicContact CG-CG 4.31Å; Q58-E62 VanDerWaalsContact CG-OE1 3.23Å; Q58-E62 WeakPolarHBondContact CG-OE1 3.46Å; Q58-E62 PolarHBondContact NE2-OE1 3.5Å; Q58-E62 WeakPolarHBondContact O-CB 3.27Å; Q58-E62 PolarHBondContact O-N 3.36Å; E62-N99 PolarHBondContact O-N 2.84Å
63	G	94.7	Very high	94.6	Very high	7 Å²	7	58 Å²	58	7%	0.072	29%	0.294	C	S	.	.	H	α-helix	trans	-94.1	-23.8	-171.9	0	0	0	0	0	114.9	I59 T100 S101	I59-G63 VanDerWaalsContact O-CA 3.28Å; I59-G63 WeakPolarHBondContact O-CA 3.22Å; I59-G63 PolarHBondContact O-N 2.89Å; G63-T100 WeakPolarHBondContact CA-OG1 3.49Å; G63-T100 CarbonylContact O-C 3.56Å; G63-T100 PolarHBondContact O-OG1 2.87Å; G63-S101 WeakPolarHBondContact O-CA 3.44Å; G63-S101 PolarHBondContact O-N 3.3Å
64	G	96.9	Very high	94.5	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	70.6	-158.1	-178	0	0	0	0	0	114	L60 F96	L60-G64 VanDerWaalsContact O-CA 3.27Å; L60-G64 WeakPolarHBondContact O-CA 3.43Å; L60-G64 PolarHBondContact O-N 3.09Å; G64-F96 CarbonylContact C-O 3.45Å; G64-F96 VanDerWaalsContact CA-O 3.32Å; G64-F96 WeakPolarHBondContact CA-O 3.43Å
65	T	98.1	Very high	94.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.262	C	S	.	.			trans	-91.2	144.6	-179.6	-55	0	0	0	0	110.3	F81 K82 W83 F95 F96 S101 V102	T65-F81 HydrophobicContact CG2-CD1 4.05Å; T65-K82 WeakPolarHBondContact CA-O 3.37Å; T65-K82 WeakPolarHBondContact CG2-O 3.45Å; T65-W83 PolarHBondContact OG1-O 3.28Å; T65-F95 HydrophobicContact CG2-CD2 3.38Å; T65-F95 HydrophobicContact CG2-CE2 3.58Å; T65-F95 HydrophobicContact CG2-CG 4.03Å; T65-F95 HydrophobicContact CG2-CZ 4.37Å; T65-F95 WeakPolarHBondContact O-CZ 3.45Å; T65-F96 PolarHBondContact N-O 2.84Å; T65-F96 PolarHBondContact OG1-N 3.21Å; T65-S101 WeakPolarHBondContact O-CA 3.38Å; T65-S101 WeakPolarHBondContact O-CB 3.39Å; T65-V102 PolarHBondContact O-N 2.87Å
66	H	98.1	Very high	94.1	Very high	51 Å²	51	49.8 Å²	49.8	24%	0.236	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135	171.9	-63.5	-119.8	0	0	0	109.3	F81 K82 T100 V102	H66-F81 CarbonylContact O-C 3.6Å; H66-F81 WeakPolarHBondContact O-CA 3.2Å; H66-K82 HydrophobicContact CB-CB 4.22Å; H66-K82 PolarHBondContact N-O 3.03Å; H66-K82 PolarHBondContact O-N 2.81Å; H66-T100 PolarHBondContact CE1-O 3.4Å; H66-T100 PolarHBondContact NE2-O 3.14Å; H66-V102 CarbonylContact C-O 3.53Å; H66-V102 WeakPolarHBondContact CA-O 3.36Å; H66-V102 HydrophobicContact CB-CB 4.32Å; H66-V102 WeakPolarHBondContact ND1-CG2 3.35Å
67	M	97.9	Very high	94.1	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	127.9	177.4	-178.5	-172.7	87.7	0	0	110.1	C79 R80 F81 F95 V102 M103 L104 L116 F132	M67-C79 HydrophobicContact CG-CB 4.29Å; M67-R80 CarbonylContact C-O 3.54Å; M67-R80 WeakPolarHBondContact CA-O 3.37Å; M67-F81 HydrophobicContact CB-CD1 3.71Å; M67-F81 HydrophobicContact CB-CE1 3.56Å; M67-F81 HydrophobicContact CB-CG 4.45Å; M67-F81 HydrophobicContact CB-CZ 4.19Å; M67-F81 HydrophobicContact CG-CD1 3.87Å; M67-F81 HydrophobicContact CG-CD2 4.47Å; M67-F81 HydrophobicContact CG-CE1 3.36Å; M67-F81 HydrophobicContact CG-CE2 4.04Å; M67-F81 HydrophobicContact CG-CG 4.39Å; M67-F81 HydrophobicContact CG-CZ 3.45Å; M67-F81 VanDerWaalsContact CG-CZ 3.45Å; M67-F81 HydrophobicContact SD-CD1 4.49Å; M67-F81 HydrophobicContact SD-CE1 3.45Å; M67-F81 WeakPolarHBondContact SD-CE1 3.24Å; M67-F81 HydrophobicContact SD-CE2 4.33Å; M67-F81 HydrophobicContact SD-CZ 3.34Å; M67-F81 WeakPolarHBondContact SD-CZ 3.33Å; M67-F95 HydrophobicContact CB-CD2 4.45Å; M67-F95 HydrophobicContact CB-CE2 3.8Å; M67-V102 PolarHBondContact N-O 2.79Å; M67-M103 HydrophobicContact CE-CB 4.47Å; M67-M103 HydrophobicContact CE-CG 3.29Å; M67-M103 HydrophobicContact CE-SD 4.26Å; M67-M103 HydrophobicContact SD-CG 4.37Å; M67-L104 PolarHBondContact O-N 3.25Å; M67-L116 HydrophobicContact SD-CD2 4.06Å; M67-F132 HydrophobicContact SD-CE1 3.76Å; M67-F132 HydrophobicContact SD-CZ 4.05Å
68	V	97.6	Very high	94.1	Very high	54 Å²	54	48.8 Å²	48.8	33%	0.327	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	118.9	171.2	-178.3	0	0	0	0	109.3	R80 L104	V68-R80 PolarHBondContact N-O 3.32Å; V68-R80 PolarHBondContact O-N 3.22Å; V68-L104 CarbonylContact C-O 3.58Å; V68-L104 WeakPolarHBondContact CA-O 3.41Å
69	C	96.6	Very high	94.3	Very high	16 Å²	16	43.8 Å²	43.8	11%	0.108	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	148.6	-179.9	-45.9	0	0	0	0	112.6	R77 I78 C79 L104	C69-R77 HydrophobicContact CB-CG 3.77Å; C69-I78 CarbonylContact C-O 3.56Å; C69-I78 VanDerWaalsContact CA-O 3.27Å; C69-I78 WeakPolarHBondContact CA-O 3.36Å; C69-C79 HydrophobicContact CB-CB 4.04Å; C69-C79 WeakPolarHBondContact CB-SG 3.22Å; C69-C79 WeakPolarHBondContact SG-CB 3.47Å; C69-C79 CovalentContact SG-SG 2.02Å; C69-C79 PolarHBondContact SG-SG 2.92Å; C69-L104 PolarHBondContact N-O 3.09Å
70	T	94.3	Very high	94.4	Very high	61 Å²	61	45.9 Å²	45.9	37%	0.374	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	159.1	166.4	55.7	0	0	0	0	109.1	R77 I78	T70-R77 WeakPolarHBondContact O-CA 3.47Å; T70-R77 WeakPolarHBondContact O-CG 3.29Å; T70-I78 PolarHBondContact N-O 3.27Å; T70-I78 PolarHBondContact O-N 3.3Å
71	G	91.2	Very high	94.5	Very high	36 Å²	36	46 Å²	46	37%	0.371	23%	0.231	S	C	.	.			trans	96.9	153.3	-176.3	0	0	0	0	0	112.6	D76	G71-D76 WeakPolarHBondContact CA-OD2 3.4Å
72	R	87.6	Confident	94.6	Very high	229 Å²	229	48.1 Å²	48.1	86%	0.864	24%	0.238	S	C	*	.	S	Bend	trans	-100	-40.8	-171.8	-66.8	-175.8	178	-177.2	-0	112.6	D76 R77	R72-D76 VanDerWaalsContact N-CG 3.29Å; R72-D76 PolarHBondContact N-OD1 3.4Å; R72-D76 PolarHBondContact N-OD2 3.12Å; R72-R77 PolarHBondContact O-NH2 2.82Å
73	T	90.3	Very high	94.7	Very high	72 Å²	72	44.6 Å²	44.6	44%	0.442	22%	0.22	S	C	.	.	S	Bend	trans	-101.1	173.7	179.2	71.5	0	0	0	0	110.1	T75 D76 R77	T73-T75 PolarHBondContact O-N 3.48Å; T73-T75 WeakPolarHBondContact OG1-CB 3.4Å; T73-T75 PolarHBondContact OG1-N 2.8Å; T73-D76 WeakPolarHBondContact CA-OD1 3.34Å; T73-D76 PolarHBondContact N-OD1 3.22Å; T73-D76 PolarHBondContact OG1-N 3.29Å; T73-D76 PolarHBondContact OG1-OD1 3.39Å; T73-D76 VanDerWaalsContact OG1-OD1 3.06Å; T73-R77 WeakPolarHBondContact O-CB 3.39Å; T73-R77 PolarHBondContact O-N 2.67Å
74	H	89.9	Confident	94.9	Very high	26 Å²	26	44.2 Å²	44.2	12%	0.12	22%	0.217	C	C	.	.	S	Bend	trans	-67.5	-26.3	173.3	63.9	-79.9	0	0	0	111.5	P114 A115 L117 D118	H74-P114 WeakPolarHBondContact CE1-CG 3.4Å; H74-P114 WeakPolarHBondContact ND1-CD 3.46Å; H74-P114 WeakPolarHBondContact ND1-CG 3.3Å; H74-A115 HydrophobicContact CB-CB 4.48Å; H74-A115 WeakPolarHBondContact CB-O 3.29Å; H74-L117 VanDerWaalsContact O-CA 3.26Å; H74-L117 WeakPolarHBondContact O-CA 3.29Å; H74-D118 IonicContact CD2-OD1 3.29Å; H74-D118 PolarHBondContact CD2-OD1 2.97Å; H74-D118 IonicContact CD2-OD2 2.69Å; H74-D118 PolarHBondContact O-N 2.77Å
75	T	89.2	Confident	95	Very high	27 Å²	27	44.2 Å²	44.2	17%	0.166	22%	0.217	C	C	.	.	S	Bend	trans	-72.8	-38	-177.3	-53.3	0	0	0	0	114.3	T73 D118 E123 K238	T73-T75 PolarHBondContact O-N 3.48Å; T73-T75 WeakPolarHBondContact OG1-CB 3.4Å; T73-T75 PolarHBondContact OG1-N 2.8Å; T75-D118 WeakPolarHBondContact CA-OD2 3.46Å; T75-E123 HydrophobicContact CG2-CG 3.65Å; T75-K238 HydrophobicContact CG2-CD 3.6Å; T75-K238 WeakPolarHBondContact O-CD 3.5Å; T75-K238 WeakPolarHBondContact O-CE 3.47Å
76	D	89.6	Confident	95	Very high	77 Å²	77	44.3 Å²	44.3	41%	0.412	22%	0.217	S	C	.	.	S	Bend	trans	-99.5	2.5	179	72.5	-27.9	0	0	0	112.7	G71 R72 T73	G71-D76 WeakPolarHBondContact CA-OD2 3.4Å; R72-D76 VanDerWaalsContact N-CG 3.29Å; R72-D76 PolarHBondContact N-OD1 3.4Å; R72-D76 PolarHBondContact N-OD2 3.12Å; T73-D76 WeakPolarHBondContact CA-OD1 3.34Å; T73-D76 PolarHBondContact N-OD1 3.22Å; T73-D76 PolarHBondContact OG1-N 3.29Å; T73-D76 PolarHBondContact OG1-OD1 3.39Å; T73-D76 VanDerWaalsContact OG1-OD1 3.06Å
77	R	93.9	Very high	94.9	Very high	20 Å²	20	42.8 Å²	42.8	8%	0.075	21%	0.212	C	C	.	.			trans	-83.9	129.1	-173.7	-174.4	174.9	-52.1	136.9	0.7	112.6	C69 T70 R72 T73 L116 L117	C69-R77 HydrophobicContact CB-CG 3.77Å; T70-R77 WeakPolarHBondContact O-CA 3.47Å; T70-R77 WeakPolarHBondContact O-CG 3.29Å; R72-R77 PolarHBondContact O-NH2 2.82Å; T73-R77 WeakPolarHBondContact O-CB 3.39Å; T73-R77 PolarHBondContact O-N 2.67Å; R77-L116 WeakPolarHBondContact CD-O 3.39Å; R77-L116 PolarHBondContact NH1-O 3.41Å; R77-L117 HydrophobicContact CB-CB 4.07Å; R77-L117 HydrophobicContact CG-CB 4.3Å; R77-L117 WeakPolarHBondContact O-CB 3.44Å
78	I	96.3	Very high	94.8	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.5	170.5	-58.8	175.9	0	0	0	106.9	C69 T70 T178 F182	C69-I78 CarbonylContact C-O 3.56Å; C69-I78 VanDerWaalsContact CA-O 3.27Å; C69-I78 WeakPolarHBondContact CA-O 3.36Å; T70-I78 PolarHBondContact N-O 3.27Å; T70-I78 PolarHBondContact O-N 3.3Å; I78-T178 HydrophobicContact CD1-CG2 4.49Å; I78-F182 HydrophobicContact CG2-CE2 4.3Å; I78-F182 HydrophobicContact CG2-CZ 4.17Å
79	C	97.6	Very high	94.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.2	-178	-67.2	0	0	0	0	111	M67 C69 F81 L117 V234	M67-C79 HydrophobicContact CG-CB 4.29Å; C69-C79 HydrophobicContact CB-CB 4.04Å; C69-C79 WeakPolarHBondContact CB-SG 3.22Å; C69-C79 WeakPolarHBondContact SG-CB 3.47Å; C69-C79 CovalentContact SG-SG 2.02Å; C69-C79 PolarHBondContact SG-SG 2.92Å; C79-F81 HydrophobicContact CB-CD2 4.11Å; C79-F81 HydrophobicContact CB-CE2 3.39Å; C79-F81 HydrophobicContact CB-CZ 4.03Å; C79-L117 HydrophobicContact CB-CD2 3.72Å; C79-L117 WeakPolarHBondContact SG-CD2 3.4Å; C79-V234 PolarHBondContact N-O 2.54Å; C79-V234 PolarHBondContact O-N 3.22Å
80	R	97.5	Very high	94.6	Very high	109 Å²	109	49 Å²	49	41%	0.411	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.7	171.6	-63.3	178.6	-63.6	179	-0.4	108.7	M67 V68 A232 F233	M67-R80 CarbonylContact C-O 3.54Å; M67-R80 WeakPolarHBondContact CA-O 3.37Å; V68-R80 PolarHBondContact N-O 3.32Å; V68-R80 PolarHBondContact O-N 3.22Å; R80-A232 CarbonylContact C-O 3.59Å; R80-A232 WeakPolarHBondContact CA-O 3.46Å; R80-F233 VanDerWaalsContact CD-CE1 3.48Å; R80-F233 HydrophobicContact CG-CD1 3.66Å; R80-F233 HydrophobicContact CG-CE1 3.58Å; R80-F233 HydrophobicContact CG-CG 4.4Å; R80-F233 HydrophobicContact CG-CZ 4.25Å
81	F	98.1	Very high	94.6	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.018	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	148.4	177.2	-64.6	-102.4	0	0	0	111.8	T65 H66 M67 C79 L84 F95 F130 F132 H231 A232 V234	T65-F81 HydrophobicContact CG2-CD1 4.05Å; H66-F81 CarbonylContact O-C 3.6Å; H66-F81 WeakPolarHBondContact O-CA 3.2Å; M67-F81 HydrophobicContact CB-CD1 3.71Å; M67-F81 HydrophobicContact CB-CE1 3.56Å; M67-F81 HydrophobicContact CB-CG 4.45Å; M67-F81 HydrophobicContact CB-CZ 4.19Å; M67-F81 HydrophobicContact CG-CD1 3.87Å; M67-F81 HydrophobicContact CG-CD2 4.47Å; M67-F81 HydrophobicContact CG-CE1 3.36Å; M67-F81 HydrophobicContact CG-CE2 4.04Å; M67-F81 HydrophobicContact CG-CG 4.39Å; M67-F81 HydrophobicContact CG-CZ 3.45Å; M67-F81 VanDerWaalsContact CG-CZ 3.45Å; M67-F81 HydrophobicContact SD-CD1 4.49Å; M67-F81 HydrophobicContact SD-CE1 3.45Å; M67-F81 WeakPolarHBondContact SD-CE1 3.24Å; M67-F81 HydrophobicContact SD-CE2 4.33Å; M67-F81 HydrophobicContact SD-CZ 3.34Å; M67-F81 WeakPolarHBondContact SD-CZ 3.33Å; C79-F81 HydrophobicContact CB-CD2 4.11Å; C79-F81 HydrophobicContact CB-CE2 3.39Å; C79-F81 HydrophobicContact CB-CZ 4.03Å; F81-L84 HydrophobicContact CB-CB 3.7Å; F81-L84 HydrophobicContact CB-CD2 4.29Å; F81-L84 HydrophobicContact CD1-CB 4.2Å; F81-L84 HydrophobicContact CD1-CD1 3.9Å; F81-L84 HydrophobicContact CD1-CD2 4.35Å; F81-L84 HydrophobicContact CD1-CG 4.39Å; F81-L84 HydrophobicContact CD2-CD2 4.15Å; F81-L84 HydrophobicContact CE1-CD1 4.12Å; F81-L84 HydrophobicContact CG-CB 4.09Å; F81-L84 HydrophobicContact CG-CD1 4.39Å; F81-L84 HydrophobicContact CG-CD2 4.03Å; F81-L84 HydrophobicContact CG-CG 4.41Å; F81-F95 HydrophobicContact CD1-CD2 4.46Å; F81-F95 HydrophobicContact CE1-CD2 4.25Å; F81-F130 AromaticContact CE2-CE1 3.9Å; F81-F130 HydrophobicContact CE2-CE1 3.9Å; F81-F130 HydrophobicContact CE2-CZ 4.17Å; F81-F130 AromaticContact CZ-CE1 3.64Å; F81-F130 HydrophobicContact CZ-CE1 3.64Å; F81-F130 HydrophobicContact CZ-CZ 4.08Å; F81-F132 HydrophobicContact CE1-CD1 4.2Å; F81-F132 AromaticContact CE1-CE1 3.97Å; F81-F132 HydrophobicContact CE1-CE1 3.97Å; F81-F132 HydrophobicContact CZ-CD1 4.21Å; F81-F132 AromaticContact CZ-CE1 3.99Å; F81-F132 HydrophobicContact CZ-CE1 3.99Å; F81-H231 WeakPolarHBondContact O-CA 3.49Å; F81-A232 HydrophobicContact CB-CB 4.34Å; F81-A232 PolarHBondContact N-O 2.97Å; F81-A232 PolarHBondContact O-N 2.77Å; F81-V234 HydrophobicContact CD2-CB 4.37Å; F81-V234 HydrophobicContact CD2-CG2 3.57Å; F81-V234 HydrophobicContact CE2-CB 4.08Å; F81-V234 HydrophobicContact CE2-CG2 3.66Å
82	K	97	Very high	94.8	Very high	104 Å²	104	52.4 Å²	52.4	45%	0.452	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134.2	158.6	-62.8	-176.5	172.7	-174.7	0	109	T65 H66 L84 S230	T65-K82 WeakPolarHBondContact CA-O 3.37Å; T65-K82 WeakPolarHBondContact CG2-O 3.45Å; H66-K82 HydrophobicContact CB-CB 4.22Å; H66-K82 PolarHBondContact N-O 3.03Å; H66-K82 PolarHBondContact O-N 2.81Å; K82-L84 VanDerWaalsContact C-N 3.31Å; K82-L84 PolarHBondContact O-N 3.32Å; K82-S230 VanDerWaalsContact CA-O 3.3Å; K82-S230 WeakPolarHBondContact CA-O 3.3Å
83	W	96.7	Very high	95.3	Very high	36 Å²	36	42.1 Å²	42.1	14%	0.136	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.3	40.1	-179.4	-43	111.3	0	0	0	113.4	A56 I59 L60 T65 F148 F229 S230	A56-W83 HydrophobicContact CB-CH2 3.74Å; A56-W83 HydrophobicContact CB-CZ3 3.74Å; I59-W83 HydrophobicContact CB-CZ2 4.32Å; I59-W83 HydrophobicContact CD1-CZ2 4.14Å; I59-W83 HydrophobicContact CG2-CZ2 3.9Å; I59-W83 VanDerWaalsContact CG2-NE1 3.28Å; L60-W83 HydrophobicContact CD1-CB 3.61Å; T65-W83 PolarHBondContact OG1-O 3.28Å; W83-F148 AromaticContact CE3-CD1 3.91Å; W83-F148 HydrophobicContact CE3-CD1 3.91Å; W83-F148 AromaticContact CE3-CE1 3.83Å; W83-F148 HydrophobicContact CE3-CE1 3.83Å; W83-F148 AromaticContact CZ3-CD1 3.68Å; W83-F148 HydrophobicContact CZ3-CD1 3.68Å; W83-F148 AromaticContact CZ3-CE1 3.83Å; W83-F148 HydrophobicContact CZ3-CE1 3.83Å; W83-F229 WeakPolarHBondContact CA-O 3.37Å; W83-F229 PolarHBondContact N-O 3.37Å; W83-S230 PolarHBondContact N-O 2.77Å
84	L	98.3	Very high	95.7	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	131.5	168.7	177.5	66.3	0	0	0	108.2	F81 K82 F93 F130 I155 C228 F229 A232 V234	F81-L84 HydrophobicContact CB-CB 3.7Å; F81-L84 HydrophobicContact CB-CD2 4.29Å; F81-L84 HydrophobicContact CD1-CB 4.2Å; F81-L84 HydrophobicContact CD1-CD1 3.9Å; F81-L84 HydrophobicContact CD1-CD2 4.35Å; F81-L84 HydrophobicContact CD1-CG 4.39Å; F81-L84 HydrophobicContact CD2-CD2 4.15Å; F81-L84 HydrophobicContact CE1-CD1 4.12Å; F81-L84 HydrophobicContact CG-CB 4.09Å; F81-L84 HydrophobicContact CG-CD1 4.39Å; F81-L84 HydrophobicContact CG-CD2 4.03Å; F81-L84 HydrophobicContact CG-CG 4.41Å; K82-L84 VanDerWaalsContact C-N 3.31Å; K82-L84 PolarHBondContact O-N 3.32Å; L84-F93 HydrophobicContact CD1-CB 4.25Å; L84-F93 HydrophobicContact CD1-CD1 4.34Å; L84-F93 HydrophobicContact CD2-CD1 3.76Å; L84-F93 HydrophobicContact CD2-CE1 4.12Å; L84-F93 HydrophobicContact CG-CD1 3.94Å; L84-F130 HydrophobicContact CD2-CZ 4.09Å; L84-I155 HydrophobicContact CD2-CD1 4.27Å; L84-C228 CarbonylContact O-C 3.5Å; L84-C228 WeakPolarHBondContact O-CA 3.29Å; L84-F229 PolarHBondContact N-O 2.78Å; L84-F229 WeakPolarHBondContact O-CD2 3.23Å; L84-F229 PolarHBondContact O-N 2.66Å; L84-A232 HydrophobicContact CD2-CB 4.32Å; L84-V234 HydrophobicContact CD2-CG2 4.18Å
85	C	98.3	Very high	96.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	159.8	177.4	-58.3	0	0	0	0	112.3	F93 I94 F96 L226 L227 C228	C85-F93 CarbonylContact O-C 3.48Å; C85-F93 VanDerWaalsContact O-CA 3.27Å; C85-F93 WeakPolarHBondContact O-CA 3.15Å; C85-I94 HydrophobicContact CB-CB 4.35Å; C85-I94 PolarHBondContact N-O 3Å; C85-I94 VanDerWaalsContact N-O 3.13Å; C85-I94 PolarHBondContact O-N 2.66Å; C85-F96 HydrophobicContact CB-CD2 4.49Å; C85-F96 HydrophobicContact CB-CE2 3.92Å; C85-L226 HydrophobicContact CB-CD1 3.97Å; C85-L227 CarbonylContact C-O 3.5Å; C85-L227 WeakPolarHBondContact CA-O 3.21Å; C85-L227 WeakPolarHBondContact CB-O 3.34Å; C85-C228 HydrophobicContact CB-CB 4.19Å; C85-C228 WeakPolarHBondContact CB-SG 3.43Å; C85-C228 WeakPolarHBondContact SG-CB 3.37Å; C85-C228 CovalentContact SG-SG 2.05Å; C85-C228 PolarHBondContact SG-SG 3.14Å
86	Y	98.2	Very high	96.6	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.008	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	124.9	177.4	-179.9	-106.1	0	0	0	109.3	N88 E91 E92 F93 M194 L220 L227	Y86-N88 WeakPolarHBondContact CE1-OD1 3.3Å; Y86-E91 VanDerWaalsContact CE2-C 3.47Å; Y86-E91 WeakPolarHBondContact CE2-O 3.43Å; Y86-E91 WeakPolarHBondContact OH-CA 3.39Å; Y86-E92 WeakPolarHBondContact CA-O 3.38Å; Y86-E92 WeakPolarHBondContact CD2-O 3.29Å; Y86-F93 AromaticContact CD2-CD1 3.91Å; Y86-F93 HydrophobicContact CD2-CD1 3.91Å; Y86-F93 HydrophobicContact CD2-CD2 4.14Å; Y86-F93 AromaticContact CD2-CE1 3.93Å; Y86-F93 HydrophobicContact CD2-CE1 3.93Å; Y86-F93 HydrophobicContact CD2-CE2 4.16Å; Y86-F93 HydrophobicContact CD2-CG 4.03Å; Y86-F93 HydrophobicContact CD2-CZ 4.06Å; Y86-F93 HydrophobicContact CE2-CE2 4.43Å; Y86-F93 HydrophobicContact CG-CD1 4.41Å; Y86-F93 HydrophobicContact CG-CE1 4.29Å; Y86-M194 HydrophobicContact CD1-CE 4.39Å; Y86-M194 HydrophobicContact CD2-CE 3.94Å; Y86-M194 HydrophobicContact CE1-CE 3.95Å; Y86-M194 HydrophobicContact CE2-CE 3.47Å; Y86-M194 VanDerWaalsContact CE2-CE 3.47Å; Y86-M194 HydrophobicContact CG-CE 4.38Å; Y86-M194 VanDerWaalsContact CZ-CE 3.48Å; Y86-L220 HydrophobicContact CD1-CD1 4.15Å; Y86-L220 HydrophobicContact CE1-CD1 4.09Å; Y86-L227 PolarHBondContact N-O 3.12Å; Y86-L227 PolarHBondContact O-N 3.15Å
87	S	97.7	Very high	96.9	Very high	19 Å²	19	36.3 Å²	36.3	13%	0.133	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	115.9	173.5	175.4	0	0	0	0	109.3	E89 A90 E91 E92	S87-E89 PolarHBondContact O-N 3.37Å; S87-E89 PolarHBondContact OG-N 2.82Å; S87-A90 PolarHBondContact OG-N 3.46Å; S87-E91 VanDerWaalsContact O-CA 3.23Å; S87-E91 WeakPolarHBondContact O-CA 3.32Å; S87-E91 PolarHBondContact O-N 3.21Å; S87-E92 PolarHBondContact N-O 3.01Å; S87-E92 PolarHBondContact O-N 2.96Å
88	N	95.1	Very high	97	Very high	13 Å²	13	36.3 Å²	36.3	7%	0.07	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-19.6	176.2	-87.3	-60.6	0	0	0	113.2	Y86 L220 K221 G224 R225	Y86-N88 WeakPolarHBondContact CE1-OD1 3.3Å; N88-L220 PolarHBondContact ND2-O 3.24Å; N88-L220 WeakPolarHBondContact OD1-CB 3.46Å; N88-K221 HydrophobicContact CB-CG 4.24Å; N88-K221 PolarHBondContact OD1-N 3.01Å; N88-G224 PolarHBondContact ND2-O 3.02Å; N88-R225 PolarHBondContact N-O 3.16Å
89	E	93.9	Very high	96.9	Very high	134 Å²	134	43.6 Å²	43.6	63%	0.626	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-42.5	179.3	-178	172.2	-172.2	0	0	111.9	S87 R225	S87-E89 PolarHBondContact O-N 3.37Å; S87-E89 PolarHBondContact OG-N 2.82Å; E89-R225 IonicContact OE1-NH2 3.2Å; E89-R225 IonicContact OE2-CZ 2.86Å; E89-R225 IonicContact OE2-NE 2.77Å; E89-R225 IonicContact OE2-NH2 3.88Å; E89-R225 PolarHBondContact OE2-NH2 3.14Å
90	A	95.3	Very high	96.8	Very high	55 Å²	55	47.5 Å²	47.5	46%	0.455	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-16.8	175.1	0	0	0	0	0	112.6	S87 E92	S87-A90 PolarHBondContact OG-N 3.46Å; A90-E92 HydrophobicContact CB-CB 4.28Å; A90-E92 HydrophobicContact CB-CG 4.42Å; A90-E92 PolarHBondContact O-N 3.41Å
91	E	95.1	Very high	96.6	Very high	76 Å²	76	43.9 Å²	43.9	36%	0.355	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	29.3	-169.2	-56.4	-164.7	166.3	0	0	113.8	Y86 S87 R217 K221	Y86-E91 VanDerWaalsContact CE2-C 3.47Å; Y86-E91 WeakPolarHBondContact CE2-O 3.43Å; Y86-E91 WeakPolarHBondContact OH-CA 3.39Å; S87-E91 VanDerWaalsContact O-CA 3.23Å; S87-E91 WeakPolarHBondContact O-CA 3.32Å; S87-E91 PolarHBondContact O-N 3.21Å; E91-R217 IonicContact OE2-CZ 2.92Å; E91-R217 IonicContact OE2-NH1 2.69Å; E91-R217 PolarHBondContact OE2-NH1 3.3Å; E91-R217 IonicContact OE2-NH2 2.69Å; E91-K221 IonicContact OE1-NZ 3.29Å; E91-K221 PolarHBondContact OE1-NZ 3.24Å
92	E	96.2	Very high	96.5	Very high	93 Å²	93	46 Å²	46	44%	0.435	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	145.1	-175.8	-69.6	-176.7	120.7	0	0	112.9	Y86 S87 A90 V133	Y86-E92 WeakPolarHBondContact CA-O 3.38Å; Y86-E92 WeakPolarHBondContact CD2-O 3.29Å; S87-E92 PolarHBondContact N-O 3.01Å; S87-E92 PolarHBondContact O-N 2.96Å; A90-E92 HydrophobicContact CB-CB 4.28Å; A90-E92 HydrophobicContact CB-CG 4.42Å; A90-E92 PolarHBondContact O-N 3.41Å; E92-V133 WeakPolarHBondContact OE1-CG1 3.35Å
93	F	98.1	Very high	96.5	Very high	13 Å²	13	42.1 Å²	42.1	6%	0.057	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	146.9	166.1	-70.9	-80	0	0	0	110.9	L84 C85 Y86 F130 F132 V133 I155 M194 F229	L84-F93 HydrophobicContact CD1-CB 4.25Å; L84-F93 HydrophobicContact CD1-CD1 4.34Å; L84-F93 HydrophobicContact CD2-CD1 3.76Å; L84-F93 HydrophobicContact CD2-CE1 4.12Å; L84-F93 HydrophobicContact CG-CD1 3.94Å; C85-F93 CarbonylContact O-C 3.48Å; C85-F93 VanDerWaalsContact O-CA 3.27Å; C85-F93 WeakPolarHBondContact O-CA 3.15Å; Y86-F93 AromaticContact CD2-CD1 3.91Å; Y86-F93 HydrophobicContact CD2-CD1 3.91Å; Y86-F93 HydrophobicContact CD2-CD2 4.14Å; Y86-F93 AromaticContact CD2-CE1 3.93Å; Y86-F93 HydrophobicContact CD2-CE1 3.93Å; Y86-F93 HydrophobicContact CD2-CE2 4.16Å; Y86-F93 HydrophobicContact CD2-CG 4.03Å; Y86-F93 HydrophobicContact CD2-CZ 4.06Å; Y86-F93 HydrophobicContact CE2-CE2 4.43Å; Y86-F93 HydrophobicContact CG-CD1 4.41Å; Y86-F93 HydrophobicContact CG-CE1 4.29Å; F93-F130 HydrophobicContact CB-CE2 4.25Å; F93-F130 HydrophobicContact CB-CZ 4.34Å; F93-F130 HydrophobicContact CD1-CE2 4.24Å; F93-F130 HydrophobicContact CD2-CD2 4.01Å; F93-F130 AromaticContact CD2-CE2 3.38Å; F93-F130 HydrophobicContact CD2-CE2 3.38Å; F93-F130 HydrophobicContact CD2-CZ 4.28Å; F93-F130 HydrophobicContact CE1-CE2 4.47Å; F93-F130 HydrophobicContact CE2-CD2 4.1Å; F93-F130 AromaticContact CE2-CE2 3.66Å; F93-F130 HydrophobicContact CE2-CE2 3.66Å; F93-F130 AromaticContact CG-CE2 3.7Å; F93-F130 HydrophobicContact CG-CE2 3.7Å; F93-F130 HydrophobicContact CG-CZ 4.19Å; F93-F130 HydrophobicContact CZ-CE2 4.2Å; F93-F132 HydrophobicContact CB-CB 3.83Å; F93-F132 CarbonylContact O-C 3.56Å; F93-F132 WeakPolarHBondContact O-CA 3.37Å; F93-F132 WeakPolarHBondContact O-CB 3.28Å; F93-V133 WeakPolarHBondContact O-CG2 3.31Å; F93-V133 PolarHBondContact O-N 3.18Å; F93-I155 HydrophobicContact CE1-CD1 3.78Å; F93-I155 HydrophobicContact CZ-CD1 4Å; F93-I155 HydrophobicContact CZ-CG2 3.93Å; F93-M194 HydrophobicContact CE2-CE 4.02Å; F93-M194 HydrophobicContact CE2-CG 4.26Å; F93-M194 HydrophobicContact CZ-CE 3.73Å; F93-M194 HydrophobicContact CZ-CG 4.02Å; F93-M194 HydrophobicContact CZ-SD 4.18Å; F93-F229 HydrophobicContact CE1-CE2 4.16Å
94	I	98.4	Very high	96.4	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	126.3	-175.9	-51.6	177.6	0	0	0	109.2	C85 F96 V133 L135 M143 L226	C85-I94 HydrophobicContact CB-CB 4.35Å; C85-I94 PolarHBondContact N-O 3Å; C85-I94 VanDerWaalsContact N-O 3.13Å; C85-I94 PolarHBondContact O-N 2.66Å; I94-F96 HydrophobicContact CB-CE2 4.31Å; I94-F96 HydrophobicContact CB-CZ 4.47Å; I94-F96 HydrophobicContact CG2-CD1 4.22Å; I94-F96 HydrophobicContact CG2-CD2 4.1Å; I94-F96 HydrophobicContact CG2-CE1 3.87Å; I94-F96 HydrophobicContact CG2-CE2 3.75Å; I94-F96 HydrophobicContact CG2-CG 4.34Å; I94-F96 HydrophobicContact CG2-CZ 3.63Å; I94-V133 WeakPolarHBondContact CA-O 3.42Å; I94-V133 HydrophobicContact CB-CG2 4.26Å; I94-V133 HydrophobicContact CG1-CG2 3.77Å; I94-V133 HydrophobicContact CG2-CG2 4.29Å; I94-L135 HydrophobicContact CD1-CD1 4.43Å; I94-L135 HydrophobicContact CG2-CB 4.26Å; I94-L135 HydrophobicContact CG2-CD1 3.8Å; I94-L135 HydrophobicContact CG2-CG 4.09Å; I94-M143 HydrophobicContact CD1-CE 4.06Å; I94-M143 HydrophobicContact CD1-SD 4.35Å; I94-L226 HydrophobicContact CD1-CD1 4.1Å
95	F	98.1	Very high	96.1	Very high	1 Å²	1	47.7 Å²	47.7	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.2	166.9	-174	-76.6	0	0	0	109	T65 M67 F81 H97 V102 M103 F132 V133 E134 L135	T65-F95 HydrophobicContact CG2-CD2 3.38Å; T65-F95 HydrophobicContact CG2-CE2 3.58Å; T65-F95 HydrophobicContact CG2-CG 4.03Å; T65-F95 HydrophobicContact CG2-CZ 4.37Å; T65-F95 WeakPolarHBondContact O-CZ 3.45Å; M67-F95 HydrophobicContact CB-CD2 4.45Å; M67-F95 HydrophobicContact CB-CE2 3.8Å; F81-F95 HydrophobicContact CD1-CD2 4.46Å; F81-F95 HydrophobicContact CE1-CD2 4.25Å; F95-H97 AromaticContact CD1-CE1 3.9Å; F95-H97 AromaticContact CD1-NE2 3.87Å; F95-H97 AromaticContact CE1-CE1 3.66Å; F95-H97 AromaticContact CE1-ND1 3.75Å; F95-V102 WeakPolarHBondContact CZ-O 3.23Å; F95-M103 HydrophobicContact CD1-CE 4.07Å; F95-M103 HydrophobicContact CD2-CE 4.28Å; F95-M103 HydrophobicContact CE1-CE 3.98Å; F95-M103 HydrophobicContact CE2-CE 4.18Å; F95-M103 HydrophobicContact CG-CE 4.24Å; F95-M103 HydrophobicContact CZ-CB 4.35Å; F95-M103 HydrophobicContact CZ-CE 4.03Å; F95-F132 HydrophobicContact CB-CD2 3.35Å; F95-F132 HydrophobicContact CB-CE2 3.55Å; F95-F132 HydrophobicContact CB-CG 4.03Å; F95-F132 HydrophobicContact CB-CZ 4.35Å; F95-F132 HydrophobicContact CD2-CE2 4.24Å; F95-F132 HydrophobicContact CD2-CZ 4.28Å; F95-F132 HydrophobicContact CG-CD2 4.26Å; F95-F132 AromaticContact CG-CE2 3.97Å; F95-F132 HydrophobicContact CG-CE2 3.97Å; F95-F132 HydrophobicContact CG-CZ 4.46Å; F95-V133 PolarHBondContact N-O 3.15Å; F95-E134 HydrophobicContact CB-CG 4.41Å; F95-E134 WeakPolarHBondContact O-CA 3.41Å; F95-L135 PolarHBondContact O-N 3.28Å
96	F	98.2	Very high	95.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	127.4	176.8	-72.5	-70.8	0	0	0	111.5	L60 G64 T65 C85 I94 L135 A137 L140 M143	L60-F96 HydrophobicContact CD1-CB 4.23Å; L60-F96 HydrophobicContact CD1-CD2 3.89Å; L60-F96 HydrophobicContact CD1-CG 4.43Å; L60-F96 HydrophobicContact CD2-CD2 4.43Å; L60-F96 HydrophobicContact CG-CD2 4.47Å; G64-F96 CarbonylContact C-O 3.45Å; G64-F96 VanDerWaalsContact CA-O 3.32Å; G64-F96 WeakPolarHBondContact CA-O 3.43Å; T65-F96 PolarHBondContact N-O 2.84Å; T65-F96 PolarHBondContact OG1-N 3.21Å; C85-F96 HydrophobicContact CB-CD2 4.49Å; C85-F96 HydrophobicContact CB-CE2 3.92Å; I94-F96 HydrophobicContact CB-CE2 4.31Å; I94-F96 HydrophobicContact CB-CZ 4.47Å; I94-F96 HydrophobicContact CG2-CD1 4.22Å; I94-F96 HydrophobicContact CG2-CD2 4.1Å; I94-F96 HydrophobicContact CG2-CE1 3.87Å; I94-F96 HydrophobicContact CG2-CE2 3.75Å; I94-F96 HydrophobicContact CG2-CG 4.34Å; I94-F96 HydrophobicContact CG2-CZ 3.63Å; F96-L135 CarbonylContact C-O 3.43Å; F96-L135 VanDerWaalsContact CA-O 3.26Å; F96-L135 WeakPolarHBondContact CA-O 3.41Å; F96-L135 HydrophobicContact CD1-CB 3.89Å; F96-L135 HydrophobicContact CE1-CB 3.86Å; F96-L135 HydrophobicContact CE1-CD1 4.08Å; F96-A137 HydrophobicContact CB-CB 4.24Å; F96-L140 HydrophobicContact CD1-CD1 4.37Å; F96-L140 HydrophobicContact CD1-CG 4.18Å; F96-L140 HydrophobicContact CD2-CD1 4.25Å; F96-L140 HydrophobicContact CD2-CD2 4.36Å; F96-L140 HydrophobicContact CD2-CG 4.41Å; F96-L140 HydrophobicContact CE1-CD1 4.44Å; F96-L140 HydrophobicContact CE1-CD2 4.09Å; F96-L140 HydrophobicContact CE1-CG 3.78Å; F96-L140 HydrophobicContact CE2-CD1 4.32Å; F96-L140 HydrophobicContact CE2-CD2 3.62Å; F96-L140 HydrophobicContact CE2-CG 4.03Å; F96-L140 HydrophobicContact CG-CD1 4.27Å; F96-L140 HydrophobicContact CG-CG 4.47Å; F96-L140 HydrophobicContact CZ-CD1 4.4Å; F96-L140 HydrophobicContact CZ-CD2 3.46Å; F96-L140 VanDerWaalsContact CZ-CD2 3.46Å; F96-L140 HydrophobicContact CZ-CG 3.7Å; F96-M143 HydrophobicContact CE1-SD 4.2Å; F96-M143 HydrophobicContact CZ-SD 3.8Å
97	H	97.7	Very high	95.2	Very high	74 Å²	74	53.6 Å²	53.6	34%	0.343	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	116.3	172.7	-72.9	-76	0	0	0	110.5	F95 E134 L135 A137	F95-H97 AromaticContact CD1-CE1 3.9Å; F95-H97 AromaticContact CD1-NE2 3.87Å; F95-H97 AromaticContact CE1-CE1 3.66Å; F95-H97 AromaticContact CE1-ND1 3.75Å; H97-E134 IonicContact CD2-OE2 2.71Å; H97-E134 IonicContact CE1-OE2 4Å; H97-E134 PolarHBondContact CE1-OE2 2.8Å; H97-E134 VanDerWaalsContact CE1-OE2 3.29Å; H97-E134 IonicContact NE2-OE2 3.8Å; H97-E134 PolarHBondContact NE2-OE2 2.99Å; H97-L135 PolarHBondContact N-O 2.91Å; H97-A137 VanDerWaalsContact O-CB 3.32Å; H97-A137 WeakPolarHBondContact O-CB 3.36Å; H97-A137 PolarHBondContact O-N 3.35Å
98	G	95.7	Very high	94.9	Very high	20 Å²	20	54.4 Å²	54.4	21%	0.206	31%	0.308	C	S	.	.			trans	-124.9	-174.2	176.5	0	0	0	0	0	111.1	T100 S101	G98-T100 PolarHBondContact O-N 3.11Å; G98-S101 PolarHBondContact N-OG 3.4Å; G98-S101 PolarHBondContact O-N 3.15Å; G98-S101 PolarHBondContact O-OG 2.91Å; G98-S101 VanDerWaalsContact O-OG 3.04Å
99	N	94.1	Very high	94.7	Very high	157 Å²	157	57.7 Å²	57.7	84%	0.84	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-25.1	-176	-68.2	-9.2	0	0	0	113	E62	E62-N99 PolarHBondContact O-N 2.84Å
100	T	94.1	Very high	94.5	Very high	82 Å²	82	58.8 Å²	58.8	50%	0.503	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	13.4	-177	64.3	0	0	0	0	112.9	G63 H66 G98 V102	G63-T100 WeakPolarHBondContact CA-OG1 3.49Å; G63-T100 CarbonylContact O-C 3.56Å; G63-T100 PolarHBondContact O-OG1 2.87Å; H66-T100 PolarHBondContact CE1-O 3.4Å; H66-T100 PolarHBondContact NE2-O 3.14Å; G98-T100 PolarHBondContact O-N 3.11Å; T100-V102 PolarHBondContact O-N 3.43Å
101	S	95.3	Very high	94.4	Very high	34 Å²	34	57.2 Å²	57.2	24%	0.238	31%	0.312	C	S	.	.			trans	-62.5	138.9	-177.5	52.2	0	0	0	0	110.5	G63 T65 G98	G63-S101 WeakPolarHBondContact O-CA 3.44Å; G63-S101 PolarHBondContact O-N 3.3Å; T65-S101 WeakPolarHBondContact O-CA 3.38Å; T65-S101 WeakPolarHBondContact O-CB 3.39Å; G98-S101 PolarHBondContact N-OG 3.4Å; G98-S101 PolarHBondContact O-N 3.15Å; G98-S101 PolarHBondContact O-OG 2.91Å; G98-S101 VanDerWaalsContact O-OG 3.04Å
102	V	95.8	Very high	94.2	Very high	48 Å²	48	58.7 Å²	58.7	29%	0.291	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	134	-176.9	174.9	0	0	0	0	109.1	T65 H66 M67 F95 T100 L104	T65-V102 PolarHBondContact O-N 2.87Å; H66-V102 CarbonylContact C-O 3.53Å; H66-V102 WeakPolarHBondContact CA-O 3.36Å; H66-V102 HydrophobicContact CB-CB 4.32Å; H66-V102 WeakPolarHBondContact ND1-CG2 3.35Å; M67-V102 PolarHBondContact N-O 2.79Å; F95-V102 WeakPolarHBondContact CZ-O 3.23Å; T100-V102 PolarHBondContact O-N 3.43Å; V102-L104 HydrophobicContact CG1-CB 4.44Å; V102-L104 HydrophobicContact CG1-CD1 3.6Å; V102-L104 HydrophobicContact CG1-CG 3.62Å
103	M	95.6	Very high	93.8	Very high	23 Å²	23	61.1 Å²	61.1	11%	0.113	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	101	172.6	-169.1	-175.8	-68.3	0	0	109.2	M67 F95 P105 N106 F132	M67-M103 HydrophobicContact CE-CB 4.47Å; M67-M103 HydrophobicContact CE-CG 3.29Å; M67-M103 HydrophobicContact CE-SD 4.26Å; M67-M103 HydrophobicContact SD-CG 4.37Å; F95-M103 HydrophobicContact CD1-CE 4.07Å; F95-M103 HydrophobicContact CD2-CE 4.28Å; F95-M103 HydrophobicContact CE1-CE 3.98Å; F95-M103 HydrophobicContact CE2-CE 4.18Å; F95-M103 HydrophobicContact CG-CE 4.24Å; F95-M103 HydrophobicContact CZ-CB 4.35Å; F95-M103 HydrophobicContact CZ-CE 4.03Å; M103-P105 CarbonylContact O-C 3.59Å; M103-N106 HydrophobicContact CB-CB 4.43Å; M103-N106 HydrophobicContact CG-CB 4.35Å; M103-N106 PolarHBondContact O-N 3.48Å; M103-N106 VanDerWaalsContact O-N 3.12Å; M103-N106 HydrophobicContact SD-CB 4.31Å; M103-F132 HydrophobicContact CE-CE2 3.86Å; M103-F132 HydrophobicContact CE-CZ 3.82Å; M103-F132 HydrophobicContact SD-CZ 4.48Å
104	L	94.6	Very high	93.3	Very high	100 Å²	100	63.4 Å²	63.4	52%	0.524	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	117.3	-175.7	-65.4	174.8	0	0	0	111.1	M67 V68 C69 V102	M67-L104 PolarHBondContact O-N 3.25Å; V68-L104 CarbonylContact C-O 3.58Å; V68-L104 WeakPolarHBondContact CA-O 3.41Å; C69-L104 PolarHBondContact N-O 3.09Å; V102-L104 HydrophobicContact CG1-CB 4.44Å; V102-L104 HydrophobicContact CG1-CD1 3.6Å; V102-L104 HydrophobicContact CG1-CG 3.62Å
105	P	92.8	Very high	93	Very high	53 Å²	53	63.4 Å²	63.4	34%	0.344	35%	0.346	S	S	.	.	S	Bend	cis	-69.7	148.6	-11	31.6	-33.3	0	0	0	111.2	M103 L107	M103-P105 CarbonylContact O-C 3.59Å; P105-L107 HydrophobicContact CB-CD2 4.01Å; P105-L107 HydrophobicContact CB-CG 4.46Å; P105-L107 HydrophobicContact CG-CD2 3.87Å; P105-L107 HydrophobicContact CG-CG 4.11Å; P105-L107 PolarHBondContact O-N 2.91Å
106	N	90.9	Very high	92.8	Very high	102 Å²	102	63.5 Å²	63.5	55%	0.545	35%	0.347	S	S	.	.			trans	-84	108.5	163.7	-173.9	-11.9	0	0	0	108.5	M103 G108	M103-N106 HydrophobicContact CB-CB 4.43Å; M103-N106 HydrophobicContact CG-CB 4.35Å; M103-N106 PolarHBondContact O-N 3.48Å; M103-N106 VanDerWaalsContact O-N 3.12Å; M103-N106 HydrophobicContact SD-CB 4.31Å; N106-G108 PolarHBondContact OD1-N 3.41Å
107	L	87.3	Confident	92.7	Very high	24 Å²	24	63.5 Å²	63.5	13%	0.126	35%	0.347	C	S	.	.			trans	-89.2	-11	-177.6	-62.9	-179.9	0	0	0	113.2	P105 S109 R110 R111 L116	P105-L107 HydrophobicContact CB-CD2 4.01Å; P105-L107 HydrophobicContact CB-CG 4.46Å; P105-L107 HydrophobicContact CG-CD2 3.87Å; P105-L107 HydrophobicContact CG-CG 4.11Å; P105-L107 PolarHBondContact O-N 2.91Å; L107-S109 PolarHBondContact O-N 3.44Å; L107-R110 HydrophobicContact CB-CB 4.25Å; L107-R110 VanDerWaalsContact O-CB 3.27Å; L107-R110 WeakPolarHBondContact O-CB 3.36Å; L107-R110 PolarHBondContact O-N 3.4Å; L107-R110 VanDerWaalsContact O-N 3.09Å; L107-R110 PolarHBondContact O-NE 2.8Å; L107-R111 HydrophobicContact CB-CB 4.23Å; L107-L116 HydrophobicContact CD1-CD1 3.77Å
108	G	90.2	Very high	92.5	Very high	35 Å²	35	60.2 Å²	60.2	36%	0.361	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	52.6	-135.2	-170.5	0	0	0	0	0	111	N106 R110 R111	N106-G108 PolarHBondContact OD1-N 3.41Å; G108-R110 PolarHBondContact O-N 2.9Å; G108-R111 WeakPolarHBondContact O-CD 3.4Å; G108-R111 VanDerWaalsContact O-CG 3.22Å; G108-R111 WeakPolarHBondContact O-CG 3.05Å; G108-R111 PolarHBondContact O-N 2.85Å
109	S	91.3	Very high	92.5	Very high	82 Å²	82	59.6 Å²	59.6	57%	0.573	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-64.2	-17.7	177.7	56.9	0	0	0	0	114.4	L107 R111 F112	L107-S109 PolarHBondContact O-N 3.44Å; S109-R111 PolarHBondContact O-N 3.49Å; S109-R111 VanDerWaalsContact O-N 3.12Å; S109-F112 WeakPolarHBondContact O-CD2 3.38Å; S109-F112 PolarHBondContact O-N 3.2Å
110	R	90.3	Very high	92.5	Very high	157 Å²	157	52.1 Å²	52.1	59%	0.592	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-64.7	-16	177.2	-60.5	-176.7	-69.4	176	-3.8	112.8	L107 G108 F112 Q113	L107-R110 HydrophobicContact CB-CB 4.25Å; L107-R110 VanDerWaalsContact O-CB 3.27Å; L107-R110 WeakPolarHBondContact O-CB 3.36Å; L107-R110 PolarHBondContact O-N 3.4Å; L107-R110 VanDerWaalsContact O-N 3.09Å; L107-R110 PolarHBondContact O-NE 2.8Å; G108-R110 PolarHBondContact O-N 2.9Å; R110-F112 PolarHBondContact O-N 2.95Å; R110-F112 VanDerWaalsContact O-N 3.14Å; R110-Q113 PolarHBondContact O-N 3.27Å; R110-Q113 VanDerWaalsContact O-N 3.11Å
111	R	92	Very high	92.4	Very high	22 Å²	22	48.3 Å²	48.3	8%	0.083	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-66.5	-5.1	171.9	80.1	-169.1	176.2	92.2	-11.9	113.9	L107 G108 S109 A115 L116 N131 F132 E134	L107-R111 HydrophobicContact CB-CB 4.23Å; G108-R111 WeakPolarHBondContact O-CD 3.4Å; G108-R111 VanDerWaalsContact O-CG 3.22Å; G108-R111 WeakPolarHBondContact O-CG 3.05Å; G108-R111 PolarHBondContact O-N 2.85Å; S109-R111 PolarHBondContact O-N 3.49Å; S109-R111 VanDerWaalsContact O-N 3.12Å; R111-A115 CarbonylContact O-C 3.48Å; R111-A115 WeakPolarHBondContact O-CA 3.37Å; R111-L116 HydrophobicContact CB-CB 4.21Å; R111-L116 HydrophobicContact CB-CD1 4.38Å; R111-L116 PolarHBondContact O-N 3.33Å; R111-N131 PolarHBondContact NH1-OD1 2.66Å; R111-F132 PolarHBondContact NH1-O 2.86Å; R111-F132 PolarHBondContact NH2-O 2.82Å; R111-E134 IonicContact CZ-OE1 3.59Å; R111-E134 IonicContact NE-OE1 3.41Å; R111-E134 PolarHBondContact NE-OE1 2.76Å; R111-E134 IonicContact NH2-OE1 2.75Å; R111-E134 PolarHBondContact NH2-OE1 2.89Å
112	F	91.3	Very high	92.1	Very high	107 Å²	107	47.1 Å²	47.1	47%	0.469	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-111.8	13.3	174.3	-47.4	-63.3	0	0	0	112.6	S109 R110 P114	S109-F112 WeakPolarHBondContact O-CD2 3.38Å; S109-F112 PolarHBondContact O-N 3.2Å; R110-F112 PolarHBondContact O-N 2.95Å; R110-F112 VanDerWaalsContact O-N 3.14Å; F112-P114 CarbonylContact C-O 3.52Å; F112-P114 VanDerWaalsContact C-O 3.24Å; F112-P114 CarbonylContact O-C 2.97Å
113	Q	89.1	Confident	91.2	Very high	145 Å²	145	48.3 Å²	48.3	68%	0.678	25%	0.254	S	S	*	.	S	Bend	trans	-130.1	83.6	-175.6	-65.5	-178.2	5.4	0	0	111.5	R110	R110-Q113 PolarHBondContact O-N 3.27Å; R110-Q113 VanDerWaalsContact O-N 3.11Å
114	P	87.5	Confident	89.8	Confident	60 Å²	60	51.6 Å²	51.6	39%	0.39	27%	0.272	S	S	.	.	S	Bend	cis	-80	-24.4	-10.1	32.4	-34.1	0	0	0	112.9	H74 F112 Y129	H74-P114 WeakPolarHBondContact CE1-CG 3.4Å; H74-P114 WeakPolarHBondContact ND1-CD 3.46Å; H74-P114 WeakPolarHBondContact ND1-CG 3.3Å; F112-P114 CarbonylContact C-O 3.52Å; F112-P114 VanDerWaalsContact C-O 3.24Å; F112-P114 CarbonylContact O-C 2.97Å; P114-Y129 HydrophobicContact CB-CE2 4.15Å
115	A	92.3	Very high	88.6	Confident	6 Å²	6	49 Å²	49	5%	0.05	26%	0.257	C	S	.	.			trans	-159	171.6	-175.8	0	0	0	0	0	112.5	H74 R111 Y129	H74-A115 HydrophobicContact CB-CB 4.48Å; H74-A115 WeakPolarHBondContact CB-O 3.29Å; R111-A115 CarbonylContact O-C 3.48Å; R111-A115 WeakPolarHBondContact O-CA 3.37Å; A115-Y129 HydrophobicContact CB-CD1 3.53Å; A115-Y129 HydrophobicContact CB-CD2 3.69Å; A115-Y129 HydrophobicContact CB-CE1 4.03Å; A115-Y129 HydrophobicContact CB-CE2 4.15Å; A115-Y129 HydrophobicContact CB-CG 3.35Å
116	L	93.7	Very high	87.3	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	27%	0.271	C	S	.	.	S	Bend	trans	-71.8	-52.8	168.9	179.2	60.2	0	0	0	109.9	M67 R77 L107 R111 F130 F132	M67-L116 HydrophobicContact SD-CD2 4.06Å; R77-L116 WeakPolarHBondContact CD-O 3.39Å; R77-L116 PolarHBondContact NH1-O 3.41Å; L107-L116 HydrophobicContact CD1-CD1 3.77Å; R111-L116 HydrophobicContact CB-CB 4.21Å; R111-L116 HydrophobicContact CB-CD1 4.38Å; R111-L116 PolarHBondContact O-N 3.33Å; L116-F130 HydrophobicContact CD2-CD1 4.06Å; L116-F130 HydrophobicContact CD2-CE1 4.21Å; L116-F132 HydrophobicContact CD2-CD1 4.21Å; L116-F132 HydrophobicContact CD2-CE1 3.53Å; L116-F132 HydrophobicContact CD2-CZ 4.4Å
117	L	94.8	Very high	86.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	166.7	176.2	64.7	84.8	0	0	0	111.3	H74 R77 C79 L119 F130 V234	H74-L117 VanDerWaalsContact O-CA 3.26Å; H74-L117 WeakPolarHBondContact O-CA 3.29Å; R77-L117 HydrophobicContact CB-CB 4.07Å; R77-L117 HydrophobicContact CG-CB 4.3Å; R77-L117 WeakPolarHBondContact O-CB 3.44Å; C79-L117 HydrophobicContact CB-CD2 3.72Å; C79-L117 WeakPolarHBondContact SG-CD2 3.4Å; L117-L119 HydrophobicContact CD1-CD2 4.2Å; L117-F130 HydrophobicContact CD1-CB 3.46Å; L117-F130 VanDerWaalsContact CD1-CB 3.46Å; L117-F130 HydrophobicContact CD1-CD1 4.44Å; L117-F130 HydrophobicContact CD1-CG 4.18Å; L117-F130 HydrophobicContact CD2-CD1 4.22Å; L117-F130 HydrophobicContact CG-CB 3.79Å; L117-F130 HydrophobicContact CG-CD1 4.14Å; L117-F130 HydrophobicContact CG-CG 4.34Å; L117-F130 PolarHBondContact O-N 3.29Å; L117-V234 HydrophobicContact CD1-CG1 4.1Å; L117-V234 HydrophobicContact CD2-CB 4.43Å; L117-V234 HydrophobicContact CD2-CG1 4.39Å; L117-V234 WeakPolarHBondContact CD2-O 3.19Å
118	D	94.4	Very high	86.1	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.027	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	134.7	172.7	-59.6	-29.5	0	0	0	112	H74 T75 S120 Y129 G235 K238	H74-D118 IonicContact CD2-OD1 3.29Å; H74-D118 PolarHBondContact CD2-OD1 2.97Å; H74-D118 IonicContact CD2-OD2 2.69Å; H74-D118 PolarHBondContact O-N 2.77Å; T75-D118 WeakPolarHBondContact CA-OD2 3.46Å; D118-S120 WeakPolarHBondContact CB-O 3.21Å; D118-Y129 WeakPolarHBondContact OD1-CD1 3.34Å; D118-Y129 WeakPolarHBondContact OD1-CE1 3.31Å; D118-G235 WeakPolarHBondContact O-CA 3.21Å; D118-K238 WeakPolarHBondContact OD2-CE 3.44Å; D118-K238 IonicContact OD2-NZ 3.52Å; D118-K238 PolarHBondContact OD2-NZ 2.8Å
119	L	95.4	Very high	86.2	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.042	26%	0.262	C	S	.	.	S	Bend	trans	-82.9	-15.4	171.4	-68.3	175.1	0	0	0	112.6	L117 Q128 F130 I155 A156 N157 V234	L117-L119 HydrophobicContact CD1-CD2 4.2Å; L119-Q128 WeakPolarHBondContact CB-O 3.27Å; L119-Q128 PolarHBondContact N-O 2.91Å; L119-F130 HydrophobicContact CD1-CB 4.2Å; L119-F130 HydrophobicContact CD1-CD2 4.41Å; L119-F130 HydrophobicContact CD2-CB 3.8Å; L119-F130 HydrophobicContact CD2-CD2 4Å; L119-F130 HydrophobicContact CD2-CG 4.24Å; L119-F130 HydrophobicContact CG-CB 3.78Å; L119-I155 HydrophobicContact CD2-CG2 4.33Å; L119-A156 CarbonylContact O-C 3.53Å; L119-A156 WeakPolarHBondContact O-CA 2.99Å; L119-N157 HydrophobicContact CB-CB 3.83Å; L119-N157 PolarHBondContact O-N 3.41Å; L119-V234 HydrophobicContact CD2-CG1 3.66Å
120	S	94.4	Very high	86.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.235	C	C	.	.	S	Bend	trans	-124	160.2	178.8	178	0	0	0	0	110.8	D118 V122 F159 K238	D118-S120 WeakPolarHBondContact CB-O 3.21Å; S120-V122 VanDerWaalsContact C-N 3.33Å; S120-F159 WeakPolarHBondContact OG-CB 3.32Å; S120-K238 WeakPolarHBondContact O-CE 3.4Å; S120-K238 PolarHBondContact O-NZ 2.6Å
121	T	92.4	Very high	86.4	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.012	23%	0.225	C	C	.	.	S	Bend	trans	-81.2	-10.2	177.7	61	0	0	0	0	114.8	E123 D170 P174 L236 K238 T241	T121-E123 PolarHBondContact O-N 2.88Å; T121-D170 WeakPolarHBondContact OG1-CA 3.5Å; T121-D170 WeakPolarHBondContact OG1-CB 3.43Å; T121-D170 PolarHBondContact OG1-O 2.82Å; T121-D170 PolarHBondContact OG1-OD1 3.45Å; T121-P174 HydrophobicContact CG2-CB 3.33Å; T121-P174 HydrophobicContact CG2-CG 3.35Å; T121-L236 HydrophobicContact CG2-CB 3.96Å; T121-L236 HydrophobicContact CG2-CD1 4.17Å; T121-K238 HydrophobicContact CG2-CG 4.02Å; T121-K238 WeakPolarHBondContact O-CD 3.37Å; T121-K238 PolarHBondContact O-NZ 3.49Å; T121-T241 HydrophobicContact CG2-CG2 4.39Å
122	V	87.8	Confident	86.7	Confident	8 Å²	8	43.4 Å²	43.4	5%	0.048	22%	0.222	C	C	.	.	S	Bend	trans	-72.7	125	173.2	180	0	0	0	0	109.1	S120 H125 F159 D170 K238 Y245 F247	S120-V122 VanDerWaalsContact C-N 3.33Å; V122-H125 HydrophobicContact CG1-CB 4.35Å; V122-F159 HydrophobicContact CB-CD2 3.65Å; V122-F159 HydrophobicContact CB-CE2 3.75Å; V122-F159 HydrophobicContact CB-CG 4.09Å; V122-F159 HydrophobicContact CB-CZ 4.26Å; V122-F159 HydrophobicContact CG1-CD2 4.23Å; V122-F159 HydrophobicContact CG1-CE2 3.79Å; V122-F159 HydrophobicContact CG1-CZ 4.02Å; V122-F159 HydrophobicContact CG2-CB 4.09Å; V122-F159 HydrophobicContact CG2-CD1 3.5Å; V122-F159 VanDerWaalsContact CG2-CD1 3.5Å; V122-F159 HydrophobicContact CG2-CD2 3.41Å; V122-F159 VanDerWaalsContact CG2-CD2 3.41Å; V122-F159 HydrophobicContact CG2-CE1 3.79Å; V122-F159 HydrophobicContact CG2-CE2 3.72Å; V122-F159 HydrophobicContact CG2-CG 3.3Å; V122-F159 HydrophobicContact CG2-CZ 3.9Å; V122-D170 HydrophobicContact CG2-CB 4.3Å; V122-K238 PolarHBondContact O-NZ 3.18Å; V122-Y245 HydrophobicContact CG2-CD2 4.46Å; V122-Y245 HydrophobicContact CG2-CE2 4.17Å; V122-F247 HydrophobicContact CG1-CD2 4.07Å; V122-F247 HydrophobicContact CG1-CE2 3.64Å
123	E	77.9	Confident	86.9	Confident	73 Å²	73	40.3 Å²	40.3	34%	0.341	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	149.9	-179.4	-70.6	170.6	-164.5	0	0	110.9	T75 T121 H125 K238 K254	T75-E123 HydrophobicContact CG2-CG 3.65Å; T121-E123 PolarHBondContact O-N 2.88Å; E123-H125 PolarHBondContact O-N 3.24Å; E123-H125 VanDerWaalsContact O-N 3.11Å; E123-K238 HydrophobicContact CG-CD 4.11Å; E123-K254 IonicContact OE1-NZ 2.84Å; E123-K254 PolarHBondContact OE1-NZ 3.33Å
124	D	65.7	Low	87.3	Confident	92 Å²	92	37 Å²	37	49%	0.492	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	27.8	172.5	-57.9	-39.5	0	0	0	115.6	V248	D124-V248 HydrophobicContact CB-CG2 4.45Å
125	H	69.6	Low	87.8	Confident	47 Å²	47	36.4 Å²	36.4	22%	0.218	19%	0.189	C	C	.	.			trans	-100.2	98	172.4	-157.9	-70.3	0	0	0	110.4	V122 E123 T127 Q128 F159 F247	V122-H125 HydrophobicContact CG1-CB 4.35Å; E123-H125 PolarHBondContact O-N 3.24Å; E123-H125 VanDerWaalsContact O-N 3.11Å; H125-T127 PolarHBondContact CE1-OG1 3.43Å; H125-T127 PolarHBondContact ND1-OG1 3.43Å; H125-T127 PolarHBondContact O-N 2.94Å; H125-Q128 HydrophobicContact CB-CG 4.11Å; H125-Q128 WeakPolarHBondContact O-CB 3.23Å; H125-Q128 PolarHBondContact O-N 2.91Å; H125-F159 AromaticContact CD2-CE2 3.94Å; H125-F247 AromaticContact CD2-CE1 3.97Å
126	N	64.6	Low	88	Confident	118 Å²	118	40 Å²	40	63%	0.631	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-57.2	-20.8	-170.5	65.8	-9.8	0	0	0	116	Q128 Y129	N126-Q128 PolarHBondContact O-N 2.95Å; N126-Y129 HydrophobicContact CB-CE2 3.97Å; N126-Y129 WeakPolarHBondContact O-CD2 3.4Å
127	T	69.6	Low	88.2	Confident	89 Å²	89	40 Å²	40	55%	0.546	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-77	-4.4	175.9	70.7	0	0	0	0	113.7	H125	H125-T127 PolarHBondContact CE1-OG1 3.43Å; H125-T127 PolarHBondContact ND1-OG1 3.43Å; H125-T127 PolarHBondContact O-N 2.94Å
128	Q	83.5	Confident	88.2	Confident	11 Å²	11	42.7 Å²	42.7	5%	0.051	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-108.1	14	-172.8	-56.5	-61.6	-18.4	0	0	112.8	L119 H125 N126 N157	L119-Q128 WeakPolarHBondContact CB-O 3.27Å; L119-Q128 PolarHBondContact N-O 2.91Å; H125-Q128 HydrophobicContact CB-CG 4.11Å; H125-Q128 WeakPolarHBondContact O-CB 3.23Å; H125-Q128 PolarHBondContact O-N 2.91Å; N126-Q128 PolarHBondContact O-N 2.95Å; Q128-N157 PolarHBondContact OE1-ND2 2.83Å
129	Y	91.8	Very high	88.3	Confident	62 Å²	62	43.5 Å²	43.5	24%	0.243	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	137.1	-177.9	-62.8	-28.3	0	0	0	112.8	P114 A115 D118 N126	P114-Y129 HydrophobicContact CB-CE2 4.15Å; A115-Y129 HydrophobicContact CB-CD1 3.53Å; A115-Y129 HydrophobicContact CB-CD2 3.69Å; A115-Y129 HydrophobicContact CB-CE1 4.03Å; A115-Y129 HydrophobicContact CB-CE2 4.15Å; A115-Y129 HydrophobicContact CB-CG 3.35Å; D118-Y129 WeakPolarHBondContact OD1-CD1 3.34Å; D118-Y129 WeakPolarHBondContact OD1-CE1 3.31Å; N126-Y129 HydrophobicContact CB-CE2 3.97Å; N126-Y129 WeakPolarHBondContact O-CD2 3.4Å
130	F	94.6	Very high	88.3	Confident	3 Å²	3	43.7 Å²	43.7	1%	0.013	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	135.7	168.9	178.8	-105.2	0	0	0	110.8	F81 L84 F93 L116 L117 L119 F132 V234	F81-F130 AromaticContact CE2-CE1 3.9Å; F81-F130 HydrophobicContact CE2-CE1 3.9Å; F81-F130 HydrophobicContact CE2-CZ 4.17Å; F81-F130 AromaticContact CZ-CE1 3.64Å; F81-F130 HydrophobicContact CZ-CE1 3.64Å; F81-F130 HydrophobicContact CZ-CZ 4.08Å; L84-F130 HydrophobicContact CD2-CZ 4.09Å; F93-F130 HydrophobicContact CB-CE2 4.25Å; F93-F130 HydrophobicContact CB-CZ 4.34Å; F93-F130 HydrophobicContact CD1-CE2 4.24Å; F93-F130 HydrophobicContact CD2-CD2 4.01Å; F93-F130 AromaticContact CD2-CE2 3.38Å; F93-F130 HydrophobicContact CD2-CE2 3.38Å; F93-F130 HydrophobicContact CD2-CZ 4.28Å; F93-F130 HydrophobicContact CE1-CE2 4.47Å; F93-F130 HydrophobicContact CE2-CD2 4.1Å; F93-F130 AromaticContact CE2-CE2 3.66Å; F93-F130 HydrophobicContact CE2-CE2 3.66Å; F93-F130 AromaticContact CG-CE2 3.7Å; F93-F130 HydrophobicContact CG-CE2 3.7Å; F93-F130 HydrophobicContact CG-CZ 4.19Å; F93-F130 HydrophobicContact CZ-CE2 4.2Å; L116-F130 HydrophobicContact CD2-CD1 4.06Å; L116-F130 HydrophobicContact CD2-CE1 4.21Å; L117-F130 HydrophobicContact CD1-CB 3.46Å; L117-F130 VanDerWaalsContact CD1-CB 3.46Å; L117-F130 HydrophobicContact CD1-CD1 4.44Å; L117-F130 HydrophobicContact CD1-CG 4.18Å; L117-F130 HydrophobicContact CD2-CD1 4.22Å; L117-F130 HydrophobicContact CG-CB 3.79Å; L117-F130 HydrophobicContact CG-CD1 4.14Å; L117-F130 HydrophobicContact CG-CG 4.34Å; L117-F130 PolarHBondContact O-N 3.29Å; L119-F130 HydrophobicContact CD1-CB 4.2Å; L119-F130 HydrophobicContact CD1-CD2 4.41Å; L119-F130 HydrophobicContact CD2-CB 3.8Å; L119-F130 HydrophobicContact CD2-CD2 4Å; L119-F130 HydrophobicContact CD2-CG 4.24Å; L119-F130 HydrophobicContact CG-CB 3.78Å; F130-F132 AromaticContact CE1-CD1 3.76Å; F130-F132 HydrophobicContact CE1-CD1 3.76Å; F130-F132 HydrophobicContact CE1-CE1 4.38Å; F130-F132 HydrophobicContact CZ-CD1 4.24Å; F130-V234 HydrophobicContact CB-CG1 4.24Å; F130-V234 HydrophobicContact CD1-CG1 3.89Å; F130-V234 HydrophobicContact CD2-CG1 3.42Å; F130-V234 VanDerWaalsContact CD2-CG1 3.42Å; F130-V234 HydrophobicContact CE1-CG1 4.04Å; F130-V234 HydrophobicContact CE2-CG1 3.57Å; F130-V234 HydrophobicContact CE2-CG2 4.43Å; F130-V234 HydrophobicContact CG-CG1 3.57Å; F130-V234 HydrophobicContact CZ-CG1 3.89Å; F130-V234 HydrophobicContact CZ-CG2 4.29Å
131	N	93.1	Very high	88.3	Confident	70 Å²	70	52.7 Å²	52.7	37%	0.374	28%	0.277	S	S	.	.			trans	-146.2	161.1	173.4	-164.1	21.2	0	0	0	111	R111	R111-N131 PolarHBondContact NH1-OD1 2.66Å
132	F	96.3	Very high	88.4	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.018	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	152.9	171	57.1	-101.7	0	0	0	111.3	M67 F81 F93 F95 M103 R111 L116 F130 E134	M67-F132 HydrophobicContact SD-CE1 3.76Å; M67-F132 HydrophobicContact SD-CZ 4.05Å; F81-F132 HydrophobicContact CE1-CD1 4.2Å; F81-F132 AromaticContact CE1-CE1 3.97Å; F81-F132 HydrophobicContact CE1-CE1 3.97Å; F81-F132 HydrophobicContact CZ-CD1 4.21Å; F81-F132 AromaticContact CZ-CE1 3.99Å; F81-F132 HydrophobicContact CZ-CE1 3.99Å; F93-F132 HydrophobicContact CB-CB 3.83Å; F93-F132 CarbonylContact O-C 3.56Å; F93-F132 WeakPolarHBondContact O-CA 3.37Å; F93-F132 WeakPolarHBondContact O-CB 3.28Å; F95-F132 HydrophobicContact CB-CD2 3.35Å; F95-F132 HydrophobicContact CB-CE2 3.55Å; F95-F132 HydrophobicContact CB-CG 4.03Å; F95-F132 HydrophobicContact CB-CZ 4.35Å; F95-F132 HydrophobicContact CD2-CE2 4.24Å; F95-F132 HydrophobicContact CD2-CZ 4.28Å; F95-F132 HydrophobicContact CG-CD2 4.26Å; F95-F132 AromaticContact CG-CE2 3.97Å; F95-F132 HydrophobicContact CG-CE2 3.97Å; F95-F132 HydrophobicContact CG-CZ 4.46Å; M103-F132 HydrophobicContact CE-CE2 3.86Å; M103-F132 HydrophobicContact CE-CZ 3.82Å; M103-F132 HydrophobicContact SD-CZ 4.48Å; R111-F132 PolarHBondContact NH1-O 2.86Å; R111-F132 PolarHBondContact NH2-O 2.82Å; L116-F132 HydrophobicContact CD2-CD1 4.21Å; L116-F132 HydrophobicContact CD2-CE1 3.53Å; L116-F132 HydrophobicContact CD2-CZ 4.4Å; F130-F132 AromaticContact CE1-CD1 3.76Å; F130-F132 HydrophobicContact CE1-CD1 3.76Å; F130-F132 HydrophobicContact CE1-CE1 4.38Å; F130-F132 HydrophobicContact CZ-CD1 4.24Å; F132-E134 HydrophobicContact CD2-CG 3.89Å; F132-E134 HydrophobicContact CE2-CG 3.67Å
133	V	96.9	Very high	88.8	Confident	42 Å²	42	63.8 Å²	63.8	26%	0.255	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	152.1	166	-59.5	0	0	0	0	110	E92 F93 I94 F95	E92-V133 WeakPolarHBondContact OE1-CG1 3.35Å; F93-V133 WeakPolarHBondContact O-CG2 3.31Å; F93-V133 PolarHBondContact O-N 3.18Å; I94-V133 WeakPolarHBondContact CA-O 3.42Å; I94-V133 HydrophobicContact CB-CG2 4.26Å; I94-V133 HydrophobicContact CG1-CG2 3.77Å; I94-V133 HydrophobicContact CG2-CG2 4.29Å; F95-V133 PolarHBondContact N-O 3.15Å
134	E	96.6	Very high	89.6	Confident	74 Å²	74	62.7 Å²	62.7	35%	0.346	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.5	-178.6	-68.3	178.1	-106.8	0	0	109.3	F95 H97 R111 F132	F95-E134 HydrophobicContact CB-CG 4.41Å; F95-E134 WeakPolarHBondContact O-CA 3.41Å; H97-E134 IonicContact CD2-OE2 2.71Å; H97-E134 IonicContact CE1-OE2 4Å; H97-E134 PolarHBondContact CE1-OE2 2.8Å; H97-E134 VanDerWaalsContact CE1-OE2 3.29Å; H97-E134 IonicContact NE2-OE2 3.8Å; H97-E134 PolarHBondContact NE2-OE2 2.99Å; R111-E134 IonicContact CZ-OE1 3.59Å; R111-E134 IonicContact NE-OE1 3.41Å; R111-E134 PolarHBondContact NE-OE1 2.76Å; R111-E134 IonicContact NH2-OE1 2.75Å; R111-E134 PolarHBondContact NH2-OE1 2.89Å; F132-E134 HydrophobicContact CD2-CG 3.89Å; F132-E134 HydrophobicContact CE2-CG 3.67Å
135	L	97.5	Very high	91	Very high	49 Å²	49	66.6 Å²	66.6	26%	0.257	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	149.3	179.3	-65.9	179.5	0	0	0	110.5	I94 F95 F96 H97 A139 M143	I94-L135 HydrophobicContact CD1-CD1 4.43Å; I94-L135 HydrophobicContact CG2-CB 4.26Å; I94-L135 HydrophobicContact CG2-CD1 3.8Å; I94-L135 HydrophobicContact CG2-CG 4.09Å; F95-L135 PolarHBondContact O-N 3.28Å; F96-L135 CarbonylContact C-O 3.43Å; F96-L135 VanDerWaalsContact CA-O 3.26Å; F96-L135 WeakPolarHBondContact CA-O 3.41Å; F96-L135 HydrophobicContact CD1-CB 3.89Å; F96-L135 HydrophobicContact CE1-CB 3.86Å; F96-L135 HydrophobicContact CE1-CD1 4.08Å; H97-L135 PolarHBondContact N-O 2.91Å; L135-A139 HydrophobicContact CB-CB 4.37Å; L135-M143 HydrophobicContact CD1-CE 3.44Å; L135-M143 VanDerWaalsContact CD1-CE 3.44Å; L135-M143 HydrophobicContact CD1-SD 4.22Å
136	P	97.6	Very high	92.2	Very high	80 Å²	80	64.7 Å²	64.7	52%	0.519	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	140.7	167.7	28	-32.8	0	0	0	109.8	A138 A139	P136-A138 PolarHBondContact O-N 3.02Å; P136-A138 VanDerWaalsContact O-N 3.08Å; P136-A139 HydrophobicContact CG-CB 4.33Å; P136-A139 WeakPolarHBondContact O-CB 3.42Å; P136-A139 PolarHBondContact O-N 3.37Å
137	A	97	Very high	93.7	Very high	3 Å²	3	62 Å²	62	3%	0.025	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-57.3	-27.3	179	0	0	0	0	0	112.6	M61 F96 H97 A139 L140	M61-A137 VanDerWaalsContact O-CB 3.27Å; M61-A137 WeakPolarHBondContact O-CB 3.25Å; F96-A137 HydrophobicContact CB-CB 4.24Å; H97-A137 VanDerWaalsContact O-CB 3.32Å; H97-A137 WeakPolarHBondContact O-CB 3.36Å; H97-A137 PolarHBondContact O-N 3.35Å; A137-A139 PolarHBondContact O-N 2.95Å; A137-L140 VanDerWaalsContact O-CB 3.31Å; A137-L140 WeakPolarHBondContact O-CB 3.21Å; A137-L140 WeakPolarHBondContact O-CD1 3.49Å; A137-L140 PolarHBondContact O-N 2.75Å; A137-L140 VanDerWaalsContact O-N 3.12Å
138	A	95.3	Very high	94.9	Very high	57 Å²	57	58.6 Å²	58.6	47%	0.471	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-58.5	-25.1	172.4	0	0	0	0	0	113.9	P136 L140 R141	P136-A138 PolarHBondContact O-N 3.02Å; P136-A138 VanDerWaalsContact O-N 3.08Å; A138-L140 PolarHBondContact O-N 2.98Å; A138-R141 WeakPolarHBondContact O-CG 3.48Å; A138-R141 PolarHBondContact O-N 3.39Å
139	A	96.4	Very high	95.4	Very high	22 Å²	22	58.7 Å²	58.7	18%	0.182	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-62.4	-23.6	176.9	0	0	0	0	0	112.7	L135 P136 A137 R141 F142 M143	L135-A139 HydrophobicContact CB-CB 4.37Å; P136-A139 HydrophobicContact CG-CB 4.33Å; P136-A139 WeakPolarHBondContact O-CB 3.42Å; P136-A139 PolarHBondContact O-N 3.37Å; A137-A139 PolarHBondContact O-N 2.95Å; A139-R141 PolarHBondContact O-N 3.36Å; A139-R141 VanDerWaalsContact O-N 3.07Å; A139-F142 PolarHBondContact O-N 2.99Å; A139-M143 PolarHBondContact O-N 3.47Å
140	L	95.3	Very high	95.1	Very high	12 Å²	12	58.8 Å²	58.8	6%	0.063	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-55.9	-26.3	176.2	-77.1	160.8	0	0	0	113.3	L60 M61 F96 A137 A138 F142 M143 L226	L60-L140 HydrophobicContact CD1-CD1 4.46Å; L60-L140 HydrophobicContact CD2-CD1 3.73Å; L60-L140 HydrophobicContact CD2-CD2 4.12Å; L60-L140 HydrophobicContact CG-CD1 3.59Å; M61-L140 HydrophobicContact CG-CB 4.32Å; M61-L140 HydrophobicContact CG-CD1 4.01Å; F96-L140 HydrophobicContact CD1-CD1 4.37Å; F96-L140 HydrophobicContact CD1-CG 4.18Å; F96-L140 HydrophobicContact CD2-CD1 4.25Å; F96-L140 HydrophobicContact CD2-CD2 4.36Å; F96-L140 HydrophobicContact CD2-CG 4.41Å; F96-L140 HydrophobicContact CE1-CD1 4.44Å; F96-L140 HydrophobicContact CE1-CD2 4.09Å; F96-L140 HydrophobicContact CE1-CG 3.78Å; F96-L140 HydrophobicContact CE2-CD1 4.32Å; F96-L140 HydrophobicContact CE2-CD2 3.62Å; F96-L140 HydrophobicContact CE2-CG 4.03Å; F96-L140 HydrophobicContact CG-CD1 4.27Å; F96-L140 HydrophobicContact CG-CG 4.47Å; F96-L140 HydrophobicContact CZ-CD1 4.4Å; F96-L140 HydrophobicContact CZ-CD2 3.46Å; F96-L140 VanDerWaalsContact CZ-CD2 3.46Å; F96-L140 HydrophobicContact CZ-CG 3.7Å; A137-L140 VanDerWaalsContact O-CB 3.31Å; A137-L140 WeakPolarHBondContact O-CB 3.21Å; A137-L140 WeakPolarHBondContact O-CD1 3.49Å; A137-L140 PolarHBondContact O-N 2.75Å; A137-L140 VanDerWaalsContact O-N 3.12Å; A138-L140 PolarHBondContact O-N 2.98Å; L140-F142 PolarHBondContact O-N 3.26Å; L140-M143 PolarHBondContact O-N 3.44Å; L140-L226 HydrophobicContact CD2-CD2 4.01Å
141	R	94.1	Very high	94.8	Very high	189 Å²	189	60 Å²	60	71%	0.713	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-63.3	-23.5	176.7	-63.4	-179.5	-177.6	-169.9	0.9	113.3	M61 A138 A139	M61-R141 HydrophobicContact CE-CG 3.94Å; A138-R141 WeakPolarHBondContact O-CG 3.48Å; A138-R141 PolarHBondContact O-N 3.39Å; A139-R141 PolarHBondContact O-N 3.36Å; A139-R141 VanDerWaalsContact O-N 3.07Å
142	F	95.1	Very high	94.9	Very high	182 Å²	182	57.5 Å²	57.5	80%	0.798	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-110.2	3	-176.7	-50.5	-72.4	0	0	0	112.6	A139 L140	A139-F142 PolarHBondContact O-N 2.99Å; L140-F142 PolarHBondContact O-N 3.26Å
143	M	95.3	Very high	95	Very high	61 Å²	61	57.3 Å²	57.3	30%	0.3	30%	0.298	S	S	.	.	S	Bend	trans	-100	162.2	-179.6	-74	-164.7	145.9	0	0	111.9	I94 F96 L135 A139 L140 L226	I94-M143 HydrophobicContact CD1-CE 4.06Å; I94-M143 HydrophobicContact CD1-SD 4.35Å; F96-M143 HydrophobicContact CE1-SD 4.2Å; F96-M143 HydrophobicContact CZ-SD 3.8Å; L135-M143 HydrophobicContact CD1-CE 3.44Å; L135-M143 VanDerWaalsContact CD1-CE 3.44Å; L135-M143 HydrophobicContact CD1-SD 4.22Å; A139-M143 PolarHBondContact O-N 3.47Å; L140-M143 PolarHBondContact O-N 3.44Å; M143-L226 HydrophobicContact CB-CD2 4.25Å
144	P	95.3	Very high	95.1	Very high	49 Å²	49	55.4 Å²	55.4	32%	0.318	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-52.4	146.4	168.6	-24.9	34.6	0	0	0	111.3	R225 L226	P144-R225 HydrophobicContact CB-CB 3.84Å; P144-R225 HydrophobicContact CG-CB 4.01Å; P144-L226 HydrophobicContact CB-CB 4.39Å; P144-L226 WeakPolarHBondContact O-CD2 3.45Å
145	K	94.6	Very high	95.2	Very high	175 Å²	175	51.9 Å²	51.9	76%	0.761	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-55.1	125.1	177.7	-70	-175.6	179.3	179.7	0	109.8
146	P	95.8	Very high	95.1	Very high	7 Å²	7	49.6 Å²	49.6	5%	0.045	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	136.1	-178	26.5	-33	0	0	0	110.5	Y53 L57 F148 L226 C228	Y53-P146 VanDerWaalsContact CE2-O 3.28Å; Y53-P146 WeakPolarHBondContact CE2-O 3.11Å; L57-P146 HydrophobicContact CD1-CG 3.83Å; P146-F148 HydrophobicContact CB-CE2 4.38Å; P146-F148 HydrophobicContact CB-CZ 4.26Å; P146-F148 HydrophobicContact CG-CE2 3.99Å; P146-F148 HydrophobicContact CG-CZ 3.96Å; P146-L226 CarbonylContact C-O 3.54Å; P146-L226 WeakPolarHBondContact CA-O 3.45Å; P146-L226 HydrophobicContact CB-CD2 3.93Å; P146-L226 HydrophobicContact CB-CG 4.25Å; P146-C228 HydrophobicContact CB-CB 4.42Å
147	V	96.2	Very high	95.1	Very high	60 Å²	60	46.2 Å²	46.2	36%	0.364	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	113.4	168.2	174.7	0	0	0	0	107.4	L226 L227 C228	V147-L226 PolarHBondContact N-O 3.16Å; V147-L227 HydrophobicContact CB-CD2 3.98Å; V147-L227 HydrophobicContact CG1-CD2 4.11Å; V147-L227 CarbonylContact O-C 3.58Å; V147-L227 WeakPolarHBondContact O-CA 3.44Å; V147-C228 PolarHBondContact O-N 3.3Å
148	F	95.1	Very high	95	Very high	19 Å²	19	46 Å²	46	8%	0.083	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	125	-179.2	-67.4	-77.4	0	0	0	111.2	I51 Y53 A56 L57 L60 W83 P146 P150 C228	I51-F148 HydrophobicContact CD1-CB 3.75Å; I51-F148 HydrophobicContact CG2-CB 3.99Å; I51-F148 HydrophobicContact CG2-CG 4.32Å; Y53-F148 AromaticContact CD2-CD2 3.85Å; Y53-F148 HydrophobicContact CD2-CD2 3.85Å; Y53-F148 HydrophobicContact CD2-CE2 4.07Å; Y53-F148 HydrophobicContact CE2-CD2 4.1Å; Y53-F148 HydrophobicContact CE2-CE2 4.05Å; A56-F148 HydrophobicContact CB-CD1 4.12Å; A56-F148 HydrophobicContact CB-CD2 3.91Å; A56-F148 HydrophobicContact CB-CE1 4.02Å; A56-F148 HydrophobicContact CB-CE2 3.81Å; A56-F148 HydrophobicContact CB-CG 4.07Å; A56-F148 HydrophobicContact CB-CZ 3.87Å; L57-F148 HydrophobicContact CB-CE2 4.23Å; L57-F148 HydrophobicContact CB-CZ 4.32Å; L60-F148 HydrophobicContact CD2-CE1 4.1Å; L60-F148 HydrophobicContact CD2-CZ 4.3Å; W83-F148 AromaticContact CE3-CD1 3.91Å; W83-F148 HydrophobicContact CE3-CD1 3.91Å; W83-F148 AromaticContact CE3-CE1 3.83Å; W83-F148 HydrophobicContact CE3-CE1 3.83Å; W83-F148 AromaticContact CZ3-CD1 3.68Å; W83-F148 HydrophobicContact CZ3-CD1 3.68Å; W83-F148 AromaticContact CZ3-CE1 3.83Å; W83-F148 HydrophobicContact CZ3-CE1 3.83Å; P146-F148 HydrophobicContact CB-CE2 4.38Å; P146-F148 HydrophobicContact CB-CZ 4.26Å; P146-F148 HydrophobicContact CG-CE2 3.99Å; P146-F148 HydrophobicContact CG-CZ 3.96Å; F148-P150 WeakPolarHBondContact O-CD 3.5Å; F148-C228 CarbonylContact C-O 3.47Å; F148-C228 VanDerWaalsContact CA-O 3.31Å; F148-C228 WeakPolarHBondContact CA-O 3.4Å; F148-C228 HydrophobicContact CD1-CB 3.67Å; F148-C228 HydrophobicContact CE1-CB 3.77Å
149	V	92.8	Very high	95	Very high	13 Å²	13	44.3 Å²	44.3	8%	0.079	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	116	177.2	-178.3	0	0	0	0	108.4	D151 F192 L227 C228 F229 S230	V149-D151 VanDerWaalsContact C-N 3.33Å; V149-D151 HydrophobicContact CG1-CB 4.28Å; V149-F192 HydrophobicContact CG1-CZ 4.08Å; V149-L227 HydrophobicContact CG2-CB 4.36Å; V149-L227 HydrophobicContact CG2-CD2 4.49Å; V149-C228 PolarHBondContact N-O 3.43Å; V149-F229 HydrophobicContact CB-CD1 3.82Å; V149-F229 HydrophobicContact CB-CE1 4.2Å; V149-F229 HydrophobicContact CG1-CD1 3.96Å; V149-F229 HydrophobicContact CG1-CE1 4.16Å; V149-F229 HydrophobicContact CG2-CD1 3.96Å; V149-F229 HydrophobicContact CG2-CE1 3.92Å; V149-S230 PolarHBondContact O-OG 3Å
150	P	85.3	Confident	94.8	Very high	63 Å²	63	45.8 Å²	45.8	41%	0.409	22%	0.221	S	C	.	.			trans	-76.2	-22.7	-177.4	31.6	-35.6	0	0	0	113.2	I51 F148	I51-P150 HydrophobicContact CD1-CB 4.01Å; I51-P150 HydrophobicContact CG1-CB 4.12Å; F148-P150 WeakPolarHBondContact O-CD 3.5Å
151	D	90.3	Very high	94.8	Very high	28 Å²	28	45.5 Å²	45.5	15%	0.15	22%	0.22	C	C	.	.	S	Bend	trans	-73	141.2	178.5	-64	-35.4	0	0	0	111.2	V149 A153 R190 K212	V149-D151 VanDerWaalsContact C-N 3.33Å; V149-D151 HydrophobicContact CG1-CB 4.28Å; D151-A153 PolarHBondContact O-N 3.05Å; D151-R190 HydrophobicContact CB-CB 4.08Å; D151-R190 IonicContact OD2-CZ 3.37Å; D151-R190 VanDerWaalsContact OD2-CZ 3.22Å; D151-R190 IonicContact OD2-NE 3.55Å; D151-R190 PolarHBondContact OD2-NE 3.27Å; D151-R190 IonicContact OD2-NH2 2.69Å; D151-R190 PolarHBondContact OD2-NH2 3.3Å; D151-K212 HydrophobicContact CB-CD 4.25Å; D151-K212 WeakPolarHBondContact OD1-CE 3.49Å; D151-K212 IonicContact OD1-NZ 2.74Å; D151-K212 PolarHBondContact OD1-NZ 2.86Å
152	V	95.3	Very high	94.7	Very high	19 Å²	19	41.9 Å²	41.9	12%	0.115	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	124.8	162.5	-178.6	0	0	0	0	107.2	L185 E188 A189 R190 H231 F233	V152-L185 HydrophobicContact CG1-CD1 3.56Å; V152-E188 HydrophobicContact CB-CB 4.44Å; V152-E188 HydrophobicContact CG2-CB 4.19Å; V152-A189 CarbonylContact O-C 3.56Å; V152-A189 VanDerWaalsContact O-CA 3.22Å; V152-A189 WeakPolarHBondContact O-CA 3.44Å; V152-R190 PolarHBondContact O-N 3.02Å; V152-H231 HydrophobicContact CG1-CB 4.26Å; V152-H231 HydrophobicContact CG2-CB 4.31Å; V152-F233 HydrophobicContact CG1-CD2 3.9Å; V152-F233 HydrophobicContact CG1-CE2 3.78Å
153	A	97.6	Very high	94.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	135.6	-179	0	0	0	0	0	111	D151 I155 F192 F229 H231 A232 F233	D151-A153 PolarHBondContact O-N 3.05Å; A153-I155 HydrophobicContact CB-CD1 4.42Å; A153-I155 HydrophobicContact CB-CG1 4.07Å; A153-F192 HydrophobicContact CB-CD2 3.56Å; A153-F192 HydrophobicContact CB-CE2 3.56Å; A153-F229 HydrophobicContact CB-CD1 3.63Å; A153-F229 HydrophobicContact CB-CE1 4.07Å; A153-F229 HydrophobicContact CB-CG 4.35Å; A153-H231 PolarHBondContact N-O 3.28Å; A153-A232 HydrophobicContact CB-CB 4.1Å; A153-A232 CarbonylContact O-C 3.59Å; A153-A232 WeakPolarHBondContact O-CA 3.3Å; A153-F233 PolarHBondContact O-N 2.8Å
154	L	98.3	Very high	94.7	Very high	1 Å²	1	33 Å²	33	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	108.4	157.6	177.6	59.5	0	0	0	107.8	L175 T178 L179 A189 R190 L191 F192 F233	L154-L175 HydrophobicContact CD2-CD2 3.89Å; L154-L175 HydrophobicContact CG-CD2 4.49Å; L154-T178 HydrophobicContact CD1-CG2 3.99Å; L154-T178 HydrophobicContact CD2-CG2 4.27Å; L154-L179 HydrophobicContact CD2-CD2 3.59Å; L154-L179 HydrophobicContact CD2-CG 3.84Å; L154-A189 HydrophobicContact CB-CB 4.36Å; L154-R190 PolarHBondContact N-O 2.95Å; L154-L191 HydrophobicContact CB-CD2 4.03Å; L154-L191 HydrophobicContact CD2-CD2 3.78Å; L154-L191 HydrophobicContact CG-CD2 4.2Å; L154-F192 PolarHBondContact O-N 2.96Å; L154-F233 CarbonylContact C-O 3.35Å; L154-F233 WeakPolarHBondContact CA-O 3.17Å; L154-F233 HydrophobicContact CD1-CB 3.77Å
155	I	98.3	Very high	94.8	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.9	-175.4	-56.6	176.6	0	0	0	108.7	L84 F93 L119 A153 F192 M194 F229 A232 F233 V234 G235	L84-I155 HydrophobicContact CD2-CD1 4.27Å; F93-I155 HydrophobicContact CE1-CD1 3.78Å; F93-I155 HydrophobicContact CZ-CD1 4Å; F93-I155 HydrophobicContact CZ-CG2 3.93Å; L119-I155 HydrophobicContact CD2-CG2 4.33Å; A153-I155 HydrophobicContact CB-CD1 4.42Å; A153-I155 HydrophobicContact CB-CG1 4.07Å; I155-F192 WeakPolarHBondContact CA-O 3.27Å; I155-F192 HydrophobicContact CG1-CB 4.06Å; I155-M194 HydrophobicContact CG2-CG 3.68Å; I155-F229 HydrophobicContact CD1-CD2 4.49Å; I155-F229 HydrophobicContact CD1-CE2 4.4Å; I155-A232 HydrophobicContact CD1-CB 4.03Å; I155-F233 PolarHBondContact N-O 2.93Å; I155-V234 HydrophobicContact CB-CG1 4.32Å; I155-V234 HydrophobicContact CB-CG2 4.25Å; I155-V234 HydrophobicContact CD1-CG2 4.2Å; I155-V234 HydrophobicContact CG2-CG1 4.38Å; I155-G235 PolarHBondContact O-N 3.22Å
156	A	97.3	Very high	94.9	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.008	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	175.7	-179.9	0	0	0	0	0	109.9	L119 L175 F192 F193 M194 L236	L119-A156 CarbonylContact O-C 3.53Å; L119-A156 WeakPolarHBondContact O-CA 2.99Å; A156-L175 HydrophobicContact CB-CD2 4.43Å; A156-F192 PolarHBondContact N-O 3.42Å; A156-F193 WeakPolarHBondContact O-CA 3.41Å; A156-M194 PolarHBondContact O-N 3.47Å; A156-L236 HydrophobicContact CB-CD1 3.84Å; A156-L236 HydrophobicContact CB-CD2 3.74Å; A156-L236 HydrophobicContact CB-CG 3.7Å
157	N	96.6	Very high	95	Very high	9 Å²	9	23.3 Å²	23.3	5%	0.048	13%	0.129	C	C	.	.			trans	-120.8	142	172.2	-76.1	-2.7	0	0	0	110.1	L119 Q128 M194 E195	L119-N157 HydrophobicContact CB-CB 3.83Å; L119-N157 PolarHBondContact O-N 3.41Å; Q128-N157 PolarHBondContact OE1-ND2 2.83Å; N157-M194 WeakPolarHBondContact OD1-CA 3.34Å; N157-M194 WeakPolarHBondContact OD1-CB 3.47Å; N157-M194 PolarHBondContact OD1-N 3.11Å; N157-E195 VanDerWaalsContact CA-OE2 3.31Å; N157-E195 WeakPolarHBondContact CA-OE2 3.44Å; N157-E195 HydrophobicContact CB-CB 4.07Å; N157-E195 PolarHBondContact OD1-N 3.17Å; N157-E195 VanDerWaalsContact OD1-N 3.14Å
158	R	96	Very high	95.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.112	C	C	.	.			trans	-73.9	145.6	165.8	-64.1	175.4	-65.9	166.9	-0.4	110.1	D171 F193 E195 W197 G198 E199 Y206	R158-D171 WeakPolarHBondContact CA-OD1 3.24Å; R158-F193 HydrophobicContact CG-CD1 3.84Å; R158-F193 HydrophobicContact CG-CE1 3.85Å; R158-F193 HydrophobicContact CG-CG 4.2Å; R158-F193 HydrophobicContact CG-CZ 4.21Å; R158-E195 IonicContact CZ-OE1 2.6Å; R158-E195 PolarHBondContact N-OE2 3.03Å; R158-E195 IonicContact NE-OE1 2.71Å; R158-E195 PolarHBondContact NE-OE1 2.97Å; R158-E195 IonicContact NH2-OE1 3.49Å; R158-E195 PolarHBondContact NH2-OE1 3.48Å; R158-W197 HydrophobicContact CB-CE3 3.96Å; R158-W197 HydrophobicContact CB-CZ3 3.94Å; R158-W197 PolarHBondContact NH2-O 2.76Å; R158-W197 WeakPolarHBondContact O-CZ3 3.44Å; R158-G198 PolarHBondContact NH1-O 3.05Å; R158-G198 VanDerWaalsContact NH1-O 3.11Å; R158-G198 PolarHBondContact NH2-O 2.89Å; R158-E199 PolarHBondContact NH1-O 3.02Å; R158-Y206 VanDerWaalsContact CD-CZ 3.44Å; R158-Y206 WeakPolarHBondContact CD-OH 3.49Å; R158-Y206 HydrophobicContact CG-CE1 3.76Å
159	F	93.9	Very high	95.2	Very high	20 Å²	20	19.6 Å²	19.6	9%	0.088	11%	0.108	C	C	.	.	S	Bend	trans	-92.9	-38.7	-176	179.9	-107.4	0	0	0	115.9	S120 V122 H125 H166 D170 D171 W197 F247	S120-F159 WeakPolarHBondContact OG-CB 3.32Å; V122-F159 HydrophobicContact CB-CD2 3.65Å; V122-F159 HydrophobicContact CB-CE2 3.75Å; V122-F159 HydrophobicContact CB-CG 4.09Å; V122-F159 HydrophobicContact CB-CZ 4.26Å; V122-F159 HydrophobicContact CG1-CD2 4.23Å; V122-F159 HydrophobicContact CG1-CE2 3.79Å; V122-F159 HydrophobicContact CG1-CZ 4.02Å; V122-F159 HydrophobicContact CG2-CB 4.09Å; V122-F159 HydrophobicContact CG2-CD1 3.5Å; V122-F159 VanDerWaalsContact CG2-CD1 3.5Å; V122-F159 HydrophobicContact CG2-CD2 3.41Å; V122-F159 VanDerWaalsContact CG2-CD2 3.41Å; V122-F159 HydrophobicContact CG2-CE1 3.79Å; V122-F159 HydrophobicContact CG2-CE2 3.72Å; V122-F159 HydrophobicContact CG2-CG 3.3Å; V122-F159 HydrophobicContact CG2-CZ 3.9Å; H125-F159 AromaticContact CD2-CE2 3.94Å; F159-H166 HydrophobicContact CD1-CB 4.29Å; F159-H166 AromaticContact CD1-CE1 3.84Å; F159-H166 AromaticContact CD1-CG 3.87Å; F159-H166 AromaticContact CD1-ND1 3.42Å; F159-H166 WeakPolarHBondContact CD1-ND1 3.28Å; F159-H166 AromaticContact CE1-CE1 3.52Å; F159-H166 AromaticContact CE1-ND1 3.62Å; F159-D170 HydrophobicContact CB-CB 3.93Å; F159-D171 PolarHBondContact N-OD1 3.18Å; F159-W197 VanDerWaalsContact C-CZ3 3.43Å; F159-W197 WeakPolarHBondContact O-CH2 3.49Å; F159-F247 HydrophobicContact CZ-CE2 4.13Å; F159-F247 AromaticContact CZ-CZ 3.78Å; F159-F247 HydrophobicContact CZ-CZ 3.78Å
160	N	93.3	Very high	95.4	Very high	53 Å²	53	19.1 Å²	19.1	28%	0.283	11%	0.105	S	C	.	.			trans	-164.6	90.2	175.2	-176.6	0.6	0	0	0	108.6	D162 N163 H166	N160-D162 PolarHBondContact O-N 3.41Å; N160-N163 PolarHBondContact O-N 3.27Å; N160-H166 HydrophobicContact CB-CB 3.82Å; N160-H166 PolarHBondContact ND2-CD2 2.94Å
161	P	94.1	Very high	96	Very high	7 Å²	7	16.1 Å²	16.1	5%	0.045	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-9.9	-158.4	39.7	-28.1	0	0	0	112	V167 W197 H202	P161-V167 VanDerWaalsContact O-CG2 3.27Å; P161-V167 WeakPolarHBondContact O-CG2 3.42Å; P161-W197 HydrophobicContact CB-CE3 3.98Å; P161-W197 HydrophobicContact CB-CZ3 4.18Å; P161-W197 VanDerWaalsContact CD-CE3 3.4Å; P161-W197 HydrophobicContact CG-CD2 3.96Å; P161-W197 HydrophobicContact CG-CE3 3.31Å; P161-W197 HydrophobicContact CG-CH2 4.42Å; P161-W197 HydrophobicContact CG-CZ3 3.63Å; P161-H202 PolarHBondContact O-CD2 3.08Å
162	D	92.6	Very high	96.4	Very high	112 Å²	112	14.8 Å²	14.8	60%	0.599	8%	0.079	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-7	-179.9	-62.7	-37.6	0	0	0	111.9	N160	N160-D162 PolarHBondContact O-N 3.41Å
163	N	94.4	Very high	96.5	Very high	51 Å²	51	14 Å²	14	27%	0.273	7%	0.073	S	C	.	.			trans	-112.5	110.9	178.9	-177.3	-47	0	0	0	109.9	N160 M165 H166 V167 A347	N160-N163 PolarHBondContact O-N 3.27Å; N163-M165 PolarHBondContact O-N 2.68Å; N163-M165 VanDerWaalsContact O-N 3.08Å; N163-M165 WeakPolarHBondContact OD1-CB 3.4Å; N163-M165 PolarHBondContact OD1-N 3.19Å; N163-H166 HydrophobicContact CB-CB 4.37Å; N163-H166 PolarHBondContact O-N 3.42Å; N163-V167 WeakPolarHBondContact O-CG2 3.06Å; N163-V167 PolarHBondContact O-N 3.42Å; N163-A347 WeakPolarHBondContact OD1-CB 3.34Å
164	L	96.2	Very high	96.5	Very high	5 Å²	5	14 Å²	14	3%	0.026	7%	0.073	C	C	.	.	H	α-helix	trans	-53.8	-34.6	-175.5	-164	69.2	0	0	0	113.9	V167 F168 L205 L323 F328 A347 V350 T351	L164-V167 PolarHBondContact O-N 3.17Å; L164-F168 HydrophobicContact CD1-CD2 3.85Å; L164-F168 HydrophobicContact CD1-CE2 3.64Å; L164-F168 HydrophobicContact CG-CD2 3.93Å; L164-F168 HydrophobicContact CG-CE2 4.09Å; L164-F168 WeakPolarHBondContact O-CD2 3.3Å; L164-F168 PolarHBondContact O-N 3.34Å; L164-L205 HydrophobicContact CD1-CD1 4.4Å; L164-L323 HydrophobicContact CD2-CD1 3.73Å; L164-L323 HydrophobicContact CD2-CD2 4.31Å; L164-F328 HydrophobicContact CD1-CE2 4.24Å; L164-F328 HydrophobicContact CD2-CE2 4.04Å; L164-A347 HydrophobicContact CB-CB 4.14Å; L164-V350 HydrophobicContact CB-CG1 4.45Å; L164-V350 HydrophobicContact CD2-CG1 4.01Å; L164-V350 HydrophobicContact CG-CG1 3.85Å; L164-T351 HydrophobicContact CD2-CG2 4.35Å
165	M	96.8	Very high	96.5	Very high	8 Å²	8	14 Å²	14	4%	0.039	7%	0.074	C	C	.	.	H	α-helix	trans	-66.3	-44.9	178.6	-175.1	-79.6	179.3	0	0	110.7	N163 F168 H169 Y245 A347 V350 P376 Y377	N163-M165 PolarHBondContact O-N 2.68Å; N163-M165 VanDerWaalsContact O-N 3.08Å; N163-M165 WeakPolarHBondContact OD1-CB 3.4Å; N163-M165 PolarHBondContact OD1-N 3.19Å; M165-F168 PolarHBondContact O-N 3.08Å; M165-H169 HydrophobicContact CE-CB 3.87Å; M165-H169 WeakPolarHBondContact O-CB 3.43Å; M165-H169 PolarHBondContact O-N 3.18Å; M165-H169 HydrophobicContact SD-CB 3.99Å; M165-Y245 HydrophobicContact CE-CE1 3.84Å; M165-Y245 VanDerWaalsContact CE-OH 3.28Å; M165-Y245 WeakPolarHBondContact CE-OH 3.3Å; M165-Y245 HydrophobicContact SD-CE1 3.77Å; M165-Y245 PolarHBondContact SD-OH 2.77Å; M165-A347 HydrophobicContact CB-CB 4.15Å; M165-V350 HydrophobicContact CB-CB 4.28Å; M165-V350 HydrophobicContact CG-CB 4.35Å; M165-V350 HydrophobicContact CG-CG2 4.4Å; M165-P376 HydrophobicContact CE-CB 3.87Å; M165-Y377 HydrophobicContact CG-CE1 4.14Å
166	H	96.8	Very high	96.5	Very high	21 Å²	21	14.6 Å²	14.6	10%	0.097	8%	0.076	C	C	.	.	H	α-helix	trans	-65.2	-43.4	174.7	-69.9	-62.1	0	0	0	112.1	F159 N160 N163 F168 H169 D170 D171 Y245	F159-H166 HydrophobicContact CD1-CB 4.29Å; F159-H166 AromaticContact CD1-CE1 3.84Å; F159-H166 AromaticContact CD1-CG 3.87Å; F159-H166 AromaticContact CD1-ND1 3.42Å; F159-H166 WeakPolarHBondContact CD1-ND1 3.28Å; F159-H166 AromaticContact CE1-CE1 3.52Å; F159-H166 AromaticContact CE1-ND1 3.62Å; N160-H166 HydrophobicContact CB-CB 3.82Å; N160-H166 PolarHBondContact ND2-CD2 2.94Å; N163-H166 HydrophobicContact CB-CB 4.37Å; N163-H166 PolarHBondContact O-N 3.42Å; H166-F168 PolarHBondContact O-N 3Å; H166-H169 PolarHBondContact O-N 3.03Å; H166-D170 WeakPolarHBondContact CA-OD2 3.43Å; H166-D170 IonicContact CE1-OD2 2.69Å; H166-D170 IonicContact CG-OD2 3.12Å; H166-D170 IonicContact ND1-OD2 3.55Å; H166-D170 PolarHBondContact ND1-OD2 3.08Å; H166-D170 WeakPolarHBondContact O-CA 3.42Å; H166-D170 WeakPolarHBondContact O-CB 3.36Å; H166-D170 PolarHBondContact O-N 2.9Å; H166-D171 PolarHBondContact O-N 2.59Å; H166-Y245 AromaticContact CE1-CD1 3.7Å; H166-Y245 AromaticContact CE1-CD2 3.71Å; H166-Y245 AromaticContact CE1-CE1 3.35Å; H166-Y245 WeakPolarHBondContact CE1-CE1 3.18Å; H166-Y245 AromaticContact CE1-CE2 3.36Å; H166-Y245 WeakPolarHBondContact CE1-CE2 3.48Å; H166-Y245 AromaticContact CE1-CG 3.86Å; H166-Y245 AromaticContact CE1-CZ 3.16Å; H166-Y245 AromaticContact ND1-CE1 3.87Å; H166-Y245 AromaticContact ND1-CE2 3.52Å; H166-Y245 AromaticContact ND1-CZ 3.27Å; H166-Y245 VanDerWaalsContact ND1-CZ 3.27Å; H166-Y245 PolarHBondContact ND1-OH 3.05Å
167	V	98.1	Very high	96.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.089	C	C	.	.	I	π-helix	trans	-52.8	-45.5	175.3	170.3	0	0	0	0	110.9	P161 N163 L164 D171 L172 H202 L205 Y206	P161-V167 VanDerWaalsContact O-CG2 3.27Å; P161-V167 WeakPolarHBondContact O-CG2 3.42Å; N163-V167 WeakPolarHBondContact O-CG2 3.06Å; N163-V167 PolarHBondContact O-N 3.42Å; L164-V167 PolarHBondContact O-N 3.17Å; V167-D171 WeakPolarHBondContact O-CB 3.3Å; V167-D171 PolarHBondContact O-N 2.85Å; V167-L172 HydrophobicContact CG1-CD1 3.68Å; V167-L172 HydrophobicContact CG1-CG 3.96Å; V167-L172 WeakPolarHBondContact O-CB 3.22Å; V167-L172 VanDerWaalsContact O-CG 3.29Å; V167-L172 WeakPolarHBondContact O-CG 3.27Å; V167-L172 PolarHBondContact O-N 3.01Å; V167-H202 HydrophobicContact CG1-CB 4.16Å; V167-H202 HydrophobicContact CG2-CB 4.08Å; V167-L205 HydrophobicContact CG1-CD1 4.2Å; V167-Y206 HydrophobicContact CG1-CE2 4.27Å
168	F	98.4	Very high	96.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.087	C	C	.	.	I	π-helix	trans	-79	-49.8	-179.7	-87.7	-91.8	0	0	0	113.6	L164 M165 H166 L172 L173 L205 F267 M271 F328 V350 L353 F354	L164-F168 HydrophobicContact CD1-CD2 3.85Å; L164-F168 HydrophobicContact CD1-CE2 3.64Å; L164-F168 HydrophobicContact CG-CD2 3.93Å; L164-F168 HydrophobicContact CG-CE2 4.09Å; L164-F168 WeakPolarHBondContact O-CD2 3.3Å; L164-F168 PolarHBondContact O-N 3.34Å; M165-F168 PolarHBondContact O-N 3.08Å; H166-F168 PolarHBondContact O-N 3Å; F168-L172 HydrophobicContact CD1-CD1 4.28Å; F168-L172 HydrophobicContact CD2-CD1 4.26Å; F168-L172 HydrophobicContact CE1-CD1 4.17Å; F168-L172 HydrophobicContact CE2-CD1 4.14Å; F168-L172 HydrophobicContact CG-CD1 4.34Å; F168-L172 HydrophobicContact CZ-CD1 4.08Å; F168-L173 VanDerWaalsContact O-CB 3.25Å; F168-L173 WeakPolarHBondContact O-CB 3.44Å; F168-L173 WeakPolarHBondContact O-CG 3.41Å; F168-L173 PolarHBondContact O-N 3.18Å; F168-L173 VanDerWaalsContact O-N 3.09Å; F168-L205 HydrophobicContact CE2-CD1 3.69Å; F168-L205 HydrophobicContact CZ-CD1 4.05Å; F168-F267 AromaticContact CD1-CE1 3.59Å; F168-F267 HydrophobicContact CD1-CE1 3.59Å; F168-F267 AromaticContact CD1-CZ 3.9Å; F168-F267 HydrophobicContact CD1-CZ 3.9Å; F168-F267 AromaticContact CE1-CE1 3.7Å; F168-F267 HydrophobicContact CE1-CE1 3.7Å; F168-F267 AromaticContact CE1-CZ 3.92Å; F168-F267 HydrophobicContact CE1-CZ 3.92Å; F168-M271 HydrophobicContact CE1-CE 4.33Å; F168-M271 HydrophobicContact CZ-CE 4.29Å; F168-F328 HydrophobicContact CE2-CE1 4.16Å; F168-F328 HydrophobicContact CE2-CE2 4.31Å; F168-F328 AromaticContact CE2-CZ 3.57Å; F168-F328 HydrophobicContact CE2-CZ 3.57Å; F168-F328 AromaticContact CZ-CE1 3.66Å; F168-F328 HydrophobicContact CZ-CE1 3.66Å; F168-F328 HydrophobicContact CZ-CE2 4.48Å; F168-F328 AromaticContact CZ-CZ 3.37Å; F168-F328 HydrophobicContact CZ-CZ 3.37Å; F168-V350 HydrophobicContact CB-CB 4.46Å; F168-V350 HydrophobicContact CB-CG1 4.09Å; F168-V350 HydrophobicContact CB-CG2 3.54Å; F168-V350 HydrophobicContact CD2-CG1 3.96Å; F168-V350 HydrophobicContact CG-CG1 4.1Å; F168-V350 HydrophobicContact CG-CG2 4.27Å; F168-L353 HydrophobicContact CB-CD2 4.41Å; F168-L353 HydrophobicContact CD1-CD2 3.46Å; F168-L353 VanDerWaalsContact CD1-CD2 3.46Å; F168-L353 HydrophobicContact CE1-CD2 4.02Å; F168-L353 HydrophobicContact CG-CD2 4.17Å; F168-F354 HydrophobicContact CE1-CE2 4.06Å; F168-F354 AromaticContact CE1-CZ 3.9Å; F168-F354 HydrophobicContact CE1-CZ 3.9Å; F168-F354 HydrophobicContact CZ-CE2 4.27Å; F168-F354 HydrophobicContact CZ-CZ 4.26Å
169	H	98	Very high	96.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.088	C	C	.	.	I	π-helix	trans	-73.4	-44.9	-173.6	175.9	-91.3	0	0	0	112.8	M165 H166 P174 W242 Y243 Y245	M165-H169 HydrophobicContact CE-CB 3.87Å; M165-H169 WeakPolarHBondContact O-CB 3.43Å; M165-H169 PolarHBondContact O-N 3.18Å; M165-H169 HydrophobicContact SD-CB 3.99Å; H166-H169 PolarHBondContact O-N 3.03Å; H169-P174 VanDerWaalsContact O-CD 3.28Å; H169-P174 WeakPolarHBondContact O-CD 3.31Å; H169-P174 WeakPolarHBondContact O-CG 3.33Å; H169-W242 HydrophobicContact CB-CH2 4.3Å; H169-W242 AromaticContact CD2-CD2 3.49Å; H169-W242 VanDerWaalsContact CD2-CD2 3.49Å; H169-W242 AromaticContact CD2-CE2 3.55Å; H169-W242 AromaticContact CD2-CE3 3.47Å; H169-W242 VanDerWaalsContact CD2-CE3 3.47Å; H169-W242 AromaticContact CD2-CH2 3.59Å; H169-W242 AromaticContact CD2-CZ2 3.62Å; H169-W242 AromaticContact CD2-CZ3 3.51Å; H169-W242 AromaticContact NE2-CD2 3.74Å; H169-W242 AromaticContact NE2-CE3 3.89Å; H169-W242 PolarHBondContact NE2-N 2.94Å; H169-Y243 PolarHBondContact CE1-O 2.85Å; H169-Y243 PolarHBondContact NE2-N 3.46Å; H169-Y243 VanDerWaalsContact NE2-N 3.16Å; H169-Y245 PolarHBondContact ND1-OH 2.87Å; H169-Y245 VanDerWaalsContact ND1-OH 3.12Å
170	D	96.5	Very high	96.5	Very high	3 Å²	3	23 Å²	23	2%	0.016	11%	0.107	C	C	.	.	I	π-helix	trans	-98.6	-23.8	-170.7	-59.6	-56.8	0	0	0	113.3	T121 V122 F159 H166 P174 Y245	T121-D170 WeakPolarHBondContact OG1-CA 3.5Å; T121-D170 WeakPolarHBondContact OG1-CB 3.43Å; T121-D170 PolarHBondContact OG1-O 2.82Å; T121-D170 PolarHBondContact OG1-OD1 3.45Å; V122-D170 HydrophobicContact CG2-CB 4.3Å; F159-D170 HydrophobicContact CB-CB 3.93Å; H166-D170 WeakPolarHBondContact CA-OD2 3.43Å; H166-D170 IonicContact CE1-OD2 2.69Å; H166-D170 IonicContact CG-OD2 3.12Å; H166-D170 IonicContact ND1-OD2 3.55Å; H166-D170 PolarHBondContact ND1-OD2 3.08Å; H166-D170 WeakPolarHBondContact O-CA 3.42Å; H166-D170 WeakPolarHBondContact O-CB 3.36Å; H166-D170 PolarHBondContact O-N 2.9Å; D170-P174 WeakPolarHBondContact O-CG 3.43Å; D170-Y245 VanDerWaalsContact OD2-CE2 3.29Å; D170-Y245 WeakPolarHBondContact OD2-CE2 3.49Å; D170-Y245 VanDerWaalsContact OD2-CZ 3.32Å; D170-Y245 PolarHBondContact OD2-OH 3.02Å
171	D	97.8	Very high	96.4	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	11%	0.112	C	C	.	.	I	π-helix	trans	-112.4	-68.5	-178	-45.9	-30.6	0	0	0	113.2	R158 F159 H166 V167 P174 L175 Y206	R158-D171 WeakPolarHBondContact CA-OD1 3.24Å; F159-D171 PolarHBondContact N-OD1 3.18Å; H166-D171 PolarHBondContact O-N 2.59Å; V167-D171 WeakPolarHBondContact O-CB 3.3Å; V167-D171 PolarHBondContact O-N 2.85Å; D171-P174 WeakPolarHBondContact O-CD 3.33Å; D171-L175 HydrophobicContact CB-CD1 4.43Å; D171-L175 VanDerWaalsContact O-CB 3.25Å; D171-L175 WeakPolarHBondContact O-CB 3.11Å; D171-L175 WeakPolarHBondContact O-CD1 3.24Å; D171-L175 WeakPolarHBondContact O-CG 3.47Å; D171-L175 PolarHBondContact O-N 2.9Å; D171-Y206 HydrophobicContact CB-CE1 3.59Å; D171-Y206 PolarHBondContact OD2-OH 3.16Å
172	L	98.5	Very high	96.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.115	C	C	.	.	I	π-helix	trans	-65.7	-45.7	-168.1	-64.8	175.8	0	0	0	113.4	V167 F168 F176 L205 Y206 L209 F267 M271	V167-L172 HydrophobicContact CG1-CD1 3.68Å; V167-L172 HydrophobicContact CG1-CG 3.96Å; V167-L172 WeakPolarHBondContact O-CB 3.22Å; V167-L172 VanDerWaalsContact O-CG 3.29Å; V167-L172 WeakPolarHBondContact O-CG 3.27Å; V167-L172 PolarHBondContact O-N 3.01Å; F168-L172 HydrophobicContact CD1-CD1 4.28Å; F168-L172 HydrophobicContact CD2-CD1 4.26Å; F168-L172 HydrophobicContact CE1-CD1 4.17Å; F168-L172 HydrophobicContact CE2-CD1 4.14Å; F168-L172 HydrophobicContact CG-CD1 4.34Å; F168-L172 HydrophobicContact CZ-CD1 4.08Å; L172-F176 WeakPolarHBondContact O-CB 2.81Å; L172-F176 PolarHBondContact O-N 2.86Å; L172-L205 HydrophobicContact CD1-CB 3.69Å; L172-L205 HydrophobicContact CD1-CD1 4.01Å; L172-L205 HydrophobicContact CD1-CG 4.48Å; L172-L205 HydrophobicContact CD2-CB 4.2Å; L172-Y206 HydrophobicContact CD2-CD1 3.64Å; L172-Y206 HydrophobicContact CD2-CD2 4.41Å; L172-Y206 HydrophobicContact CD2-CE1 3.97Å; L172-Y206 HydrophobicContact CD2-CG 3.92Å; L172-L209 HydrophobicContact CD2-CD1 3.7Å; L172-L209 HydrophobicContact CD2-CG 4.35Å; L172-F267 HydrophobicContact CB-CE2 4.04Å; L172-F267 HydrophobicContact CB-CZ 3.78Å; L172-M271 HydrophobicContact CD1-CE 4.27Å
173	L	97.9	Very high	96.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-63.1	-51.2	178.2	-89.2	164	0	0	0	111.9	F168 L175 F176 Y177 W242 I264 F267	F168-L173 VanDerWaalsContact O-CB 3.25Å; F168-L173 WeakPolarHBondContact O-CB 3.44Å; F168-L173 WeakPolarHBondContact O-CG 3.41Å; F168-L173 PolarHBondContact O-N 3.18Å; F168-L173 VanDerWaalsContact O-N 3.09Å; L173-L175 PolarHBondContact O-N 3.11Å; L173-F176 PolarHBondContact O-N 3.04Å; L173-Y177 PolarHBondContact O-N 3.42Å; L173-W242 HydrophobicContact CD1-CH2 4.04Å; L173-W242 HydrophobicContact CD1-CZ3 3.75Å; L173-I264 HydrophobicContact CD1-CD1 3.84Å; L173-I264 HydrophobicContact CD2-CD1 3.99Å; L173-F267 HydrophobicContact CD1-CD1 4.49Å; L173-F267 HydrophobicContact CD2-CB 3.42Å; L173-F267 VanDerWaalsContact CD2-CB 3.42Å; L173-F267 HydrophobicContact CD2-CD1 3.41Å; L173-F267 VanDerWaalsContact CD2-CD1 3.41Å; L173-F267 HydrophobicContact CD2-CD2 3.87Å; L173-F267 HydrophobicContact CD2-CE1 4.12Å; L173-F267 HydrophobicContact CD2-CE2 4.49Å; L173-F267 HydrophobicContact CD2-CG 3.26Å; L173-F267 HydrophobicContact CG-CD1 3.72Å; L173-F267 HydrophobicContact CG-CD2 4.26Å; L173-F267 HydrophobicContact CG-CE1 3.9Å; L173-F267 HydrophobicContact CG-CE2 4.4Å; L173-F267 HydrophobicContact CG-CG 3.91Å; L173-F267 HydrophobicContact CG-CZ 4.22Å
174	P	97.6	Very high	95.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56.2	-46.3	172.7	-32.8	40.6	0	0	0	114.2	T121 H169 D170 D171 Y177 T178 L236 S237 T240 T241	T121-P174 HydrophobicContact CG2-CB 3.33Å; T121-P174 HydrophobicContact CG2-CG 3.35Å; H169-P174 VanDerWaalsContact O-CD 3.28Å; H169-P174 WeakPolarHBondContact O-CD 3.31Å; H169-P174 WeakPolarHBondContact O-CG 3.33Å; D170-P174 WeakPolarHBondContact O-CG 3.43Å; D171-P174 WeakPolarHBondContact O-CD 3.33Å; P174-Y177 PolarHBondContact O-N 2.97Å; P174-T178 WeakPolarHBondContact O-CB 3.42Å; P174-T178 PolarHBondContact O-N 3.47Å; P174-T178 PolarHBondContact O-OG1 3.11Å; P174-L236 HydrophobicContact CB-CB 4.43Å; P174-L236 HydrophobicContact CB-CD1 4.41Å; P174-S237 WeakPolarHBondContact CB-O 3.37Å; P174-T240 WeakPolarHBondContact CA-OG1 3.42Å; P174-T241 HydrophobicContact CG-CG2 4.33Å
175	L	98.1	Very high	95.5	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-59.6	-49.2	177.5	-77.8	163.7	0	0	0	111.2	L154 A156 D171 L173 Y177 T178 L179 L191 F193 Y206 L209 L236	L154-L175 HydrophobicContact CD2-CD2 3.89Å; L154-L175 HydrophobicContact CG-CD2 4.49Å; A156-L175 HydrophobicContact CB-CD2 4.43Å; D171-L175 HydrophobicContact CB-CD1 4.43Å; D171-L175 VanDerWaalsContact O-CB 3.25Å; D171-L175 WeakPolarHBondContact O-CB 3.11Å; D171-L175 WeakPolarHBondContact O-CD1 3.24Å; D171-L175 WeakPolarHBondContact O-CG 3.47Å; D171-L175 PolarHBondContact O-N 2.9Å; L173-L175 PolarHBondContact O-N 3.11Å; L175-Y177 VanDerWaalsContact C-N 3.29Å; L175-Y177 PolarHBondContact O-N 2.69Å; L175-T178 PolarHBondContact O-N 3.12Å; L175-L179 WeakPolarHBondContact O-CB 3.02Å; L175-L179 VanDerWaalsContact O-CG 3.24Å; L175-L179 WeakPolarHBondContact O-CG 3.34Å; L175-L179 PolarHBondContact O-N 3.1Å; L175-L191 HydrophobicContact CD1-CD1 4.44Å; L175-L191 HydrophobicContact CD2-CD2 4.09Å; L175-F193 HydrophobicContact CD1-CE1 4.2Å; L175-F193 HydrophobicContact CD1-CZ 4.2Å; L175-Y206 HydrophobicContact CD1-CD1 3.9Å; L175-Y206 HydrophobicContact CD1-CE1 4.18Å; L175-L209 HydrophobicContact CB-CD1 3.64Å; L175-L209 HydrophobicContact CD1-CD1 3.86Å; L175-L209 HydrophobicContact CG-CD1 4.37Å; L175-L236 HydrophobicContact CD2-CD2 3.53Å; L175-L236 HydrophobicContact CG-CD2 4Å
176	F	97.6	Very high	95.2	Very high	12 Å²	12	26.6 Å²	26.6	5%	0.053	14%	0.142	C	C	.	.	H	α-helix	trans	-56.2	-44.4	176.8	169.3	-100.4	0	0	0	112.2	L172 L173 R180 L209 F267 F270	L172-F176 WeakPolarHBondContact O-CB 2.81Å; L172-F176 PolarHBondContact O-N 2.86Å; L173-F176 PolarHBondContact O-N 3.04Å; F176-R180 VanDerWaalsContact CE2-NE 3.28Å; F176-R180 WeakPolarHBondContact O-CG 3.42Å; F176-R180 PolarHBondContact O-N 3.2Å; F176-L209 HydrophobicContact CB-CD2 3.89Å; F176-L209 HydrophobicContact CD2-CD2 4.47Å; F176-F267 HydrophobicContact CB-CD2 3.67Å; F176-F267 HydrophobicContact CB-CE2 4Å; F176-F267 HydrophobicContact CD1-CB 3.9Å; F176-F267 AromaticContact CD1-CD2 3.74Å; F176-F267 HydrophobicContact CD1-CD2 3.74Å; F176-F267 HydrophobicContact CD1-CG 4.3Å; F176-F267 HydrophobicContact CD2-CD2 4.06Å; F176-F267 HydrophobicContact CE1-CB 3.74Å; F176-F267 HydrophobicContact CE1-CD2 4.29Å; F176-F267 AromaticContact CG-CD2 3.58Å; F176-F267 HydrophobicContact CG-CD2 3.58Å; F176-F267 HydrophobicContact CG-CE2 4.34Å; F176-F267 HydrophobicContact CZ-CB 4.26Å; F176-F270 HydrophobicContact CD2-CB 4.44Å; F176-F270 AromaticContact CD2-CD1 3.77Å; F176-F270 HydrophobicContact CD2-CD1 3.77Å; F176-F270 HydrophobicContact CD2-CD2 4.44Å; F176-F270 HydrophobicContact CD2-CE1 4.1Å; F176-F270 AromaticContact CD2-CG 3.96Å; F176-F270 HydrophobicContact CD2-CG 3.96Å; F176-F270 HydrophobicContact CE2-CB 3.56Å; F176-F270 AromaticContact CE2-CD1 3.71Å; F176-F270 HydrophobicContact CE2-CD1 3.71Å; F176-F270 AromaticContact CE2-CD2 3.84Å; F176-F270 HydrophobicContact CE2-CD2 3.84Å; F176-F270 HydrophobicContact CE2-CE1 4.37Å; F176-F270 HydrophobicContact CE2-CE2 4.44Å; F176-F270 AromaticContact CE2-CG 3.41Å; F176-F270 HydrophobicContact CE2-CG 3.41Å; F176-F270 VanDerWaalsContact CE2-CG 3.41Å; F176-F270 HydrophobicContact CZ-CB 3.99Å; F176-F270 HydrophobicContact CZ-CG 4.33Å
177	Y	96.6	Very high	94.9	Very high	71 Å²	71	32.9 Å²	32.9	28%	0.278	17%	0.171	S	C	.	.	H	α-helix	trans	-67	-47.4	178.4	-172.4	-82.6	0	0	0	111.6	L173 P174 L175 L179 R180 Q181 I239 T240	L173-Y177 PolarHBondContact O-N 3.42Å; P174-Y177 PolarHBondContact O-N 2.97Å; L175-Y177 VanDerWaalsContact C-N 3.29Å; L175-Y177 PolarHBondContact O-N 2.69Å; Y177-L179 VanDerWaalsContact C-N 3.33Å; Y177-L179 PolarHBondContact O-N 3.01Å; Y177-R180 CarbonylContact O-C 3.55Å; Y177-R180 PolarHBondContact O-N 2.97Å; Y177-Q181 PolarHBondContact O-N 3.25Å; Y177-I239 HydrophobicContact CD1-CG2 3.56Å; Y177-I239 HydrophobicContact CD2-CG2 3.97Å; Y177-I239 HydrophobicContact CE1-CG2 3.41Å; Y177-I239 VanDerWaalsContact CE1-CG2 3.41Å; Y177-I239 HydrophobicContact CE2-CG2 3.81Å; Y177-I239 HydrophobicContact CG-CG2 3.85Å; Y177-T240 HydrophobicContact CD2-CG2 3.76Å; Y177-T240 HydrophobicContact CG-CG2 3.84Å
178	T	96.6	Very high	94.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.4	-42.6	178.6	-68.8	0	0	0	0	111.9	I78 L154 P174 L175 R180 Q181 F182 S237	I78-T178 HydrophobicContact CD1-CG2 4.49Å; L154-T178 HydrophobicContact CD1-CG2 3.99Å; L154-T178 HydrophobicContact CD2-CG2 4.27Å; P174-T178 WeakPolarHBondContact O-CB 3.42Å; P174-T178 PolarHBondContact O-N 3.47Å; P174-T178 PolarHBondContact O-OG1 3.11Å; L175-T178 PolarHBondContact O-N 3.12Å; T178-R180 PolarHBondContact O-N 2.98Å; T178-Q181 WeakPolarHBondContact O-CB 3.32Å; T178-Q181 PolarHBondContact O-N 2.7Å; T178-F182 HydrophobicContact CG2-CE2 4.32Å; T178-F182 WeakPolarHBondContact O-CD2 3.21Å; T178-S237 WeakPolarHBondContact OG1-CB 3.45Å; T178-S237 PolarHBondContact OG1-N 3.07Å
179	L	96.4	Very high	94.4	Very high	4 Å²	4	38 Å²	38	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-61	-30	176.1	-73.1	169	0	0	0	112.8	L154 L175 Y177 L185 A186 A189 L191 L209	L154-L179 HydrophobicContact CD2-CD2 3.59Å; L154-L179 HydrophobicContact CD2-CG 3.84Å; L175-L179 WeakPolarHBondContact O-CB 3.02Å; L175-L179 VanDerWaalsContact O-CG 3.24Å; L175-L179 WeakPolarHBondContact O-CG 3.34Å; L175-L179 PolarHBondContact O-N 3.1Å; Y177-L179 VanDerWaalsContact C-N 3.33Å; Y177-L179 PolarHBondContact O-N 3.01Å; L179-L185 HydrophobicContact CD2-CD2 4.34Å; L179-L185 HydrophobicContact CD2-CG 4.07Å; L179-A186 HydrophobicContact CB-CB 4.08Å; L179-A186 PolarHBondContact O-N 2.93Å; L179-A189 HydrophobicContact CD2-CB 3.78Å; L179-L191 HydrophobicContact CD1-CD2 4.49Å; L179-L209 HydrophobicContact CD1-CB 3.98Å
180	R	94.5	Very high	94.3	Very high	132 Å²	132	40.5 Å²	40.5	50%	0.498	20%	0.204	S	C	.	.	H	α-helix	trans	-89.9	-17.6	178.5	-72.5	-177.6	168.7	-162.1	0.8	114	F176 Y177 T178 F182	F176-R180 VanDerWaalsContact CE2-NE 3.28Å; F176-R180 WeakPolarHBondContact O-CG 3.42Å; F176-R180 PolarHBondContact O-N 3.2Å; Y177-R180 CarbonylContact O-C 3.55Å; Y177-R180 PolarHBondContact O-N 2.97Å; T178-R180 PolarHBondContact O-N 2.98Å; R180-F182 PolarHBondContact O-N 2.87Å
181	Q	91.8	Very high	94.4	Very high	83 Å²	83	40.3 Å²	40.3	39%	0.388	20%	0.204	S	C	.	.	H	α-helix	trans	-66.9	-26.7	176.5	-174	176.6	-13.1	0	0	112	Y177 T178	Y177-Q181 PolarHBondContact O-N 3.25Å; T178-Q181 WeakPolarHBondContact O-CB 3.32Å; T178-Q181 PolarHBondContact O-N 2.7Å
182	F	91.2	Very high	94.4	Very high	25 Å²	25	40.3 Å²	40.3	11%	0.11	20%	0.203	C	C	.	.	S	Bend	trans	-112.3	120.7	-178.9	-59.2	-74.3	0	0	0	110.6	I78 T178 R180 G184 L185 F233	I78-F182 HydrophobicContact CG2-CE2 4.3Å; I78-F182 HydrophobicContact CG2-CZ 4.17Å; T178-F182 HydrophobicContact CG2-CE2 4.32Å; T178-F182 WeakPolarHBondContact O-CD2 3.21Å; R180-F182 PolarHBondContact O-N 2.87Å; F182-G184 PolarHBondContact O-N 3.17Å; F182-L185 HydrophobicContact CB-CB 3.82Å; F182-L185 HydrophobicContact CB-CD2 3.88Å; F182-L185 HydrophobicContact CB-CG 4.46Å; F182-L185 HydrophobicContact CD2-CD2 3.67Å; F182-L185 HydrophobicContact CG-CD2 4.15Å; F182-L185 WeakPolarHBondContact O-CB 3.4Å; F182-L185 PolarHBondContact O-N 2.82Å; F182-F233 HydrophobicContact CB-CE1 4.06Å; F182-F233 HydrophobicContact CB-CZ 4.5Å; F182-F233 HydrophobicContact CD1-CD1 4.34Å; F182-F233 AromaticContact CD1-CE1 3.65Å; F182-F233 HydrophobicContact CD1-CE1 3.65Å; F182-F233 AromaticContact CD2-CD1 3.78Å; F182-F233 HydrophobicContact CD2-CD1 3.78Å; F182-F233 AromaticContact CD2-CE1 3.77Å; F182-F233 HydrophobicContact CD2-CE1 3.77Å; F182-F233 HydrophobicContact CE1-CD1 4.36Å; F182-F233 AromaticContact CE1-CE1 3.97Å; F182-F233 HydrophobicContact CE1-CE1 3.97Å; F182-F233 AromaticContact CE2-CD1 3.81Å; F182-F233 HydrophobicContact CE2-CD1 3.81Å; F182-F233 HydrophobicContact CE2-CE1 4.09Å; F182-F233 HydrophobicContact CG-CD1 4.05Å; F182-F233 AromaticContact CG-CE1 3.53Å; F182-F233 HydrophobicContact CG-CE1 3.53Å; F182-F233 HydrophobicContact CG-CZ 4.41Å; F182-F233 HydrophobicContact CZ-CD1 4.1Å; F182-F233 HydrophobicContact CZ-CE1 4.18Å
183	P	88.7	Confident	94.4	Very high	134 Å²	134	40.5 Å²	40.5	87%	0.87	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	130.3	179	-26.6	34.6	0	0	0	112.2	L185	P183-L185 PolarHBondContact O-N 2.89Å
184	G	86.4	Confident	94.3	Very high	35 Å²	35	41.2 Å²	41.2	36%	0.361	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	-19.4	178.5	0	0	0	0	0	115.7	F182 A186 H187 E188	F182-G184 PolarHBondContact O-N 3.17Å; G184-A186 VanDerWaalsContact C-N 3.35Å; G184-A186 PolarHBondContact O-N 3.05Å; G184-H187 PolarHBondContact O-N 3.15Å; G184-E188 PolarHBondContact O-N 3.32Å
185	L	92.1	Very high	94.1	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-60.3	-40.8	-170.8	-172.6	65.7	0	0	0	113	V152 L179 F182 P183 H187 E188 A189 F233	V152-L185 HydrophobicContact CG1-CD1 3.56Å; L179-L185 HydrophobicContact CD2-CD2 4.34Å; L179-L185 HydrophobicContact CD2-CG 4.07Å; F182-L185 HydrophobicContact CB-CB 3.82Å; F182-L185 HydrophobicContact CB-CD2 3.88Å; F182-L185 HydrophobicContact CB-CG 4.46Å; F182-L185 HydrophobicContact CD2-CD2 3.67Å; F182-L185 HydrophobicContact CG-CD2 4.15Å; F182-L185 WeakPolarHBondContact O-CB 3.4Å; F182-L185 PolarHBondContact O-N 2.82Å; P183-L185 PolarHBondContact O-N 2.89Å; L185-H187 PolarHBondContact O-N 2.84Å; L185-H187 VanDerWaalsContact O-N 3.13Å; L185-E188 PolarHBondContact O-N 3.15Å; L185-A189 HydrophobicContact CD1-CB 3.7Å; L185-A189 HydrophobicContact CG-CB 3.93Å; L185-A189 WeakPolarHBondContact O-CB 3.26Å; L185-A189 PolarHBondContact O-N 2.82Å; L185-F233 HydrophobicContact CD1-CD2 3.58Å; L185-F233 HydrophobicContact CD1-CE2 3.51Å; L185-F233 HydrophobicContact CD1-CG 4.21Å; L185-F233 HydrophobicContact CD1-CZ 4.07Å; L185-F233 HydrophobicContact CD2-CD1 3.98Å; L185-F233 HydrophobicContact CD2-CD2 4.2Å; L185-F233 HydrophobicContact CD2-CE1 4.21Å; L185-F233 HydrophobicContact CD2-CE2 4.43Å; L185-F233 HydrophobicContact CD2-CG 3.98Å; L185-F233 HydrophobicContact CD2-CZ 4.43Å
186	A	90	Very high	93.8	Very high	29 Å²	29	44.2 Å²	44.2	24%	0.24	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-25.7	177.8	0	0	0	0	0	114.8	L179 G184	L179-A186 HydrophobicContact CB-CB 4.08Å; L179-A186 PolarHBondContact O-N 2.93Å; G184-A186 VanDerWaalsContact C-N 3.35Å; G184-A186 PolarHBondContact O-N 3.05Å
187	H	89.5	Confident	93.6	Very high	153 Å²	153	48.1 Å²	48.1	71%	0.708	25%	0.245	S	C	*	.	H	α-helix	trans	-93.4	-22.8	-179.2	-61.6	-63.9	0	0	0	113	G184 L185 P211	G184-H187 PolarHBondContact O-N 3.15Å; L185-H187 PolarHBondContact O-N 2.84Å; L185-H187 VanDerWaalsContact O-N 3.13Å; H187-P211 VanDerWaalsContact O-CG 3.31Å; H187-P211 WeakPolarHBondContact O-CG 3.31Å
188	E	90.5	Very high	93.5	Very high	107 Å²	107	47.1 Å²	47.1	50%	0.5	26%	0.257	S	S	.	.	H	α-helix	trans	-109	-28.7	-171.1	-64.4	177.9	-173.2	0	0	113.4	V152 G184 L185 K212	V152-E188 HydrophobicContact CB-CB 4.44Å; V152-E188 HydrophobicContact CG2-CB 4.19Å; G184-E188 PolarHBondContact O-N 3.32Å; L185-E188 PolarHBondContact O-N 3.15Å; E188-K212 VanDerWaalsContact O-CE 3.25Å; E188-K212 WeakPolarHBondContact O-CE 3.29Å; E188-K212 PolarHBondContact O-NZ 2.95Å
189	A	95.4	Very high	93.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	135.5	-170.4	0	0	0	0	0	111.9	V152 L154 L179 L185 S210	V152-A189 CarbonylContact O-C 3.56Å; V152-A189 VanDerWaalsContact O-CA 3.22Å; V152-A189 WeakPolarHBondContact O-CA 3.44Å; L154-A189 HydrophobicContact CB-CB 4.36Å; L179-A189 HydrophobicContact CD2-CB 3.78Å; L185-A189 HydrophobicContact CD1-CB 3.7Å; L185-A189 HydrophobicContact CG-CB 3.93Å; L185-A189 WeakPolarHBondContact O-CB 3.26Å; L185-A189 PolarHBondContact O-N 2.82Å; A189-S210 WeakPolarHBondContact O-CB 3.46Å; A189-S210 PolarHBondContact O-OG 2.88Å
190	R	97.6	Very high	93.3	Very high	53 Å²	53	53.2 Å²	53.2	20%	0.2	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	137.9	158.5	-176.8	-175.9	-62.3	-105.2	6.3	108.9	D151 V152 L154 F192 K212 Q213	D151-R190 HydrophobicContact CB-CB 4.08Å; D151-R190 IonicContact OD2-CZ 3.37Å; D151-R190 VanDerWaalsContact OD2-CZ 3.22Å; D151-R190 IonicContact OD2-NE 3.55Å; D151-R190 PolarHBondContact OD2-NE 3.27Å; D151-R190 IonicContact OD2-NH2 2.69Å; D151-R190 PolarHBondContact OD2-NH2 3.3Å; V152-R190 PolarHBondContact O-N 3.02Å; L154-R190 PolarHBondContact N-O 2.95Å; R190-F192 HydrophobicContact CB-CD2 4.44Å; R190-F192 HydrophobicContact CB-CE2 3.78Å; R190-F192 HydrophobicContact CB-CZ 4.45Å; R190-F192 HydrophobicContact CG-CD2 4.42Å; R190-F192 HydrophobicContact CG-CE2 3.89Å; R190-F192 HydrophobicContact CG-CZ 4.26Å; R190-F192 VanDerWaalsContact O-CD2 3.29Å; R190-F192 WeakPolarHBondContact O-CD2 3.39Å; R190-K212 HydrophobicContact CB-CB 3.9Å; R190-K212 HydrophobicContact CB-CD 3.99Å; R190-K212 HydrophobicContact CG-CB 4.05Å; R190-Q213 WeakPolarHBondContact CD-O 3.26Å; R190-Q213 VanDerWaalsContact CG-O 3.26Å; R190-Q213 WeakPolarHBondContact CG-O 3.46Å; R190-Q213 PolarHBondContact NH1-O 3.49Å
191	L	98.3	Very high	93.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	135.8	174.5	-55.7	-174.5	0	0	0	110.5	L154 L175 L179 F193 L209 P214 L215	L154-L191 HydrophobicContact CB-CD2 4.03Å; L154-L191 HydrophobicContact CD2-CD2 3.78Å; L154-L191 HydrophobicContact CG-CD2 4.2Å; L175-L191 HydrophobicContact CD1-CD1 4.44Å; L175-L191 HydrophobicContact CD2-CD2 4.09Å; L179-L191 HydrophobicContact CD1-CD2 4.49Å; L191-F193 HydrophobicContact CB-CE2 4.36Å; L191-F193 HydrophobicContact CB-CZ 4.16Å; L191-F193 HydrophobicContact CD1-CZ 4.06Å; L191-L209 HydrophobicContact CD1-CB 4.21Å; L191-L209 HydrophobicContact CD1-CD1 4.15Å; L191-P214 HydrophobicContact CB-CB 3.99Å; L191-P214 HydrophobicContact CB-CG 4.26Å; L191-P214 HydrophobicContact CD1-CG 4.32Å; L191-P214 CarbonylContact O-C 3.6Å; L191-P214 WeakPolarHBondContact O-CA 3.42Å; L191-L215 PolarHBondContact O-N 2.96Å
192	F	97.8	Very high	93.3	Very high	1 Å²	1	49 Å²	49	0%	0.004	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	121	176.2	-72.7	-95.8	0	0	0	109.7	V149 A153 L154 I155 A156 R190 L215 L220 F229	V149-F192 HydrophobicContact CG1-CZ 4.08Å; A153-F192 HydrophobicContact CB-CD2 3.56Å; A153-F192 HydrophobicContact CB-CE2 3.56Å; L154-F192 PolarHBondContact O-N 2.96Å; I155-F192 WeakPolarHBondContact CA-O 3.27Å; I155-F192 HydrophobicContact CG1-CB 4.06Å; A156-F192 PolarHBondContact N-O 3.42Å; R190-F192 HydrophobicContact CB-CD2 4.44Å; R190-F192 HydrophobicContact CB-CE2 3.78Å; R190-F192 HydrophobicContact CB-CZ 4.45Å; R190-F192 HydrophobicContact CG-CD2 4.42Å; R190-F192 HydrophobicContact CG-CE2 3.89Å; R190-F192 HydrophobicContact CG-CZ 4.26Å; R190-F192 VanDerWaalsContact O-CD2 3.29Å; R190-F192 WeakPolarHBondContact O-CD2 3.39Å; F192-L215 WeakPolarHBondContact CA-O 3.17Å; F192-L215 HydrophobicContact CD1-CB 3.98Å; F192-L215 HydrophobicContact CD1-CD1 4.44Å; F192-L215 HydrophobicContact CE1-CB 4.01Å; F192-L215 HydrophobicContact CE1-CD1 3.63Å; F192-L215 HydrophobicContact CE1-CG 4.42Å; F192-L215 HydrophobicContact CZ-CD1 4.02Å; F192-L220 HydrophobicContact CD1-CD2 3.91Å; F192-L220 HydrophobicContact CE1-CD2 3.86Å; F192-F229 HydrophobicContact CD1-CE1 4.07Å; F192-F229 HydrophobicContact CD1-CZ 4.35Å; F192-F229 HydrophobicContact CD2-CE1 4.45Å; F192-F229 AromaticContact CE1-CE1 3.71Å; F192-F229 HydrophobicContact CE1-CE1 3.71Å; F192-F229 HydrophobicContact CE1-CZ 4.27Å; F192-F229 HydrophobicContact CE2-CE1 4.11Å; F192-F229 HydrophobicContact CG-CE1 4.43Å; F192-F229 HydrophobicContact CZ-CD1 4.49Å; F192-F229 AromaticContact CZ-CE1 3.74Å; F192-F229 HydrophobicContact CZ-CE1 3.74Å
193	F	97.5	Very high	93.6	Very high	3 Å²	3	48 Å²	48	1%	0.013	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	118.1	-177.4	-64.8	-51.7	0	0	0	111.3	A156 R158 L175 L191 E195 F203 Y206 P214 L215 L216 R217	A156-F193 WeakPolarHBondContact O-CA 3.41Å; R158-F193 HydrophobicContact CG-CD1 3.84Å; R158-F193 HydrophobicContact CG-CE1 3.85Å; R158-F193 HydrophobicContact CG-CG 4.2Å; R158-F193 HydrophobicContact CG-CZ 4.21Å; L175-F193 HydrophobicContact CD1-CE1 4.2Å; L175-F193 HydrophobicContact CD1-CZ 4.2Å; L191-F193 HydrophobicContact CB-CE2 4.36Å; L191-F193 HydrophobicContact CB-CZ 4.16Å; L191-F193 HydrophobicContact CD1-CZ 4.06Å; F193-E195 WeakPolarHBondContact CB-OE2 3.47Å; F193-F203 HydrophobicContact CD2-CE2 4.08Å; F193-F203 HydrophobicContact CE2-CE2 4.14Å; F193-Y206 HydrophobicContact CE1-CD1 4.41Å; F193-Y206 HydrophobicContact CE2-CD1 4.04Å; F193-Y206 HydrophobicContact CE2-CG 4.18Å; F193-Y206 AromaticContact CZ-CD1 3.52Å; F193-Y206 HydrophobicContact CZ-CD1 3.52Å; F193-Y206 HydrophobicContact CZ-CE1 4.09Å; F193-Y206 HydrophobicContact CZ-CG 4.11Å; F193-P214 HydrophobicContact CD2-CB 4.32Å; F193-P214 HydrophobicContact CE2-CB 3.9Å; F193-L215 PolarHBondContact N-O 3.03Å; F193-L216 HydrophobicContact CB-CD2 3.97Å; F193-L216 HydrophobicContact CD2-CD2 4.04Å; F193-L216 HydrophobicContact CG-CD2 4.5Å; F193-R217 PolarHBondContact O-N 3.13Å
194	M	95.3	Very high	93.9	Very high	17 Å²	17	46.5 Å²	46.5	8%	0.084	28%	0.277	C	S	.	.			trans	-104.6	-1	-168.9	-56.3	-57.4	-65.6	0	0	114	Y86 F93 I155 A156 N157 G196 R217 L220	Y86-M194 HydrophobicContact CD1-CE 4.39Å; Y86-M194 HydrophobicContact CD2-CE 3.94Å; Y86-M194 HydrophobicContact CE1-CE 3.95Å; Y86-M194 HydrophobicContact CE2-CE 3.47Å; Y86-M194 VanDerWaalsContact CE2-CE 3.47Å; Y86-M194 HydrophobicContact CG-CE 4.38Å; Y86-M194 VanDerWaalsContact CZ-CE 3.48Å; F93-M194 HydrophobicContact CE2-CE 4.02Å; F93-M194 HydrophobicContact CE2-CG 4.26Å; F93-M194 HydrophobicContact CZ-CE 3.73Å; F93-M194 HydrophobicContact CZ-CG 4.02Å; F93-M194 HydrophobicContact CZ-SD 4.18Å; I155-M194 HydrophobicContact CG2-CG 3.68Å; A156-M194 PolarHBondContact O-N 3.47Å; N157-M194 WeakPolarHBondContact OD1-CA 3.34Å; N157-M194 WeakPolarHBondContact OD1-CB 3.47Å; N157-M194 PolarHBondContact OD1-N 3.11Å; M194-G196 VanDerWaalsContact C-N 3.27Å; M194-G196 PolarHBondContact O-N 3.12Å; M194-R217 HydrophobicContact CE-CG 4.09Å; M194-R217 WeakPolarHBondContact O-CD 3.21Å; M194-L220 HydrophobicContact CE-CD1 3.93Å; M194-L220 HydrophobicContact SD-CD1 3.84Å
195	E	93.5	Very high	94.4	Very high	30 Å²	30	45.4 Å²	45.4	14%	0.14	26%	0.263	C	S	.	.	S	Bend	trans	-72.3	-16.9	-177.3	72	-72.9	164.6	0	0	114.5	N157 R158 F193 W197	N157-E195 VanDerWaalsContact CA-OE2 3.31Å; N157-E195 WeakPolarHBondContact CA-OE2 3.44Å; N157-E195 HydrophobicContact CB-CB 4.07Å; N157-E195 PolarHBondContact OD1-N 3.17Å; N157-E195 VanDerWaalsContact OD1-N 3.14Å; R158-E195 IonicContact CZ-OE1 2.6Å; R158-E195 PolarHBondContact N-OE2 3.03Å; R158-E195 IonicContact NE-OE1 2.71Å; R158-E195 PolarHBondContact NE-OE1 2.97Å; R158-E195 IonicContact NH2-OE1 3.49Å; R158-E195 PolarHBondContact NH2-OE1 3.48Å; F193-E195 WeakPolarHBondContact CB-OE2 3.47Å; E195-W197 HydrophobicContact CG-CB 4.01Å; E195-W197 HydrophobicContact CG-CD2 3.5Å; E195-W197 VanDerWaalsContact CG-CD2 3.5Å; E195-W197 HydrophobicContact CG-CE3 3.53Å; E195-W197 HydrophobicContact CG-CG 3.69Å; E195-W197 HydrophobicContact CG-CZ3 4.3Å
196	G	92.5	Very high	94.7	Very high	35 Å²	35	45.2 Å²	45.2	36%	0.361	26%	0.262	S	S	.	.			trans	87	8.6	176.9	0	0	0	0	0	115.6	M194	M194-G196 VanDerWaalsContact C-N 3.27Å; M194-G196 PolarHBondContact O-N 3.12Å
197	W	93.6	Very high	95	Very high	93 Å²	93	46.6 Å²	46.6	35%	0.352	26%	0.262	S	S	.	.			trans	-74.9	154.1	172.7	-63.6	-17.9	0	0	0	112.7	R158 F159 P161 E195	R158-W197 HydrophobicContact CB-CE3 3.96Å; R158-W197 HydrophobicContact CB-CZ3 3.94Å; R158-W197 PolarHBondContact NH2-O 2.76Å; R158-W197 WeakPolarHBondContact O-CZ3 3.44Å; F159-W197 VanDerWaalsContact C-CZ3 3.43Å; F159-W197 WeakPolarHBondContact O-CH2 3.49Å; P161-W197 HydrophobicContact CB-CE3 3.98Å; P161-W197 HydrophobicContact CB-CZ3 4.18Å; P161-W197 VanDerWaalsContact CD-CE3 3.4Å; P161-W197 HydrophobicContact CG-CD2 3.96Å; P161-W197 HydrophobicContact CG-CE3 3.31Å; P161-W197 HydrophobicContact CG-CH2 4.42Å; P161-W197 HydrophobicContact CG-CZ3 3.63Å; E195-W197 HydrophobicContact CG-CB 4.01Å; E195-W197 HydrophobicContact CG-CD2 3.5Å; E195-W197 VanDerWaalsContact CG-CD2 3.5Å; E195-W197 HydrophobicContact CG-CE3 3.53Å; E195-W197 HydrophobicContact CG-CG 3.69Å; E195-W197 HydrophobicContact CG-CZ3 4.3Å
198	G	95.3	Very high	95.3	Very high	51 Å²	51	41 Å²	41	53%	0.526	24%	0.238	S	C	.	.			trans	-69.2	-176.5	168.4	0	0	0	0	0	112	R158 G200	R158-G198 PolarHBondContact NH1-O 3.05Å; R158-G198 VanDerWaalsContact NH1-O 3.11Å; R158-G198 PolarHBondContact NH2-O 2.89Å; G198-G200 PolarHBondContact O-N 3.25Å
199	E	95.4	Very high	95.6	Very high	89 Å²	89	36.4 Å²	36.4	42%	0.416	22%	0.216	S	C	.	.			trans	-59.3	-49.3	179.4	-67.6	-169.7	174.4	0	0	111	R158 F203 L216	R158-E199 PolarHBondContact NH1-O 3.02Å; E199-F203 HydrophobicContact CB-CB 3.71Å; E199-F203 HydrophobicContact CB-CD1 3.77Å; E199-F203 HydrophobicContact CB-CD2 4.11Å; E199-F203 HydrophobicContact CB-CE1 4.42Å; E199-F203 HydrophobicContact CB-CG 3.59Å; E199-F203 HydrophobicContact CG-CB 4.49Å; E199-F203 HydrophobicContact CG-CD1 3.58Å; E199-F203 HydrophobicContact CG-CD2 4.35Å; E199-F203 HydrophobicContact CG-CE1 3.78Å; E199-F203 HydrophobicContact CG-CG 3.89Å; E199-F203 HydrophobicContact CG-CZ 4.25Å; E199-F203 VanDerWaalsContact O-CB 3.31Å; E199-F203 WeakPolarHBondContact O-CB 3.39Å; E199-F203 WeakPolarHBondContact O-CD2 3.43Å; E199-L216 HydrophobicContact CG-CD1 3.77Å
200	G	93	Very high	95.5	Very high	42 Å²	42	36.7 Å²	36.7	43%	0.433	22%	0.218	S	C	.	.			trans	75.1	174.5	-177.8	0	0	0	0	0	112.4	G198 H202	G198-G200 PolarHBondContact O-N 3.25Å; G200-H202 PolarHBondContact O-N 2.99Å
201	A	90.8	Very high	95.2	Very high	82 Å²	82	39.1 Å²	39.1	68%	0.678	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.5	-170.9	0	0	0	0	0	114.6
202	H	95.4	Very high	95	Very high	45 Å²	45	41.7 Å²	41.7	21%	0.208	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	12.2	-173.1	-58.8	-42.2	0	0	0	113.3	P161 V167 G200 D204 L205 Y206	P161-H202 PolarHBondContact O-CD2 3.08Å; V167-H202 HydrophobicContact CG1-CB 4.16Å; V167-H202 HydrophobicContact CG2-CB 4.08Å; G200-H202 PolarHBondContact O-N 2.99Å; H202-D204 VanDerWaalsContact C-N 3.25Å; H202-D204 PolarHBondContact O-N 2.87Å; H202-L205 HydrophobicContact CB-CD1 4.27Å; H202-L205 WeakPolarHBondContact O-CB 3.46Å; H202-L205 PolarHBondContact O-N 2.82Å; H202-L205 VanDerWaalsContact O-N 3.14Å; H202-Y206 WeakPolarHBondContact O-CD2 3.37Å
203	F	96.6	Very high	94.8	Very high	5 Å²	5	46.8 Å²	46.8	2%	0.022	28%	0.276	C	S	.	.	H	α-helix	trans	-59.3	-34.8	-174	-160.9	-119.2	0	0	0	113.8	F193 E199 L205 Y206 P214 L216	F193-F203 HydrophobicContact CD2-CE2 4.08Å; F193-F203 HydrophobicContact CE2-CE2 4.14Å; E199-F203 HydrophobicContact CB-CB 3.71Å; E199-F203 HydrophobicContact CB-CD1 3.77Å; E199-F203 HydrophobicContact CB-CD2 4.11Å; E199-F203 HydrophobicContact CB-CE1 4.42Å; E199-F203 HydrophobicContact CB-CG 3.59Å; E199-F203 HydrophobicContact CG-CB 4.49Å; E199-F203 HydrophobicContact CG-CD1 3.58Å; E199-F203 HydrophobicContact CG-CD2 4.35Å; E199-F203 HydrophobicContact CG-CE1 3.78Å; E199-F203 HydrophobicContact CG-CG 3.89Å; E199-F203 HydrophobicContact CG-CZ 4.25Å; E199-F203 VanDerWaalsContact O-CB 3.31Å; E199-F203 WeakPolarHBondContact O-CB 3.39Å; E199-F203 WeakPolarHBondContact O-CD2 3.43Å; F203-L205 PolarHBondContact O-N 3.37Å; F203-L205 VanDerWaalsContact O-N 3.16Å; F203-Y206 HydrophobicContact CD2-CD2 4.3Å; F203-Y206 WeakPolarHBondContact O-CB 3.42Å; F203-Y206 WeakPolarHBondContact O-CD2 3.44Å; F203-Y206 PolarHBondContact O-N 2.7Å; F203-P214 HydrophobicContact CE2-CB 4.43Å; F203-P214 HydrophobicContact CZ-CB 3.84Å; F203-L216 HydrophobicContact CE2-CD2 3.7Å; F203-L216 HydrophobicContact CE2-CG 4.3Å; F203-L216 HydrophobicContact CZ-CD2 4.01Å; F203-L216 HydrophobicContact CZ-CG 4.16Å
204	D	95.8	Very high	94.8	Very high	102 Å²	102	46.9 Å²	46.9	55%	0.545	28%	0.277	S	S	.	.	H	α-helix	trans	-62.3	-25.1	-178.8	-66.8	-31.8	0	0	0	113	H202 Y206 K207	H202-D204 VanDerWaalsContact C-N 3.25Å; H202-D204 PolarHBondContact O-N 2.87Å; D204-Y206 VanDerWaalsContact C-N 3.3Å; D204-Y206 PolarHBondContact O-N 3.12Å; D204-K207 WeakPolarHBondContact O-CB 3.32Å; D204-K207 PolarHBondContact O-N 3.17Å; D204-K207 WeakPolarHBondContact OD1-CD 3.4Å; D204-K207 WeakPolarHBondContact OD1-CE 3.42Å; D204-K207 IonicContact OD1-NZ 2.64Å; D204-K207 PolarHBondContact OD1-NZ 2.91Å
205	L	97.4	Very high	94.9	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.063	28%	0.28	C	S	.	.	H	α-helix	trans	-66.8	-32.8	175.6	-58.8	179.8	0	0	0	112.2	L164 V167 F168 L172 H202 F203 K207 L208 M271 F328	L164-L205 HydrophobicContact CD1-CD1 4.4Å; V167-L205 HydrophobicContact CG1-CD1 4.2Å; F168-L205 HydrophobicContact CE2-CD1 3.69Å; F168-L205 HydrophobicContact CZ-CD1 4.05Å; L172-L205 HydrophobicContact CD1-CB 3.69Å; L172-L205 HydrophobicContact CD1-CD1 4.01Å; L172-L205 HydrophobicContact CD1-CG 4.48Å; L172-L205 HydrophobicContact CD2-CB 4.2Å; H202-L205 HydrophobicContact CB-CD1 4.27Å; H202-L205 WeakPolarHBondContact O-CB 3.46Å; H202-L205 PolarHBondContact O-N 2.82Å; H202-L205 VanDerWaalsContact O-N 3.14Å; F203-L205 PolarHBondContact O-N 3.37Å; F203-L205 VanDerWaalsContact O-N 3.16Å; L205-K207 VanDerWaalsContact C-N 3.32Å; L205-L208 HydrophobicContact CD2-CD1 4.29Å; L205-L208 WeakPolarHBondContact O-CB 3.46Å; L205-L208 PolarHBondContact O-N 3.41Å; L205-M271 HydrophobicContact CB-CE 4.46Å; L205-M271 HydrophobicContact CD2-CE 4.12Å; L205-F328 HydrophobicContact CD1-CD1 4.49Å; L205-F328 HydrophobicContact CD1-CE1 4.3Å; L205-F328 HydrophobicContact CD2-CD1 3.62Å; L205-F328 HydrophobicContact CD2-CE1 3.86Å; L205-F328 HydrophobicContact CD2-CG 4.48Å
206	Y	97.8	Very high	95	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-71.4	-30.5	176.8	-58.5	-93.8	0	0	0	111.5	R158 V167 D171 L172 L175 F193 H202 F203 D204 L208 L209	R158-Y206 VanDerWaalsContact CD-CZ 3.44Å; R158-Y206 WeakPolarHBondContact CD-OH 3.49Å; R158-Y206 HydrophobicContact CG-CE1 3.76Å; V167-Y206 HydrophobicContact CG1-CE2 4.27Å; D171-Y206 HydrophobicContact CB-CE1 3.59Å; D171-Y206 PolarHBondContact OD2-OH 3.16Å; L172-Y206 HydrophobicContact CD2-CD1 3.64Å; L172-Y206 HydrophobicContact CD2-CD2 4.41Å; L172-Y206 HydrophobicContact CD2-CE1 3.97Å; L172-Y206 HydrophobicContact CD2-CG 3.92Å; L175-Y206 HydrophobicContact CD1-CD1 3.9Å; L175-Y206 HydrophobicContact CD1-CE1 4.18Å; F193-Y206 HydrophobicContact CE1-CD1 4.41Å; F193-Y206 HydrophobicContact CE2-CD1 4.04Å; F193-Y206 HydrophobicContact CE2-CG 4.18Å; F193-Y206 AromaticContact CZ-CD1 3.52Å; F193-Y206 HydrophobicContact CZ-CD1 3.52Å; F193-Y206 HydrophobicContact CZ-CE1 4.09Å; F193-Y206 HydrophobicContact CZ-CG 4.11Å; H202-Y206 WeakPolarHBondContact O-CD2 3.37Å; F203-Y206 HydrophobicContact CD2-CD2 4.3Å; F203-Y206 WeakPolarHBondContact O-CB 3.42Å; F203-Y206 WeakPolarHBondContact O-CD2 3.44Å; F203-Y206 PolarHBondContact O-N 2.7Å; D204-Y206 VanDerWaalsContact C-N 3.3Å; D204-Y206 PolarHBondContact O-N 3.12Å; Y206-L208 PolarHBondContact O-N 3.25Å; Y206-L209 WeakPolarHBondContact O-CB 3.43Å; Y206-L209 PolarHBondContact O-N 2.74Å
207	K	96.5	Very high	95.2	Very high	57 Å²	57	48.3 Å²	48.3	25%	0.248	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-21.5	175.3	-58.8	178	-177.7	162.9	0	112.1	D204 L205 L209 P214	D204-K207 WeakPolarHBondContact O-CB 3.32Å; D204-K207 PolarHBondContact O-N 3.17Å; D204-K207 WeakPolarHBondContact OD1-CD 3.4Å; D204-K207 WeakPolarHBondContact OD1-CE 3.42Å; D204-K207 IonicContact OD1-NZ 2.64Å; D204-K207 PolarHBondContact OD1-NZ 2.91Å; L205-K207 VanDerWaalsContact C-N 3.32Å; K207-L209 VanDerWaalsContact C-N 3.31Å; K207-L209 PolarHBondContact O-N 3.09Å; K207-P214 HydrophobicContact CG-CG 4.34Å
208	L	96	Very high	95.2	Very high	37 Å²	37	47.3 Å²	47.3	19%	0.194	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-23	178.7	-54.6	-179.8	0	0	0	113.2	L205 Y206 F270 M271 K274 L275	L205-L208 HydrophobicContact CD2-CD1 4.29Å; L205-L208 WeakPolarHBondContact O-CB 3.46Å; L205-L208 PolarHBondContact O-N 3.41Å; Y206-L208 PolarHBondContact O-N 3.25Å; L208-F270 VanDerWaalsContact O-CZ 3.3Å; L208-F270 WeakPolarHBondContact O-CZ 3.4Å; L208-M271 HydrophobicContact CD1-CE 3.77Å; L208-M271 HydrophobicContact CD1-SD 4.29Å; L208-K274 HydrophobicContact CB-CB 4.06Å; L208-K274 HydrophobicContact CB-CG 4.41Å; L208-K274 HydrophobicContact CD1-CB 4.25Å; L208-K274 HydrophobicContact CD2-CB 4.23Å; L208-K274 HydrophobicContact CG-CB 4.4Å; L208-L275 HydrophobicContact CD1-CD2 3.68Å; L208-L275 HydrophobicContact CD1-CG 3.9Å
209	L	96.1	Very high	95.1	Very high	9 Å²	9	48 Å²	48	5%	0.047	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-21.8	-173.1	-66.8	172.9	0	0	0	113.7	L172 L175 F176 L179 L191 Y206 K207 F270	L172-L209 HydrophobicContact CD2-CD1 3.7Å; L172-L209 HydrophobicContact CD2-CG 4.35Å; L175-L209 HydrophobicContact CB-CD1 3.64Å; L175-L209 HydrophobicContact CD1-CD1 3.86Å; L175-L209 HydrophobicContact CG-CD1 4.37Å; F176-L209 HydrophobicContact CB-CD2 3.89Å; F176-L209 HydrophobicContact CD2-CD2 4.47Å; L179-L209 HydrophobicContact CD1-CB 3.98Å; L191-L209 HydrophobicContact CD1-CB 4.21Å; L191-L209 HydrophobicContact CD1-CD1 4.15Å; Y206-L209 WeakPolarHBondContact O-CB 3.43Å; Y206-L209 PolarHBondContact O-N 2.74Å; K207-L209 VanDerWaalsContact C-N 3.31Å; K207-L209 PolarHBondContact O-N 3.09Å; L209-F270 HydrophobicContact CD2-CE1 3.86Å; L209-F270 HydrophobicContact CD2-CZ 4.42Å
210	S	93.9	Very high	95	Very high	7 Å²	7	43.8 Å²	43.8	5%	0.049	25%	0.253	C	S	.	.			trans	-142.8	146.9	-176.3	167.4	0	0	0	0	110.8	A189 K212	A189-S210 WeakPolarHBondContact O-CB 3.46Å; A189-S210 PolarHBondContact O-OG 2.88Å; S210-K212 PolarHBondContact O-N 3.43Å; S210-K212 PolarHBondContact OG-N 2.82Å; S210-K212 PolarHBondContact OG-O 2.99Å
211	P	90.8	Very high	94.9	Very high	104 Å²	104	47.1 Å²	47.1	68%	0.675	26%	0.256	S	S	*	.	S	Bend	trans	-67.1	-10.9	170.3	29.3	-35.3	0	0	0	113.6	H187	H187-P211 VanDerWaalsContact O-CG 3.31Å; H187-P211 WeakPolarHBondContact O-CG 3.31Å
212	K	94.2	Very high	94.9	Very high	54 Å²	54	48.9 Å²	48.9	24%	0.235	26%	0.258	C	S	.	.	S	Bend	trans	-103.8	136.2	-178.4	-61.2	-178	-178.6	178.1	0	110.6	D151 E188 R190 S210 P214	D151-K212 HydrophobicContact CB-CD 4.25Å; D151-K212 WeakPolarHBondContact OD1-CE 3.49Å; D151-K212 IonicContact OD1-NZ 2.74Å; D151-K212 PolarHBondContact OD1-NZ 2.86Å; E188-K212 VanDerWaalsContact O-CE 3.25Å; E188-K212 WeakPolarHBondContact O-CE 3.29Å; E188-K212 PolarHBondContact O-NZ 2.95Å; R190-K212 HydrophobicContact CB-CB 3.9Å; R190-K212 HydrophobicContact CB-CD 3.99Å; R190-K212 HydrophobicContact CG-CB 4.05Å; S210-K212 PolarHBondContact O-N 3.43Å; S210-K212 PolarHBondContact OG-N 2.82Å; S210-K212 PolarHBondContact OG-O 2.99Å; K212-P214 WeakPolarHBondContact O-CD 3.37Å
213	Q	93.9	Very high	94.7	Very high	108 Å²	108	50.5 Å²	50.5	51%	0.505	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-57.3	123.6	177	-73.2	-64.6	-26	0	0	111.3	R190	R190-Q213 WeakPolarHBondContact CD-O 3.26Å; R190-Q213 VanDerWaalsContact CG-O 3.26Å; R190-Q213 WeakPolarHBondContact CG-O 3.46Å; R190-Q213 PolarHBondContact NH1-O 3.49Å
214	P	97.1	Very high	94.6	Very high	4 Å²	4	51.1 Å²	51.1	3%	0.026	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-55.8	144.8	171.7	-24.5	35.4	0	0	0	111.5	L191 F193 F203 K207 K212	L191-P214 HydrophobicContact CB-CB 3.99Å; L191-P214 HydrophobicContact CB-CG 4.26Å; L191-P214 HydrophobicContact CD1-CG 4.32Å; L191-P214 CarbonylContact O-C 3.6Å; L191-P214 WeakPolarHBondContact O-CA 3.42Å; F193-P214 HydrophobicContact CD2-CB 4.32Å; F193-P214 HydrophobicContact CE2-CB 3.9Å; F203-P214 HydrophobicContact CE2-CB 4.43Å; F203-P214 HydrophobicContact CZ-CB 3.84Å; K207-P214 HydrophobicContact CG-CG 4.34Å; K212-P214 WeakPolarHBondContact O-CD 3.37Å
215	L	96.9	Very high	94.6	Very high	31 Å²	31	53.3 Å²	53.3	16%	0.162	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134.4	176.6	-71.4	174	0	0	0	111.3	L191 F192 F193 Q219 L220 L223	L191-L215 PolarHBondContact O-N 2.96Å; F192-L215 WeakPolarHBondContact CA-O 3.17Å; F192-L215 HydrophobicContact CD1-CB 3.98Å; F192-L215 HydrophobicContact CD1-CD1 4.44Å; F192-L215 HydrophobicContact CE1-CB 4.01Å; F192-L215 HydrophobicContact CE1-CD1 3.63Å; F192-L215 HydrophobicContact CE1-CG 4.42Å; F192-L215 HydrophobicContact CZ-CD1 4.02Å; F193-L215 PolarHBondContact N-O 3.03Å; L215-Q219 HydrophobicContact CD2-CB 4.4Å; L215-L220 HydrophobicContact CB-CD2 4.23Å; L215-L220 HydrophobicContact CD1-CD2 4.39Å; L215-L223 HydrophobicContact CD1-CD1 4.08Å
216	L	96.9	Very high	94.6	Very high	10 Å²	10	52.9 Å²	52.9	5%	0.052	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	150.2	174.8	-58.2	177.5	0	0	0	110.6	F193 E199 F203 A218 Q219 L220	F193-L216 HydrophobicContact CB-CD2 3.97Å; F193-L216 HydrophobicContact CD2-CD2 4.04Å; F193-L216 HydrophobicContact CG-CD2 4.5Å; E199-L216 HydrophobicContact CG-CD1 3.77Å; F203-L216 HydrophobicContact CE2-CD2 3.7Å; F203-L216 HydrophobicContact CE2-CG 4.3Å; F203-L216 HydrophobicContact CZ-CD2 4.01Å; F203-L216 HydrophobicContact CZ-CG 4.16Å; L216-A218 PolarHBondContact O-N 3.2Å; L216-A218 VanDerWaalsContact O-N 3.09Å; L216-Q219 HydrophobicContact CB-CG 4.41Å; L216-Q219 WeakPolarHBondContact O-CB 3.21Å; L216-Q219 PolarHBondContact O-N 2.7Å; L216-L220 PolarHBondContact O-N 3.35Å
217	R	95.2	Very high	94.6	Very high	72 Å²	72	52.9 Å²	52.9	27%	0.272	28%	0.275	S	S	.	.	H	α-helix	trans	-46.4	-43.2	176.2	-171.2	173.8	65.5	154.2	6.4	113.7	E91 F193 M194 Q219 L220	E91-R217 IonicContact OE2-CZ 2.92Å; E91-R217 IonicContact OE2-NH1 2.69Å; E91-R217 PolarHBondContact OE2-NH1 3.3Å; E91-R217 IonicContact OE2-NH2 2.69Å; F193-R217 PolarHBondContact O-N 3.13Å; M194-R217 HydrophobicContact CE-CG 4.09Å; M194-R217 WeakPolarHBondContact O-CD 3.21Å; R217-Q219 VanDerWaalsContact C-N 3.27Å; R217-Q219 PolarHBondContact O-N 3.22Å; R217-L220 WeakPolarHBondContact O-CB 3.49Å; R217-L220 PolarHBondContact O-N 2.97Å
218	A	93.6	Very high	94.6	Very high	71 Å²	71	50.2 Å²	50.2	59%	0.587	26%	0.263	S	S	*	.	H	α-helix	trans	-62.8	-33.2	-179.8	0	0	0	0	0	112.9	L216 L220	L216-A218 PolarHBondContact O-N 3.2Å; L216-A218 VanDerWaalsContact O-N 3.09Å; A218-L220 VanDerWaalsContact C-N 3.32Å
219	Q	94.4	Very high	94.7	Very high	66 Å²	66	48.5 Å²	48.5	31%	0.308	25%	0.254	S	S	.	.	H	α-helix	trans	-74.3	-24.4	179.5	-65.3	166.6	-35.6	0	0	111.7	L215 L216 R217 K221 T222	L215-Q219 HydrophobicContact CD2-CB 4.4Å; L216-Q219 HydrophobicContact CB-CG 4.41Å; L216-Q219 WeakPolarHBondContact O-CB 3.21Å; L216-Q219 PolarHBondContact O-N 2.7Å; R217-Q219 VanDerWaalsContact C-N 3.27Å; R217-Q219 PolarHBondContact O-N 3.22Å; Q219-K221 PolarHBondContact O-N 3.06Å; Q219-T222 PolarHBondContact O-N 3.31Å; Q219-T222 VanDerWaalsContact O-N 3.1Å; Q219-T222 PolarHBondContact O-OG1 3.23Å
220	L	93.4	Very high	94.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-29	179	-58.8	-172.5	0	0	0	113	Y86 N88 F192 M194 L215 L216 R217 A218 T222 L223 L227	Y86-L220 HydrophobicContact CD1-CD1 4.15Å; Y86-L220 HydrophobicContact CE1-CD1 4.09Å; N88-L220 PolarHBondContact ND2-O 3.24Å; N88-L220 WeakPolarHBondContact OD1-CB 3.46Å; F192-L220 HydrophobicContact CD1-CD2 3.91Å; F192-L220 HydrophobicContact CE1-CD2 3.86Å; M194-L220 HydrophobicContact CE-CD1 3.93Å; M194-L220 HydrophobicContact SD-CD1 3.84Å; L215-L220 HydrophobicContact CB-CD2 4.23Å; L215-L220 HydrophobicContact CD1-CD2 4.39Å; L216-L220 PolarHBondContact O-N 3.35Å; R217-L220 WeakPolarHBondContact O-CB 3.49Å; R217-L220 PolarHBondContact O-N 2.97Å; A218-L220 VanDerWaalsContact C-N 3.32Å; L220-T222 PolarHBondContact O-N 3.48Å; L220-L223 HydrophobicContact CD2-CD1 3.97Å; L220-L223 WeakPolarHBondContact O-CB 3.46Å; L220-L223 PolarHBondContact O-N 3.42Å; L220-L227 HydrophobicContact CB-CD1 3.72Å; L220-L227 HydrophobicContact CD1-CD1 4.38Å; L220-L227 HydrophobicContact CD2-CD1 4.17Å; L220-L227 HydrophobicContact CG-CD1 4.3Å
221	K	90.3	Very high	94.7	Very high	113 Å²	113	52.1 Å²	52.1	49%	0.491	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.9	177	-62.9	-173.7	177.7	-175.9	0	112.3	N88 E91 Q219 L223	N88-K221 HydrophobicContact CB-CG 4.24Å; N88-K221 PolarHBondContact OD1-N 3.01Å; E91-K221 IonicContact OE1-NZ 3.29Å; E91-K221 PolarHBondContact OE1-NZ 3.24Å; Q219-K221 PolarHBondContact O-N 3.06Å; K221-L223 VanDerWaalsContact C-N 3.34Å
222	T	90.9	Very high	95	Very high	119 Å²	119	47.2 Å²	47.2	73%	0.73	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-18.9	178.6	70.8	0	0	0	0	113.3	Q219 L220	Q219-T222 PolarHBondContact O-N 3.31Å; Q219-T222 VanDerWaalsContact O-N 3.1Å; Q219-T222 PolarHBondContact O-OG1 3.23Å; L220-T222 PolarHBondContact O-N 3.48Å
223	L	91.7	Very high	95.2	Very high	78 Å²	78	46.1 Å²	46.1	41%	0.408	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-28.5	-176.1	-60	-179.6	0	0	0	113	L215 L220 K221 L227	L215-L223 HydrophobicContact CD1-CD1 4.08Å; L220-L223 HydrophobicContact CD2-CD1 3.97Å; L220-L223 WeakPolarHBondContact O-CB 3.46Å; L220-L223 PolarHBondContact O-N 3.42Å; K221-L223 VanDerWaalsContact C-N 3.34Å; L223-L227 HydrophobicContact CB-CD1 4.3Å; L223-L227 HydrophobicContact CB-CD2 3.57Å; L223-L227 HydrophobicContact CD1-CD1 4.45Å
224	G	92.8	Very high	95.4	Very high	19 Å²	19	41 Å²	41	20%	0.196	21%	0.21	C	C	.	.			trans	157.1	164.5	179.5	0	0	0	0	0	112.5	N88	N88-G224 PolarHBondContact ND2-O 3.02Å
225	R	96.1	Very high	95.3	Very high	148 Å²	148	40.8 Å²	40.8	56%	0.558	21%	0.209	S	C	*	.	S	Bend	trans	-73.4	-34.2	-179.3	-68.8	177.7	71.5	173.9	4.1	113.1	N88 E89 P144	N88-R225 PolarHBondContact N-O 3.16Å; E89-R225 IonicContact OE1-NH2 3.2Å; E89-R225 IonicContact OE2-CZ 2.86Å; E89-R225 IonicContact OE2-NE 2.77Å; E89-R225 IonicContact OE2-NH2 3.88Å; E89-R225 PolarHBondContact OE2-NH2 3.14Å; P144-R225 HydrophobicContact CB-CB 3.84Å; P144-R225 HydrophobicContact CG-CB 4.01Å
226	L	97.5	Very high	95.2	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.016	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	114.6	176.9	179.6	65.9	0	0	0	108.3	C85 I94 L140 M143 P144 P146 V147	C85-L226 HydrophobicContact CB-CD1 3.97Å; I94-L226 HydrophobicContact CD1-CD1 4.1Å; L140-L226 HydrophobicContact CD2-CD2 4.01Å; M143-L226 HydrophobicContact CB-CD2 4.25Å; P144-L226 HydrophobicContact CB-CB 4.39Å; P144-L226 WeakPolarHBondContact O-CD2 3.45Å; P146-L226 CarbonylContact C-O 3.54Å; P146-L226 WeakPolarHBondContact CA-O 3.45Å; P146-L226 HydrophobicContact CB-CD2 3.93Å; P146-L226 HydrophobicContact CB-CG 4.25Å; V147-L226 PolarHBondContact N-O 3.16Å
227	L	97.8	Very high	95	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.6	177.5	-61.8	171.1	0	0	0	109.2	C85 Y86 V147 V149 L220 L223	C85-L227 CarbonylContact C-O 3.5Å; C85-L227 WeakPolarHBondContact CA-O 3.21Å; C85-L227 WeakPolarHBondContact CB-O 3.34Å; Y86-L227 PolarHBondContact N-O 3.12Å; Y86-L227 PolarHBondContact O-N 3.15Å; V147-L227 HydrophobicContact CB-CD2 3.98Å; V147-L227 HydrophobicContact CG1-CD2 4.11Å; V147-L227 CarbonylContact O-C 3.58Å; V147-L227 WeakPolarHBondContact O-CA 3.44Å; V149-L227 HydrophobicContact CG2-CB 4.36Å; V149-L227 HydrophobicContact CG2-CD2 4.49Å; L220-L227 HydrophobicContact CB-CD1 3.72Å; L220-L227 HydrophobicContact CD1-CD1 4.38Å; L220-L227 HydrophobicContact CD2-CD1 4.17Å; L220-L227 HydrophobicContact CG-CD1 4.3Å; L223-L227 HydrophobicContact CB-CD1 4.3Å; L223-L227 HydrophobicContact CB-CD2 3.57Å; L223-L227 HydrophobicContact CD1-CD1 4.45Å
228	C	97.6	Very high	94.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	114.2	178.4	-67.4	0	0	0	0	111.1	L60 L84 C85 P146 V147 F148 V149	L60-C228 HydrophobicContact CD2-CB 4.47Å; L84-C228 CarbonylContact O-C 3.5Å; L84-C228 WeakPolarHBondContact O-CA 3.29Å; C85-C228 HydrophobicContact CB-CB 4.19Å; C85-C228 WeakPolarHBondContact CB-SG 3.43Å; C85-C228 WeakPolarHBondContact SG-CB 3.37Å; C85-C228 CovalentContact SG-SG 2.05Å; C85-C228 PolarHBondContact SG-SG 3.14Å; P146-C228 HydrophobicContact CB-CB 4.42Å; V147-C228 PolarHBondContact O-N 3.3Å; F148-C228 CarbonylContact C-O 3.47Å; F148-C228 VanDerWaalsContact CA-O 3.31Å; F148-C228 WeakPolarHBondContact CA-O 3.4Å; F148-C228 HydrophobicContact CD1-CB 3.67Å; F148-C228 HydrophobicContact CE1-CB 3.77Å; V149-C228 PolarHBondContact N-O 3.43Å
229	F	96.9	Very high	94.9	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	118	-178.6	-58.4	-84.7	0	0	0	110.2	W83 L84 F93 V149 A153 I155 F192 H231 A232	W83-F229 WeakPolarHBondContact CA-O 3.37Å; W83-F229 PolarHBondContact N-O 3.37Å; L84-F229 PolarHBondContact N-O 2.78Å; L84-F229 WeakPolarHBondContact O-CD2 3.23Å; L84-F229 PolarHBondContact O-N 2.66Å; F93-F229 HydrophobicContact CE1-CE2 4.16Å; V149-F229 HydrophobicContact CB-CD1 3.82Å; V149-F229 HydrophobicContact CB-CE1 4.2Å; V149-F229 HydrophobicContact CG1-CD1 3.96Å; V149-F229 HydrophobicContact CG1-CE1 4.16Å; V149-F229 HydrophobicContact CG2-CD1 3.96Å; V149-F229 HydrophobicContact CG2-CE1 3.92Å; A153-F229 HydrophobicContact CB-CD1 3.63Å; A153-F229 HydrophobicContact CB-CE1 4.07Å; A153-F229 HydrophobicContact CB-CG 4.35Å; I155-F229 HydrophobicContact CD1-CD2 4.49Å; I155-F229 HydrophobicContact CD1-CE2 4.4Å; F192-F229 HydrophobicContact CD1-CE1 4.07Å; F192-F229 HydrophobicContact CD1-CZ 4.35Å; F192-F229 HydrophobicContact CD2-CE1 4.45Å; F192-F229 AromaticContact CE1-CE1 3.71Å; F192-F229 HydrophobicContact CE1-CE1 3.71Å; F192-F229 HydrophobicContact CE1-CZ 4.27Å; F192-F229 HydrophobicContact CE2-CE1 4.11Å; F192-F229 HydrophobicContact CG-CE1 4.43Å; F192-F229 HydrophobicContact CZ-CD1 4.49Å; F192-F229 AromaticContact CZ-CE1 3.74Å; F192-F229 HydrophobicContact CZ-CE1 3.74Å; F229-H231 VanDerWaalsContact C-N 3.27Å; F229-H231 PolarHBondContact O-N 2.94Å; F229-A232 HydrophobicContact CB-CB 4.06Å
230	S	94	Very high	94.9	Very high	13 Å²	13	33.6 Å²	33.6	9%	0.091	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	-40.7	176.9	63.7	0	0	0	0	111.5	K82 W83 V149	K82-S230 VanDerWaalsContact CA-O 3.3Å; K82-S230 WeakPolarHBondContact CA-O 3.3Å; W83-S230 PolarHBondContact N-O 2.77Å; V149-S230 PolarHBondContact O-OG 3Å
231	H	96.2	Very high	95	Very high	80 Å²	80	33.8 Å²	33.8	37%	0.37	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	127.9	174.6	-63.2	83.7	0	0	0	109.5	F81 V152 A153 F229	F81-H231 WeakPolarHBondContact O-CA 3.49Å; V152-H231 HydrophobicContact CG1-CB 4.26Å; V152-H231 HydrophobicContact CG2-CB 4.31Å; A153-H231 PolarHBondContact N-O 3.28Å; F229-H231 VanDerWaalsContact C-N 3.27Å; F229-H231 PolarHBondContact O-N 2.94Å
232	A	97.8	Very high	95.3	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.008	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.3	175.7	0	0	0	0	0	111.5	R80 F81 L84 A153 I155 F229 V234	R80-A232 CarbonylContact C-O 3.59Å; R80-A232 WeakPolarHBondContact CA-O 3.46Å; F81-A232 HydrophobicContact CB-CB 4.34Å; F81-A232 PolarHBondContact N-O 2.97Å; F81-A232 PolarHBondContact O-N 2.77Å; L84-A232 HydrophobicContact CD2-CB 4.32Å; A153-A232 HydrophobicContact CB-CB 4.1Å; A153-A232 CarbonylContact O-C 3.59Å; A153-A232 WeakPolarHBondContact O-CA 3.3Å; I155-A232 HydrophobicContact CD1-CB 4.03Å; F229-A232 HydrophobicContact CB-CB 4.06Å; A232-V234 HydrophobicContact CB-CG2 4.37Å
233	F	98.1	Very high	95.5	Very high	30 Å²	30	23 Å²	23	13%	0.132	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.6	166.6	-68.5	-105.7	0	0	0	106.6	R80 V152 A153 L154 I155 F182 L185	R80-F233 VanDerWaalsContact CD-CE1 3.48Å; R80-F233 HydrophobicContact CG-CD1 3.66Å; R80-F233 HydrophobicContact CG-CE1 3.58Å; R80-F233 HydrophobicContact CG-CG 4.4Å; R80-F233 HydrophobicContact CG-CZ 4.25Å; V152-F233 HydrophobicContact CG1-CD2 3.9Å; V152-F233 HydrophobicContact CG1-CE2 3.78Å; A153-F233 PolarHBondContact O-N 2.8Å; L154-F233 CarbonylContact C-O 3.35Å; L154-F233 WeakPolarHBondContact CA-O 3.17Å; L154-F233 HydrophobicContact CD1-CB 3.77Å; I155-F233 PolarHBondContact N-O 2.93Å; F182-F233 HydrophobicContact CB-CE1 4.06Å; F182-F233 HydrophobicContact CB-CZ 4.5Å; F182-F233 HydrophobicContact CD1-CD1 4.34Å; F182-F233 AromaticContact CD1-CE1 3.65Å; F182-F233 HydrophobicContact CD1-CE1 3.65Å; F182-F233 AromaticContact CD2-CD1 3.78Å; F182-F233 HydrophobicContact CD2-CD1 3.78Å; F182-F233 AromaticContact CD2-CE1 3.77Å; F182-F233 HydrophobicContact CD2-CE1 3.77Å; F182-F233 HydrophobicContact CE1-CD1 4.36Å; F182-F233 AromaticContact CE1-CE1 3.97Å; F182-F233 HydrophobicContact CE1-CE1 3.97Å; F182-F233 AromaticContact CE2-CD1 3.81Å; F182-F233 HydrophobicContact CE2-CD1 3.81Å; F182-F233 HydrophobicContact CE2-CE1 4.09Å; F182-F233 HydrophobicContact CG-CD1 4.05Å; F182-F233 AromaticContact CG-CE1 3.53Å; F182-F233 HydrophobicContact CG-CE1 3.53Å; F182-F233 HydrophobicContact CG-CZ 4.41Å; F182-F233 HydrophobicContact CZ-CD1 4.1Å; F182-F233 HydrophobicContact CZ-CE1 4.18Å; L185-F233 HydrophobicContact CD1-CD2 3.58Å; L185-F233 HydrophobicContact CD1-CE2 3.51Å; L185-F233 HydrophobicContact CD1-CG 4.21Å; L185-F233 HydrophobicContact CD1-CZ 4.07Å; L185-F233 HydrophobicContact CD2-CD1 3.98Å; L185-F233 HydrophobicContact CD2-CD2 4.2Å; L185-F233 HydrophobicContact CD2-CE1 4.21Å; L185-F233 HydrophobicContact CD2-CE2 4.43Å; L185-F233 HydrophobicContact CD2-CG 3.98Å; L185-F233 HydrophobicContact CD2-CZ 4.43Å
234	V	97.9	Very high	95.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.2	-173.7	-168.7	0	0	0	0	109.1	C79 F81 L84 L117 L119 F130 I155 A232	C79-V234 PolarHBondContact N-O 2.54Å; C79-V234 PolarHBondContact O-N 3.22Å; F81-V234 HydrophobicContact CD2-CB 4.37Å; F81-V234 HydrophobicContact CD2-CG2 3.57Å; F81-V234 HydrophobicContact CE2-CB 4.08Å; F81-V234 HydrophobicContact CE2-CG2 3.66Å; L84-V234 HydrophobicContact CD2-CG2 4.18Å; L117-V234 HydrophobicContact CD1-CG1 4.1Å; L117-V234 HydrophobicContact CD2-CB 4.43Å; L117-V234 HydrophobicContact CD2-CG1 4.39Å; L117-V234 WeakPolarHBondContact CD2-O 3.19Å; L119-V234 HydrophobicContact CD2-CG1 3.66Å; F130-V234 HydrophobicContact CB-CG1 4.24Å; F130-V234 HydrophobicContact CD1-CG1 3.89Å; F130-V234 HydrophobicContact CD2-CG1 3.42Å; F130-V234 VanDerWaalsContact CD2-CG1 3.42Å; F130-V234 HydrophobicContact CE1-CG1 4.04Å; F130-V234 HydrophobicContact CE2-CG1 3.57Å; F130-V234 HydrophobicContact CE2-CG2 4.43Å; F130-V234 HydrophobicContact CG-CG1 3.57Å; F130-V234 HydrophobicContact CZ-CG1 3.89Å; F130-V234 HydrophobicContact CZ-CG2 4.29Å; I155-V234 HydrophobicContact CB-CG1 4.32Å; I155-V234 HydrophobicContact CB-CG2 4.25Å; I155-V234 HydrophobicContact CD1-CG2 4.2Å; I155-V234 HydrophobicContact CG2-CG1 4.38Å; A232-V234 HydrophobicContact CB-CG2 4.37Å
235	G	95.6	Very high	95.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	100.3	171.3	-175.7	0	0	0	0	0	113.9	D118 I155	D118-G235 WeakPolarHBondContact O-CA 3.21Å; I155-G235 PolarHBondContact O-N 3.22Å
236	L	94.6	Very high	95.2	Very high	5 Å²	5	14.3 Å²	14.3	3%	0.026	7%	0.07	C	C	.	.			trans	-128.4	153.1	-175.4	-64.4	176.5	0	0	0	112.1	T121 A156 P174 L175	T121-L236 HydrophobicContact CG2-CB 3.96Å; T121-L236 HydrophobicContact CG2-CD1 4.17Å; A156-L236 HydrophobicContact CB-CD1 3.84Å; A156-L236 HydrophobicContact CB-CD2 3.74Å; A156-L236 HydrophobicContact CB-CG 3.7Å; P174-L236 HydrophobicContact CB-CB 4.43Å; P174-L236 HydrophobicContact CB-CD1 4.41Å; L175-L236 HydrophobicContact CD2-CD2 3.53Å; L175-L236 HydrophobicContact CG-CD2 4Å
237	S	93.1	Very high	94.7	Very high	16 Å²	16	17.4 Å²	17.4	11%	0.112	8%	0.084	C	C	.	.			trans	-80.2	124.2	170.7	-179.7	0	0	0	0	109.5	P174 T178 I239	P174-S237 WeakPolarHBondContact CB-O 3.37Å; T178-S237 WeakPolarHBondContact OG1-CB 3.45Å; T178-S237 PolarHBondContact OG1-N 3.07Å; S237-I239 VanDerWaalsContact C-N 3.3Å; S237-I239 WeakPolarHBondContact OG-CG2 3.46Å; S237-I239 PolarHBondContact OG-N 3.42Å
238	K	92.7	Very high	94.2	Very high	21 Å²	21	22.7 Å²	22.7	9%	0.091	12%	0.116	C	C	.	.			trans	-87.2	1	177.7	-52.6	-168.3	-178.3	-159.2	0	113.4	T75 D118 S120 T121 V122 E123 T240 T241	T75-K238 HydrophobicContact CG2-CD 3.6Å; T75-K238 WeakPolarHBondContact O-CD 3.5Å; T75-K238 WeakPolarHBondContact O-CE 3.47Å; D118-K238 WeakPolarHBondContact OD2-CE 3.44Å; D118-K238 IonicContact OD2-NZ 3.52Å; D118-K238 PolarHBondContact OD2-NZ 2.8Å; S120-K238 WeakPolarHBondContact O-CE 3.4Å; S120-K238 PolarHBondContact O-NZ 2.6Å; T121-K238 HydrophobicContact CG2-CG 4.02Å; T121-K238 WeakPolarHBondContact O-CD 3.37Å; T121-K238 PolarHBondContact O-NZ 3.49Å; V122-K238 PolarHBondContact O-NZ 3.18Å; E123-K238 HydrophobicContact CG-CD 4.11Å; K238-T240 PolarHBondContact O-N 3.06Å; K238-T240 VanDerWaalsContact O-N 3.11Å; K238-T241 WeakPolarHBondContact O-CB 3.24Å; K238-T241 PolarHBondContact O-N 2.86Å; K238-T241 PolarHBondContact O-OG1 3.49Å
239	I	92.4	Very high	93.9	Very high	55 Å²	55	28.2 Å²	28.2	28%	0.282	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-27.8	-171.8	-162	169.9	0	0	0	113.2	Y177 S237 T241 L258 V259	Y177-I239 HydrophobicContact CD1-CG2 3.56Å; Y177-I239 HydrophobicContact CD2-CG2 3.97Å; Y177-I239 HydrophobicContact CE1-CG2 3.41Å; Y177-I239 VanDerWaalsContact CE1-CG2 3.41Å; Y177-I239 HydrophobicContact CE2-CG2 3.81Å; Y177-I239 HydrophobicContact CG-CG2 3.85Å; S237-I239 VanDerWaalsContact C-N 3.3Å; S237-I239 WeakPolarHBondContact OG-CG2 3.46Å; S237-I239 PolarHBondContact OG-N 3.42Å; I239-T241 VanDerWaalsContact C-N 3.33Å; I239-L258 HydrophobicContact CD1-CB 4.3Å; I239-L258 HydrophobicContact CD1-CD1 4.37Å; I239-L258 HydrophobicContact CG1-CB 3.55Å; I239-L258 HydrophobicContact CG1-CD1 3.9Å; I239-L258 HydrophobicContact CG1-CG 4.38Å; I239-V259 WeakPolarHBondContact O-CB 3.31Å; I239-V259 PolarHBondContact O-N 3.13Å
240	T	95.4	Very high	93.6	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.012	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-3.5	-179.6	52.9	0	0	0	0	114.1	P174 Y177 K238 W242 V259	P174-T240 WeakPolarHBondContact CA-OG1 3.42Å; Y177-T240 HydrophobicContact CD2-CG2 3.76Å; Y177-T240 HydrophobicContact CG-CG2 3.84Å; K238-T240 PolarHBondContact O-N 3.06Å; K238-T240 VanDerWaalsContact O-N 3.11Å; T240-W242 VanDerWaalsContact O-CE3 3.31Å; T240-V259 HydrophobicContact CG2-CG2 4.48Å
241	T	95.7	Very high	93.6	Very high	5 Å²	5	32 Å²	32	3%	0.031	16%	0.162	C	C	.	.			trans	-85.6	142.6	179.7	63.8	0	0	0	0	111.5	T121 P174 K238 I239 K254	T121-T241 HydrophobicContact CG2-CG2 4.39Å; P174-T241 HydrophobicContact CG-CG2 4.33Å; K238-T241 WeakPolarHBondContact O-CB 3.24Å; K238-T241 PolarHBondContact O-N 2.86Å; K238-T241 PolarHBondContact O-OG1 3.49Å; I239-T241 VanDerWaalsContact C-N 3.33Å; T241-K254 WeakPolarHBondContact OG1-CD 3.25Å; T241-K254 PolarHBondContact OG1-NZ 3.39Å
242	W	96.5	Very high	93.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.			trans	-129.3	-12.4	-178.6	65.7	85.8	0	0	0	114.3	H169 L173 T240 K254 I257 V259 I264 P376 T379 L380 L383	H169-W242 HydrophobicContact CB-CH2 4.3Å; H169-W242 AromaticContact CD2-CD2 3.49Å; H169-W242 VanDerWaalsContact CD2-CD2 3.49Å; H169-W242 AromaticContact CD2-CE2 3.55Å; H169-W242 AromaticContact CD2-CE3 3.47Å; H169-W242 VanDerWaalsContact CD2-CE3 3.47Å; H169-W242 AromaticContact CD2-CH2 3.59Å; H169-W242 AromaticContact CD2-CZ2 3.62Å; H169-W242 AromaticContact CD2-CZ3 3.51Å; H169-W242 AromaticContact NE2-CD2 3.74Å; H169-W242 AromaticContact NE2-CE3 3.89Å; H169-W242 PolarHBondContact NE2-N 2.94Å; L173-W242 HydrophobicContact CD1-CH2 4.04Å; L173-W242 HydrophobicContact CD1-CZ3 3.75Å; T240-W242 VanDerWaalsContact O-CE3 3.31Å; W242-K254 PolarHBondContact O-N 3.39Å; W242-I257 HydrophobicContact CB-CD1 4.2Å; W242-I257 HydrophobicContact CB-CG1 4.37Å; W242-I257 HydrophobicContact CB-CG2 3.94Å; W242-V259 HydrophobicContact CB-CG1 4.2Å; W242-V259 HydrophobicContact CE3-CG1 4.39Å; W242-I264 HydrophobicContact CE3-CD1 4.33Å; W242-I264 HydrophobicContact CZ3-CD1 3.8Å; W242-P376 PolarHBondContact NE1-O 3.41Å; W242-T379 HydrophobicContact CB-CG2 4.07Å; W242-T379 HydrophobicContact CG-CG2 4.13Å; W242-L380 HydrophobicContact CH2-CD1 4.13Å; W242-L380 HydrophobicContact CZ2-CB 4.05Å; W242-L380 HydrophobicContact CZ2-CD1 4.02Å; W242-L380 HydrophobicContact CZ2-CD2 4.1Å; W242-L380 HydrophobicContact CZ2-CG 4.27Å; W242-L383 HydrophobicContact CB-CD2 4.42Å
243	Y	95.8	Very high	93.4	Very high	6 Å²	6	31.4 Å²	31.4	2%	0.024	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	150.8	-175.6	-157.4	-103	0	0	0	111.9	H169 Y245 Q251 G252 T375 P376	H169-Y243 PolarHBondContact CE1-O 2.85Å; H169-Y243 PolarHBondContact NE2-N 3.46Å; H169-Y243 VanDerWaalsContact NE2-N 3.16Å; Y243-Y245 HydrophobicContact CD1-CD1 4.09Å; Y243-Y245 HydrophobicContact CD1-CE1 4.01Å; Y243-Y245 HydrophobicContact CE1-CD1 4.38Å; Y243-Q251 HydrophobicContact CE1-CB 4.35Å; Y243-Q251 PolarHBondContact OH-OE1 3.22Å; Y243-Q251 VanDerWaalsContact OH-OE1 3.08Å; Y243-G252 VanDerWaalsContact CD2-C 3.46Å; Y243-G252 WeakPolarHBondContact CD2-O 3.22Å; Y243-G252 VanDerWaalsContact CE2-CA 3.46Å; Y243-T375 PolarHBondContact OH-N 2.93Å; Y243-T375 VanDerWaalsContact OH-N 3.15Å; Y243-P376 HydrophobicContact CD1-CB 3.96Å; Y243-P376 VanDerWaalsContact CD2-CA 3.45Å; Y243-P376 HydrophobicContact CD2-CB 3.86Å; Y243-P376 HydrophobicContact CE1-CB 4.19Å; Y243-P376 HydrophobicContact CE1-CG 4.42Å; Y243-P376 HydrophobicContact CE2-CB 4.09Å; Y243-P376 VanDerWaalsContact CE2-N 3.29Å; Y243-P376 HydrophobicContact CG-CB 3.78Å
244	Q	93.5	Very high	93.2	Very high	39 Å²	39	31.6 Å²	31.6	18%	0.182	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.1	171.5	62	76	17.9	0	0	110.5	Q249 P250 Q251 G252 K254	Q244-Q249 VanDerWaalsContact NE2-NE2 3.16Å; Q244-P250 PolarHBondContact NE2-O 3.3Å; Q244-Q251 WeakPolarHBondContact O-CA 3.37Å; Q244-Q251 WeakPolarHBondContact O-CB 3.25Å; Q244-G252 WeakPolarHBondContact CG-O 3.16Å; Q244-G252 PolarHBondContact N-O 3.06Å; Q244-G252 PolarHBondContact O-N 3.25Å; Q244-K254 HydrophobicContact CB-CG 4.27Å
245	Y	91.1	Very high	92.7	Very high	22 Å²	22	36.4 Å²	36.4	9%	0.086	21%	0.208	C	C	.	.			trans	-92.1	-0.9	-167.4	-53.5	-71.4	0	0	0	114.7	V122 M165 H166 H169 D170 Y243 F247 Q251 C436	V122-Y245 HydrophobicContact CG2-CD2 4.46Å; V122-Y245 HydrophobicContact CG2-CE2 4.17Å; M165-Y245 HydrophobicContact CE-CE1 3.84Å; M165-Y245 VanDerWaalsContact CE-OH 3.28Å; M165-Y245 WeakPolarHBondContact CE-OH 3.3Å; M165-Y245 HydrophobicContact SD-CE1 3.77Å; M165-Y245 PolarHBondContact SD-OH 2.77Å; H166-Y245 AromaticContact CE1-CD1 3.7Å; H166-Y245 AromaticContact CE1-CD2 3.71Å; H166-Y245 AromaticContact CE1-CE1 3.35Å; H166-Y245 WeakPolarHBondContact CE1-CE1 3.18Å; H166-Y245 AromaticContact CE1-CE2 3.36Å; H166-Y245 WeakPolarHBondContact CE1-CE2 3.48Å; H166-Y245 AromaticContact CE1-CG 3.86Å; H166-Y245 AromaticContact CE1-CZ 3.16Å; H166-Y245 AromaticContact ND1-CE1 3.87Å; H166-Y245 AromaticContact ND1-CE2 3.52Å; H166-Y245 AromaticContact ND1-CZ 3.27Å; H166-Y245 VanDerWaalsContact ND1-CZ 3.27Å; H166-Y245 PolarHBondContact ND1-OH 3.05Å; H169-Y245 PolarHBondContact ND1-OH 2.87Å; H169-Y245 VanDerWaalsContact ND1-OH 3.12Å; D170-Y245 VanDerWaalsContact OD2-CE2 3.29Å; D170-Y245 WeakPolarHBondContact OD2-CE2 3.49Å; D170-Y245 VanDerWaalsContact OD2-CZ 3.32Å; D170-Y245 PolarHBondContact OD2-OH 3.02Å; Y243-Y245 HydrophobicContact CD1-CD1 4.09Å; Y243-Y245 HydrophobicContact CD1-CE1 4.01Å; Y243-Y245 HydrophobicContact CE1-CD1 4.38Å; Y245-F247 HydrophobicContact CD2-CE2 4.3Å; Y245-Q251 VanDerWaalsContact C-CB 3.49Å; Y245-Q251 WeakPolarHBondContact O-CB 3.46Å; Y245-C436 WeakPolarHBondContact O-CB 3.44Å
246	G	89.3	Confident	92.2	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.243	C	C	.	.			trans	86.5	44	169.7	0	0	0	0	0	116.2	Q249 L435 C436	G246-Q249 CarbonylContact C-O 3.49Å; G246-Q249 WeakPolarHBondContact CA-O 3.11Å; G246-L435 CarbonylContact O-C 3.55Å; G246-L435 WeakPolarHBondContact O-CA 3.33Å; G246-C436 PolarHBondContact O-N 2.93Å
247	F	87.3	Confident	92.1	Very high	69 Å²	69	45.5 Å²	45.5	30%	0.303	26%	0.256	S	S	.	.	S	Bend	trans	-69.2	-37.6	175	-69.1	-75.9	0	0	0	112.9	V122 H125 F159 Y245 C436	V122-F247 HydrophobicContact CG1-CD2 4.07Å; V122-F247 HydrophobicContact CG1-CE2 3.64Å; H125-F247 AromaticContact CD2-CE1 3.97Å; F159-F247 HydrophobicContact CZ-CE2 4.13Å; F159-F247 AromaticContact CZ-CZ 3.78Å; F159-F247 HydrophobicContact CZ-CZ 3.78Å; Y245-F247 HydrophobicContact CD2-CE2 4.3Å; F247-C436 HydrophobicContact CD1-CB 4.41Å; F247-C436 HydrophobicContact CE1-CB 4.37Å
248	V	86.6	Confident	92	Very high	112 Å²	112	50.8 Å²	50.8	68%	0.679	28%	0.282	S	S	*	.	S	Bend	trans	-113.3	-27.6	-176.6	-174.5	0	0	0	0	112.4	D124	D124-V248 HydrophobicContact CB-CG2 4.45Å
249	Q	90.6	Very high	92.1	Very high	115 Å²	115	50.1 Å²	50.1	54%	0.537	28%	0.28	S	S	.	.	S	Bend	trans	-135.1	167.6	178.5	61.8	178.8	32.3	0	0	109.2	Q244 G246 L435	Q244-Q249 VanDerWaalsContact NE2-NE2 3.16Å; G246-Q249 CarbonylContact C-O 3.49Å; G246-Q249 WeakPolarHBondContact CA-O 3.11Å; Q249-L435 WeakPolarHBondContact O-CD2 3.45Å
250	P	92.5	Very high	92	Very high	55 Å²	55	48.9 Å²	48.9	36%	0.357	28%	0.276	S	S	.	.			trans	-56.4	143.9	173.1	-27.1	36.4	0	0	0	112.4	Q244 R433	Q244-P250 PolarHBondContact NE2-O 3.3Å; P250-R433 HydrophobicContact CB-CB 4.02Å; P250-R433 HydrophobicContact CB-CG 4.49Å; P250-R433 HydrophobicContact CG-CB 4.12Å
251	Q	93.3	Very high	91.9	Very high	38 Å²	38	48.8 Å²	48.8	18%	0.178	28%	0.276	C	S	.	.			trans	-59.4	154.7	-178.7	67.2	175.9	-74.9	0	0	113.2	Y243 Q244 Y245 Y374	Y243-Q251 HydrophobicContact CE1-CB 4.35Å; Y243-Q251 PolarHBondContact OH-OE1 3.22Å; Y243-Q251 VanDerWaalsContact OH-OE1 3.08Å; Q244-Q251 WeakPolarHBondContact O-CA 3.37Å; Q244-Q251 WeakPolarHBondContact O-CB 3.25Å; Y245-Q251 VanDerWaalsContact C-CB 3.49Å; Y245-Q251 WeakPolarHBondContact O-CB 3.46Å; Q251-Y374 HydrophobicContact CG-CD1 4.17Å; Q251-Y374 HydrophobicContact CG-CE1 4.34Å; Q251-Y374 VanDerWaalsContact NE2-CD1 3.34Å; Q251-Y374 VanDerWaalsContact NE2-CE1 3.28Å
252	G	94.9	Very high	91.6	Very high	7 Å²	7	52.2 Å²	52.2	7%	0.072	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.5	-174.3	-178.5	0	0	0	0	0	113.8	Y243 Q244	Y243-G252 VanDerWaalsContact CD2-C 3.46Å; Y243-G252 WeakPolarHBondContact CD2-O 3.22Å; Y243-G252 VanDerWaalsContact CE2-CA 3.46Å; Q244-G252 WeakPolarHBondContact CG-O 3.16Å; Q244-G252 PolarHBondContact N-O 3.06Å; Q244-G252 PolarHBondContact O-N 3.25Å
253	P	95.4	Very high	91.5	Very high	62 Å²	62	54.5 Å²	54.5	40%	0.403	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	146.3	176	-16.3	29.5	0	0	0	111.1	I257 T375 T379	P253-I257 HydrophobicContact CB-CD1 4.26Å; P253-T375 WeakPolarHBondContact CD-OG1 3.28Å; P253-T379 HydrophobicContact CB-CG2 4.16Å; P253-T379 WeakPolarHBondContact CG-OG1 3.34Å
254	K	93.4	Very high	91.6	Very high	34 Å²	34	54.2 Å²	54.2	15%	0.148	30%	0.303	C	S	.	.			trans	-66.1	147.3	171.7	-66.3	-176.8	69.6	150.2	0	109.8	E123 T241 W242 Q244 N256 I257	E123-K254 IonicContact OE1-NZ 2.84Å; E123-K254 PolarHBondContact OE1-NZ 3.33Å; T241-K254 WeakPolarHBondContact OG1-CD 3.25Å; T241-K254 PolarHBondContact OG1-NZ 3.39Å; W242-K254 PolarHBondContact O-N 3.39Å; Q244-K254 HydrophobicContact CB-CG 4.27Å; K254-N256 VanDerWaalsContact C-N 3.35Å; K254-N256 PolarHBondContact O-N 3.38Å; K254-I257 HydrophobicContact CB-CG1 4.17Å; K254-I257 WeakPolarHBondContact O-CG1 3.45Å
255	A	86.6	Confident	91.7	Very high	102 Å²	102	54.1 Å²	54.1	84%	0.843	30%	0.301	S	S	*	.	S	Bend	trans	-65.4	-37.9	-179.6	0	0	0	0	0	112.6
256	N	85.4	Confident	91.9	Very high	139 Å²	139	56.3 Å²	56.3	74%	0.743	31%	0.312	S	S	*	.	S	Bend	trans	-118.9	82.2	-179.2	-69.5	-27.4	0	0	0	110.3	K254 L258	K254-N256 VanDerWaalsContact C-N 3.35Å; K254-N256 PolarHBondContact O-N 3.38Å; N256-L258 PolarHBondContact O-N 3.1Å
257	I	92.2	Very high	92.3	Very high	57 Å²	57	56.3 Å²	56.3	29%	0.292	31%	0.312	S	S	.	.			trans	-80.7	115.9	175.6	-57.4	173.5	0	0	0	108.6	W242 P253 K254 V259 T379 L383	W242-I257 HydrophobicContact CB-CD1 4.2Å; W242-I257 HydrophobicContact CB-CG1 4.37Å; W242-I257 HydrophobicContact CB-CG2 3.94Å; P253-I257 HydrophobicContact CB-CD1 4.26Å; K254-I257 HydrophobicContact CB-CG1 4.17Å; K254-I257 WeakPolarHBondContact O-CG1 3.45Å; I257-V259 HydrophobicContact CG2-CG1 3.73Å; I257-T379 HydrophobicContact CD1-CG2 3.54Å; I257-L383 HydrophobicContact CG2-CD2 3.64Å
258	L	91.1	Very high	92.8	Very high	126 Å²	126	53.4 Å²	53.4	66%	0.66	30%	0.301	S	S	*	.			trans	-98.4	-21.5	-178.8	-62.5	179	0	0	0	113	I239 N256	I239-L258 HydrophobicContact CD1-CB 4.3Å; I239-L258 HydrophobicContact CD1-CD1 4.37Å; I239-L258 HydrophobicContact CG1-CB 3.55Å; I239-L258 HydrophobicContact CG1-CD1 3.9Å; I239-L258 HydrophobicContact CG1-CG 4.38Å; N256-L258 PolarHBondContact O-N 3.1Å
259	V	94.1	Very high	93.3	Very high	8 Å²	8	55 Å²	55	5%	0.048	30%	0.295	C	S	.	.			trans	-73.4	143.8	178.8	67	0	0	0	0	111.6	I239 T240 W242 I257 E263 I264 L383	I239-V259 WeakPolarHBondContact O-CB 3.31Å; I239-V259 PolarHBondContact O-N 3.13Å; T240-V259 HydrophobicContact CG2-CG2 4.48Å; W242-V259 HydrophobicContact CB-CG1 4.2Å; W242-V259 HydrophobicContact CE3-CG1 4.39Å; I257-V259 HydrophobicContact CG2-CG1 3.73Å; V259-E263 HydrophobicContact CG2-CB 3.92Å; V259-I264 HydrophobicContact CG2-CD1 3.87Å; V259-I264 HydrophobicContact CG2-CG1 4.08Å; V259-L383 HydrophobicContact CG1-CD1 3.93Å; V259-L383 HydrophobicContact CG1-CD2 4.23Å
260	S	91.8	Very high	93.5	Very high	29 Å²	29	50.8 Å²	50.8	20%	0.203	28%	0.275	C	S	.	.			trans	-116.6	169.7	169.6	82.7	0	0	0	0	110.7	N262 E263 I264 P384	S260-N262 PolarHBondContact O-N 3.23Å; S260-N262 VanDerWaalsContact O-N 3.1Å; S260-N262 WeakPolarHBondContact OG-CB 3.27Å; S260-N262 PolarHBondContact OG-N 3.24Å; S260-E263 WeakPolarHBondContact CA-OE2 3.07Å; S260-E263 VanDerWaalsContact CB-OE2 3.29Å; S260-E263 WeakPolarHBondContact CB-OE2 2.98Å; S260-E263 PolarHBondContact N-OE2 3.03Å; S260-E263 PolarHBondContact O-N 3.16Å; S260-E263 PolarHBondContact OG-OE2 3.39Å; S260-I264 PolarHBondContact O-N 2.56Å; S260-P384 WeakPolarHBondContact CB-O 3.24Å
261	G	92.2	Very high	93.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.2	-16.5	172.8	0	0	0	0	0	113.8	R265 P384	G261-R265 WeakPolarHBondContact O-CB 3.13Å; G261-R265 WeakPolarHBondContact O-CG 3.39Å; G261-R265 PolarHBondContact O-N 3.4Å; G261-P384 PolarHBondContact N-O 3.26Å
262	N	90.3	Very high	93.8	Very high	76 Å²	76	46.8 Å²	46.8	41%	0.406	25%	0.252	S	S	.	.	H	α-helix	trans	-65.8	-49.8	173.4	176.8	63.9	0	0	0	111.7	S260 I264 R265 Q266	S260-N262 PolarHBondContact O-N 3.23Å; S260-N262 VanDerWaalsContact O-N 3.1Å; S260-N262 WeakPolarHBondContact OG-CB 3.27Å; S260-N262 PolarHBondContact OG-N 3.24Å; N262-I264 VanDerWaalsContact C-N 3.35Å; N262-I264 PolarHBondContact O-N 3.1Å; N262-R265 PolarHBondContact O-N 3.23Å; N262-Q266 PolarHBondContact ND2-NE2 2.8Å; N262-Q266 VanDerWaalsContact ND2-NE2 3.11Å; N262-Q266 WeakPolarHBondContact O-CG 3.22Å; N262-Q266 PolarHBondContact O-N 2.95Å; N262-Q266 PolarHBondContact OD1-NE2 3.13Å
263	E	94.5	Very high	93.8	Very high	49 Å²	49	52.1 Å²	52.1	23%	0.229	28%	0.275	C	S	.	.	H	α-helix	trans	-63.9	-43.2	179.3	-68	66.2	-125.4	0	0	110.6	V259 S260 R265 Q266 F267	V259-E263 HydrophobicContact CG2-CB 3.92Å; S260-E263 WeakPolarHBondContact CA-OE2 3.07Å; S260-E263 VanDerWaalsContact CB-OE2 3.29Å; S260-E263 WeakPolarHBondContact CB-OE2 2.98Å; S260-E263 PolarHBondContact N-OE2 3.03Å; S260-E263 PolarHBondContact O-N 3.16Å; S260-E263 PolarHBondContact OG-OE2 3.39Å; E263-R265 VanDerWaalsContact C-N 3.35Å; E263-R265 PolarHBondContact O-N 2.89Å; E263-Q266 PolarHBondContact O-N 2.77Å; E263-F267 PolarHBondContact O-N 2.74Å
264	I	97.4	Very high	93.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.9	-45.4	176	-58.6	-57.3	0	0	0	111.2	L173 W242 V259 S260 N262 F267 A268 L353 L380 L383 M386	L173-I264 HydrophobicContact CD1-CD1 3.84Å; L173-I264 HydrophobicContact CD2-CD1 3.99Å; W242-I264 HydrophobicContact CE3-CD1 4.33Å; W242-I264 HydrophobicContact CZ3-CD1 3.8Å; V259-I264 HydrophobicContact CG2-CD1 3.87Å; V259-I264 HydrophobicContact CG2-CG1 4.08Å; S260-I264 PolarHBondContact O-N 2.56Å; N262-I264 VanDerWaalsContact C-N 3.35Å; N262-I264 PolarHBondContact O-N 3.1Å; I264-F267 PolarHBondContact O-N 2.88Å; I264-A268 WeakPolarHBondContact O-CB 3.46Å; I264-A268 PolarHBondContact O-N 2.94Å; I264-L353 HydrophobicContact CG2-CB 3.71Å; I264-L380 HydrophobicContact CG1-CD1 4.28Å; I264-L380 HydrophobicContact CG2-CD1 4.14Å; I264-L383 HydrophobicContact CG1-CD1 3.99Å; I264-M386 HydrophobicContact CB-SD 3.89Å; I264-M386 HydrophobicContact CG2-CE 4.2Å; I264-M386 HydrophobicContact CG2-SD 3.73Å
265	R	95.3	Very high	93.8	Very high	36 Å²	36	54.4 Å²	54.4	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-70.7	-30.8	-179.9	-73.3	178.9	176	-61.7	-6.5	113.1	G261 N262 E263 R269 L355 R357 G385 M386	G261-R265 WeakPolarHBondContact O-CB 3.13Å; G261-R265 WeakPolarHBondContact O-CG 3.39Å; G261-R265 PolarHBondContact O-N 3.4Å; N262-R265 PolarHBondContact O-N 3.23Å; E263-R265 VanDerWaalsContact C-N 3.35Å; E263-R265 PolarHBondContact O-N 2.89Å; R265-R269 WeakPolarHBondContact O-CB 3.34Å; R265-R269 PolarHBondContact O-N 3.49Å; R265-L355 PolarHBondContact NH1-O 2.89Å; R265-L355 PolarHBondContact NH2-O 3.06Å; R265-R357 VanDerWaalsContact CZ-CG 3.43Å; R265-R357 VanDerWaalsContact NH2-CG 3.29Å; R265-G385 PolarHBondContact NE-O 2.84Å; R265-M386 HydrophobicContact CG-SD 4.32Å; R265-M386 PolarHBondContact NH2-O 3.33Å
266	Q	95.9	Very high	94	Very high	68 Å²	68	56.3 Å²	56.3	32%	0.318	28%	0.276	S	S	.	.	H	α-helix	trans	-65.8	-42.8	171.9	-73.6	179.2	23.4	0	0	111.4	N262 E263 F270	N262-Q266 PolarHBondContact ND2-NE2 2.8Å; N262-Q266 VanDerWaalsContact ND2-NE2 3.11Å; N262-Q266 WeakPolarHBondContact O-CG 3.22Å; N262-Q266 PolarHBondContact O-N 2.95Å; N262-Q266 PolarHBondContact OD1-NE2 3.13Å; E263-Q266 PolarHBondContact O-N 2.77Å; Q266-F270 WeakPolarHBondContact O-CB 3.34Å; Q266-F270 PolarHBondContact O-N 2.99Å
267	F	97.8	Very high	94	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-46.5	173.5	171.7	-98.1	0	0	0	111.7	F168 L172 L173 F176 E263 I264 R269 F270 M271 L353	F168-F267 AromaticContact CD1-CE1 3.59Å; F168-F267 HydrophobicContact CD1-CE1 3.59Å; F168-F267 AromaticContact CD1-CZ 3.9Å; F168-F267 HydrophobicContact CD1-CZ 3.9Å; F168-F267 AromaticContact CE1-CE1 3.7Å; F168-F267 HydrophobicContact CE1-CE1 3.7Å; F168-F267 AromaticContact CE1-CZ 3.92Å; F168-F267 HydrophobicContact CE1-CZ 3.92Å; L172-F267 HydrophobicContact CB-CE2 4.04Å; L172-F267 HydrophobicContact CB-CZ 3.78Å; L173-F267 HydrophobicContact CD1-CD1 4.49Å; L173-F267 HydrophobicContact CD2-CB 3.42Å; L173-F267 VanDerWaalsContact CD2-CB 3.42Å; L173-F267 HydrophobicContact CD2-CD1 3.41Å; L173-F267 VanDerWaalsContact CD2-CD1 3.41Å; L173-F267 HydrophobicContact CD2-CD2 3.87Å; L173-F267 HydrophobicContact CD2-CE1 4.12Å; L173-F267 HydrophobicContact CD2-CE2 4.49Å; L173-F267 HydrophobicContact CD2-CG 3.26Å; L173-F267 HydrophobicContact CG-CD1 3.72Å; L173-F267 HydrophobicContact CG-CD2 4.26Å; L173-F267 HydrophobicContact CG-CE1 3.9Å; L173-F267 HydrophobicContact CG-CE2 4.4Å; L173-F267 HydrophobicContact CG-CG 3.91Å; L173-F267 HydrophobicContact CG-CZ 4.22Å; F176-F267 HydrophobicContact CB-CD2 3.67Å; F176-F267 HydrophobicContact CB-CE2 4Å; F176-F267 HydrophobicContact CD1-CB 3.9Å; F176-F267 AromaticContact CD1-CD2 3.74Å; F176-F267 HydrophobicContact CD1-CD2 3.74Å; F176-F267 HydrophobicContact CD1-CG 4.3Å; F176-F267 HydrophobicContact CD2-CD2 4.06Å; F176-F267 HydrophobicContact CE1-CB 3.74Å; F176-F267 HydrophobicContact CE1-CD2 4.29Å; F176-F267 AromaticContact CG-CD2 3.58Å; F176-F267 HydrophobicContact CG-CD2 3.58Å; F176-F267 HydrophobicContact CG-CE2 4.34Å; F176-F267 HydrophobicContact CZ-CB 4.26Å; E263-F267 PolarHBondContact O-N 2.74Å; I264-F267 PolarHBondContact O-N 2.88Å; F267-R269 VanDerWaalsContact C-N 3.32Å; F267-R269 PolarHBondContact O-N 2.9Å; F267-F270 WeakPolarHBondContact O-CB 3.26Å; F267-F270 PolarHBondContact O-N 3.35Å; F267-F270 VanDerWaalsContact O-N 3.15Å; F267-M271 HydrophobicContact CD1-CG 4.23Å; F267-M271 HydrophobicContact CD2-CG 4.21Å; F267-M271 HydrophobicContact CE1-CG 3.72Å; F267-M271 HydrophobicContact CE2-CG 3.73Å; F267-M271 HydrophobicContact CE2-SD 3.95Å; F267-M271 HydrophobicContact CG-CG 4.46Å; F267-M271 HydrophobicContact CZ-CE 4.46Å; F267-M271 HydrophobicContact CZ-CG 3.46Å; F267-M271 VanDerWaalsContact CZ-CG 3.46Å; F267-M271 HydrophobicContact CZ-SD 3.87Å; F267-M271 WeakPolarHBondContact O-CG 3.45Å; F267-M271 PolarHBondContact O-N 3.3Å; F267-L353 HydrophobicContact CD1-CD1 4.22Å; F267-L353 HydrophobicContact CE1-CD1 4.3Å; F267-L353 HydrophobicContact CE1-CD2 4.29Å
268	A	97.6	Very high	92.7	Very high	8 Å²	8	51.2 Å²	51.2	7%	0.066	26%	0.255	C	S	.	.	H	α-helix	trans	-55.6	-47.3	177	0	0	0	0	0	111.2	I264 F270 M271 T272 L353 F354	I264-A268 WeakPolarHBondContact O-CB 3.46Å; I264-A268 PolarHBondContact O-N 2.94Å; A268-F270 PolarHBondContact O-N 3.29Å; A268-M271 PolarHBondContact O-N 3.12Å; A268-T272 PolarHBondContact O-N 3.37Å; A268-T272 PolarHBondContact O-OG1 3.24Å; A268-L353 HydrophobicContact CB-CD1 3.7Å; A268-L353 WeakPolarHBondContact CB-O 3.39Å; A268-F354 HydrophobicContact CB-CD1 3.9Å; A268-F354 HydrophobicContact CB-CE1 4.23Å
269	R	96	Very high	91.1	Very high	146 Å²	146	51.5 Å²	51.5	55%	0.551	25%	0.253	S	S	*	.	H	α-helix	trans	-59.3	-47.3	176.1	-173.8	-173.7	-58	131.7	5.7	112.1	R265 F267 M271 T272 E273	R265-R269 WeakPolarHBondContact O-CB 3.34Å; R265-R269 PolarHBondContact O-N 3.49Å; F267-R269 VanDerWaalsContact C-N 3.32Å; F267-R269 PolarHBondContact O-N 2.9Å; R269-M271 VanDerWaalsContact C-N 3.3Å; R269-M271 PolarHBondContact O-N 3.3Å; R269-T272 PolarHBondContact O-N 3.17Å; R269-E273 WeakPolarHBondContact CD-OE1 3.21Å; R269-E273 HydrophobicContact CG-CG 4.4Å; R269-E273 VanDerWaalsContact CG-OE1 3.29Å; R269-E273 WeakPolarHBondContact CG-OE1 3.36Å; R269-E273 WeakPolarHBondContact O-CB 3.47Å; R269-E273 VanDerWaalsContact O-CG 3.31Å; R269-E273 WeakPolarHBondContact O-CG 3.48Å; R269-E273 PolarHBondContact O-N 3.21Å
270	F	96.5	Very high	88.8	Confident	27 Å²	27	55.9 Å²	55.9	12%	0.118	28%	0.28	C	S	.	.	H	α-helix	trans	-56.7	-45.3	177.4	167.7	-93.4	0	0	0	111.7	F176 L208 L209 Q266 F267 A268 E273 K274	F176-F270 HydrophobicContact CD2-CB 4.44Å; F176-F270 AromaticContact CD2-CD1 3.77Å; F176-F270 HydrophobicContact CD2-CD1 3.77Å; F176-F270 HydrophobicContact CD2-CD2 4.44Å; F176-F270 HydrophobicContact CD2-CE1 4.1Å; F176-F270 AromaticContact CD2-CG 3.96Å; F176-F270 HydrophobicContact CD2-CG 3.96Å; F176-F270 HydrophobicContact CE2-CB 3.56Å; F176-F270 AromaticContact CE2-CD1 3.71Å; F176-F270 HydrophobicContact CE2-CD1 3.71Å; F176-F270 AromaticContact CE2-CD2 3.84Å; F176-F270 HydrophobicContact CE2-CD2 3.84Å; F176-F270 HydrophobicContact CE2-CE1 4.37Å; F176-F270 HydrophobicContact CE2-CE2 4.44Å; F176-F270 AromaticContact CE2-CG 3.41Å; F176-F270 HydrophobicContact CE2-CG 3.41Å; F176-F270 VanDerWaalsContact CE2-CG 3.41Å; F176-F270 HydrophobicContact CZ-CB 3.99Å; F176-F270 HydrophobicContact CZ-CG 4.33Å; L208-F270 VanDerWaalsContact O-CZ 3.3Å; L208-F270 WeakPolarHBondContact O-CZ 3.4Å; L209-F270 HydrophobicContact CD2-CE1 3.86Å; L209-F270 HydrophobicContact CD2-CZ 4.42Å; Q266-F270 WeakPolarHBondContact O-CB 3.34Å; Q266-F270 PolarHBondContact O-N 2.99Å; F267-F270 WeakPolarHBondContact O-CB 3.26Å; F267-F270 PolarHBondContact O-N 3.35Å; F267-F270 VanDerWaalsContact O-N 3.15Å; A268-F270 PolarHBondContact O-N 3.29Å; F270-E273 PolarHBondContact O-N 3.48Å; F270-K274 HydrophobicContact CD1-CG 4.43Å; F270-K274 HydrophobicContact CD2-CG 4.27Å; F270-K274 HydrophobicContact CE1-CG 4.02Å; F270-K274 HydrophobicContact CE2-CD 4.43Å; F270-K274 HydrophobicContact CE2-CG 3.89Å; F270-K274 HydrophobicContact CZ-CD 4.45Å; F270-K274 HydrophobicContact CZ-CG 3.76Å; F270-K274 WeakPolarHBondContact O-CB 3.47Å; F270-K274 VanDerWaalsContact O-CG 3.3Å; F270-K274 WeakPolarHBondContact O-CG 3.34Å; F270-K274 PolarHBondContact O-N 3.36Å
271	M	97.2	Very high	86.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66.3	-44.1	178.8	-69	-62.8	-70.9	0	0	111.8	F168 L172 L205 L208 F267 A268 R269 E273 K274 L275 F354	F168-M271 HydrophobicContact CE1-CE 4.33Å; F168-M271 HydrophobicContact CZ-CE 4.29Å; L172-M271 HydrophobicContact CD1-CE 4.27Å; L205-M271 HydrophobicContact CB-CE 4.46Å; L205-M271 HydrophobicContact CD2-CE 4.12Å; L208-M271 HydrophobicContact CD1-CE 3.77Å; L208-M271 HydrophobicContact CD1-SD 4.29Å; F267-M271 HydrophobicContact CD1-CG 4.23Å; F267-M271 HydrophobicContact CD2-CG 4.21Å; F267-M271 HydrophobicContact CE1-CG 3.72Å; F267-M271 HydrophobicContact CE2-CG 3.73Å; F267-M271 HydrophobicContact CE2-SD 3.95Å; F267-M271 HydrophobicContact CG-CG 4.46Å; F267-M271 HydrophobicContact CZ-CE 4.46Å; F267-M271 HydrophobicContact CZ-CG 3.46Å; F267-M271 VanDerWaalsContact CZ-CG 3.46Å; F267-M271 HydrophobicContact CZ-SD 3.87Å; F267-M271 WeakPolarHBondContact O-CG 3.45Å; F267-M271 PolarHBondContact O-N 3.3Å; A268-M271 PolarHBondContact O-N 3.12Å; R269-M271 VanDerWaalsContact C-N 3.3Å; R269-M271 PolarHBondContact O-N 3.3Å; M271-E273 VanDerWaalsContact C-N 3.32Å; M271-E273 PolarHBondContact O-N 2.85Å; M271-K274 PolarHBondContact O-N 3.31Å; M271-L275 VanDerWaalsContact O-CB 3.31Å; M271-L275 WeakPolarHBondContact O-CB 3.2Å; M271-L275 VanDerWaalsContact O-CG 3.24Å; M271-L275 WeakPolarHBondContact O-CG 3.3Å; M271-L275 PolarHBondContact O-N 3.32Å; M271-F354 HydrophobicContact CB-CE1 3.83Å; M271-F354 HydrophobicContact CB-CZ 4.09Å
272	T	94.8	Very high	84.2	Confident	8 Å²	8	59.3 Å²	59.3	5%	0.049	32%	0.316	C	S	.	.	H	α-helix	trans	-58.5	-44	175.6	-57.3	0	0	0	0	111.4	A268 R269 N276 V277	A268-T272 PolarHBondContact O-N 3.37Å; A268-T272 PolarHBondContact O-OG1 3.24Å; R269-T272 PolarHBondContact O-N 3.17Å; T272-N276 PolarHBondContact O-N 2.84Å; T272-V277 HydrophobicContact CG2-CB 3.63Å; T272-V277 HydrophobicContact CG2-CG1 3.74Å; T272-V277 PolarHBondContact O-N 3.47Å
273	E	94.5	Very high	82.1	Confident	120 Å²	120	60.3 Å²	60.3	56%	0.561	33%	0.327	S	S	*	.	H	α-helix	trans	-62.1	-46.9	175.2	-73.1	168.8	-173.7	0	0	111.6	R269 F270 M271 L275 N276	R269-E273 WeakPolarHBondContact CD-OE1 3.21Å; R269-E273 HydrophobicContact CG-CG 4.4Å; R269-E273 VanDerWaalsContact CG-OE1 3.29Å; R269-E273 WeakPolarHBondContact CG-OE1 3.36Å; R269-E273 WeakPolarHBondContact O-CB 3.47Å; R269-E273 VanDerWaalsContact O-CG 3.31Å; R269-E273 WeakPolarHBondContact O-CG 3.48Å; R269-E273 PolarHBondContact O-N 3.21Å; F270-E273 PolarHBondContact O-N 3.48Å; M271-E273 VanDerWaalsContact C-N 3.32Å; M271-E273 PolarHBondContact O-N 2.85Å; E273-L275 VanDerWaalsContact C-N 3.33Å; E273-L275 PolarHBondContact O-N 3.48Å; E273-N276 PolarHBondContact O-N 2.76Å; E273-N276 VanDerWaalsContact O-N 3.15Å
274	K	94.8	Very high	79.6	Confident	110 Å²	110	67.1 Å²	67.1	48%	0.478	36%	0.364	S	S	.	.	H	α-helix	trans	-69.8	-27.8	-178.8	-72.9	-62.6	-173.6	-177.9	0	114.4	L208 F270 M271 N276	L208-K274 HydrophobicContact CB-CB 4.06Å; L208-K274 HydrophobicContact CB-CG 4.41Å; L208-K274 HydrophobicContact CD1-CB 4.25Å; L208-K274 HydrophobicContact CD2-CB 4.23Å; L208-K274 HydrophobicContact CG-CB 4.4Å; F270-K274 HydrophobicContact CD1-CG 4.43Å; F270-K274 HydrophobicContact CD2-CG 4.27Å; F270-K274 HydrophobicContact CE1-CG 4.02Å; F270-K274 HydrophobicContact CE2-CD 4.43Å; F270-K274 HydrophobicContact CE2-CG 3.89Å; F270-K274 HydrophobicContact CZ-CD 4.45Å; F270-K274 HydrophobicContact CZ-CG 3.76Å; F270-K274 WeakPolarHBondContact O-CB 3.47Å; F270-K274 VanDerWaalsContact O-CG 3.3Å; F270-K274 WeakPolarHBondContact O-CG 3.34Å; F270-K274 PolarHBondContact O-N 3.36Å; M271-K274 PolarHBondContact O-N 3.31Å; K274-N276 PolarHBondContact O-N 3.17Å
275	L	94.1	Very high	77.5	Confident	34 Å²	34	70.4 Å²	70.4	18%	0.178	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	5	174.6	-69.7	168.5	0	0	0	112.5	L208 M271 E273 V277 F328 A329 V332	L208-L275 HydrophobicContact CD1-CD2 3.68Å; L208-L275 HydrophobicContact CD1-CG 3.9Å; M271-L275 VanDerWaalsContact O-CB 3.31Å; M271-L275 WeakPolarHBondContact O-CB 3.2Å; M271-L275 VanDerWaalsContact O-CG 3.24Å; M271-L275 WeakPolarHBondContact O-CG 3.3Å; M271-L275 PolarHBondContact O-N 3.32Å; E273-L275 VanDerWaalsContact C-N 3.33Å; E273-L275 PolarHBondContact O-N 3.48Å; L275-V277 HydrophobicContact CB-CG2 3.78Å; L275-V277 PolarHBondContact O-N 3.02Å; L275-V277 VanDerWaalsContact O-N 3.09Å; L275-F328 HydrophobicContact CD1-CD1 4.05Å; L275-F328 HydrophobicContact CD1-CE1 4.13Å; L275-A329 HydrophobicContact CB-CB 4.26Å; L275-A329 HydrophobicContact CD2-CB 4.43Å; L275-V332 HydrophobicContact CD1-CB 4.31Å; L275-V332 HydrophobicContact CD1-CG1 4.42Å; L275-V332 HydrophobicContact CD1-CG2 3.91Å
276	N	90.6	Very high	76.3	Confident	141 Å²	141	74.6 Å²	74.6	75%	0.754	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	31.5	-174	-66.1	-32.7	0	0	0	112.8	T272 E273 K274 S278	T272-N276 PolarHBondContact O-N 2.84Å; E273-N276 PolarHBondContact O-N 2.76Å; E273-N276 VanDerWaalsContact O-N 3.15Å; K274-N276 PolarHBondContact O-N 3.17Å; N276-S278 VanDerWaalsContact C-N 3.28Å; N276-S278 PolarHBondContact O-N 2.72Å
277	V	84.6	Confident	75.7	Confident	14 Å²	14	74.5 Å²	74.5	9%	0.085	42%	0.419	C	S	.	.			trans	-73.4	92.8	176.2	173.2	0	0	0	0	106.4	T272 L275 H279 A329 V332 R333	T272-V277 HydrophobicContact CG2-CB 3.63Å; T272-V277 HydrophobicContact CG2-CG1 3.74Å; T272-V277 PolarHBondContact O-N 3.47Å; L275-V277 HydrophobicContact CB-CG2 3.78Å; L275-V277 PolarHBondContact O-N 3.02Å; L275-V277 VanDerWaalsContact O-N 3.09Å; V277-H279 PolarHBondContact O-N 2.61Å; V277-A329 HydrophobicContact CG2-CB 4.24Å; V277-A329 WeakPolarHBondContact CG2-O 3.29Å; V277-V332 HydrophobicContact CG2-CB 4.42Å; V277-V332 HydrophobicContact CG2-CG1 4.23Å; V277-R333 HydrophobicContact CG1-CB 3.67Å; V277-R333 HydrophobicContact CG1-CG 4.03Å
278	S	64.8	Low	75.5	Confident	75 Å²	75	75.7 Å²	75.7	52%	0.524	42%	0.423	S	S	.	.			trans	-60.3	124.7	175.9	-66.1	0	0	0	0	108.2	N276 T280	N276-S278 VanDerWaalsContact C-N 3.28Å; N276-S278 PolarHBondContact O-N 2.72Å; S278-T280 PolarHBondContact O-N 3.46Å
279	H	59	Low	75.5	Confident	132 Å²	132	75.3 Å²	75.3	61%	0.611	42%	0.42	S	S	*	.			trans	-69.4	57.4	152.6	-61.3	-71.6	0	0	0	107.9	V277 G281	V277-H279 PolarHBondContact O-N 2.61Å; H279-G281 PolarHBondContact O-N 2.99Å
280	T	44.5	Very low	75.6	Confident	100 Å²	100	68.3 Å²	68.3	61%	0.613	39%	0.394	S	S	*	.			trans	-59.2	96.1	150.8	47.3	0	0	0	0	102.1	S278 A282	S278-T280 PolarHBondContact O-N 3.46Å; T280-A282 PolarHBondContact O-N 2.94Å
281	G	44.2	Very low	75.7	Confident	61 Å²	61	67 Å²	67	63%	0.629	39%	0.388	S	S	*	.			trans	-46.3	118.1	-176.3	0	0	0	0	0	105.6	H279 P283	H279-G281 PolarHBondContact O-N 2.99Å; G281-P283 VanDerWaalsContact O-N 3.09Å
282	A	44.7	Very low	75.7	Confident	40 Å²	40	67.2 Å²	67.2	33%	0.331	39%	0.389	S	S	.	.			trans	-42.8	128.7	159.6	0	0	0	0	0	104.3	T280 L284	T280-A282 PolarHBondContact O-N 2.94Å; A282-L284 PolarHBondContact O-N 3.03Å
283	P	44.6	Very low	75.8	Confident	97 Å²	97	68 Å²	68	63%	0.63	40%	0.395	S	S	*	.	S	Bend	trans	-42	119.7	-175.6	-21.1	24.4	0	0	0	106.6	G281 G285 E286	G281-P283 VanDerWaalsContact O-N 3.09Å; P283-G285 PolarHBondContact O-N 3.08Å; P283-E286 PolarHBondContact O-N 3.35Å
284	L	43.3	Very low	75.8	Confident	193 Å²	193	63.7 Å²	63.7	100%	1.01	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.1	100.8	-172.3	-96	125.7	0	0	0	109.1	A282	A282-L284 PolarHBondContact O-N 3.03Å
285	G	53.7	Low	75.6	Confident	69 Å²	69	62.2 Å²	62.2	71%	0.711	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.8	-5	176.3	0	0	0	0	0	120.3	P283 E287	P283-G285 PolarHBondContact O-N 3.08Å; G285-E287 PolarHBondContact O-N 3.03Å
286	E	68.6	Low	75.3	Confident	124 Å²	124	66.4 Å²	66.4	58%	0.579	39%	0.392	S	S	*	.			trans	-80.7	85.2	169.9	-79.7	-159	-179.8	0	0	111.7	P283	P283-E286 PolarHBondContact O-N 3.35Å
287	E	84.3	Confident	75.4	Confident	66 Å²	66	60.6 Å²	60.6	31%	0.308	36%	0.361	S	S	.	.			trans	-73.3	130.9	171.2	-58	-175.6	138.1	0	0	110.3	G285 M316	G285-E287 PolarHBondContact O-N 3.03Å; E287-M316 HydrophobicContact CB-CE 3.46Å; E287-M316 VanDerWaalsContact CB-CE 3.46Å
288	Y	94.1	Very high	75.9	Confident	24 Å²	24	61 Å²	61	9%	0.094	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	159.2	176.5	62.6	-91.2	0	0	0	113	L290 K317 V319 L334 N337 A338 S339	Y288-L290 HydrophobicContact CE2-CB 4.38Å; Y288-K317 CarbonylContact C-O 3.52Å; Y288-K317 WeakPolarHBondContact CA-O 3.5Å; Y288-K317 VanDerWaalsContact CB-O 3.22Å; Y288-K317 WeakPolarHBondContact CB-O 3.24Å; Y288-V319 HydrophobicContact CD2-CB 4.38Å; Y288-V319 HydrophobicContact CD2-CG2 4.11Å; Y288-V319 HydrophobicContact CG-CG2 4.33Å; Y288-L334 WeakPolarHBondContact CE2-O 3.49Å; Y288-L334 WeakPolarHBondContact OH-CA 3.28Å; Y288-L334 PolarHBondContact OH-O 2.79Å; Y288-N337 HydrophobicContact CE1-CB 4.14Å; Y288-N337 WeakPolarHBondContact OH-CB 3.33Å; Y288-A338 HydrophobicContact CD2-CB 4.33Å; Y288-A338 HydrophobicContact CE2-CB 3.81Å; Y288-S339 PolarHBondContact O-N 2.98Å
289	I	96.9	Very high	77.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	126.3	172.7	-56.9	178.7	0	0	0	107.4	V291 L310 F314 M316 K317 T318 V319 M340 V342	I289-V291 HydrophobicContact CG2-CG2 4.41Å; I289-L310 HydrophobicContact CD1-CB 4.12Å; I289-L310 HydrophobicContact CG2-CD1 4.26Å; I289-F314 HydrophobicContact CD1-CB 3.88Å; I289-F314 HydrophobicContact CD1-CD2 3.71Å; I289-F314 HydrophobicContact CD1-CG 4.06Å; I289-M316 HydrophobicContact CD1-CB 4.34Å; I289-M316 HydrophobicContact CD1-SD 4.42Å; I289-M316 HydrophobicContact CG1-CB 4.18Å; I289-M316 HydrophobicContact CG1-CE 4.12Å; I289-M316 HydrophobicContact CG1-SD 4.18Å; I289-K317 PolarHBondContact N-O 3.45Å; I289-T318 HydrophobicContact CB-CG2 3.93Å; I289-T318 HydrophobicContact CD1-CG2 4.43Å; I289-T318 HydrophobicContact CG2-CG2 4.38Å; I289-T318 CarbonylContact O-C 3.45Å; I289-T318 WeakPolarHBondContact O-CA 3.4Å; I289-V319 PolarHBondContact O-N 3.18Å; I289-M340 WeakPolarHBondContact CA-O 3.25Å; I289-M340 HydrophobicContact CB-CB 4.38Å; I289-M340 HydrophobicContact CD1-CE 4.3Å; I289-M340 HydrophobicContact CD1-SD 4.28Å; I289-M340 HydrophobicContact CG1-CB 4.06Å; I289-M340 HydrophobicContact CG2-CB 4.05Å; I289-M340 HydrophobicContact CG2-CG 4.18Å; I289-M340 HydrophobicContact CG2-SD 4.05Å; I289-V342 HydrophobicContact CG2-CG2 3.89Å
290	L	97.8	Very high	79.4	Confident	0 Å²	0	54 Å²	54	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.1	177.1	-169.7	62.4	0	0	0	109.2	Y288 V319 V321 L334 V335 A338 M340 L341 V342	Y288-L290 HydrophobicContact CE2-CB 4.38Å; L290-V319 CarbonylContact C-O 3.56Å; L290-V319 WeakPolarHBondContact CA-O 3.39Å; L290-V319 HydrophobicContact CD1-CB 4.09Å; L290-V319 HydrophobicContact CD1-CG1 4.05Å; L290-V321 HydrophobicContact CD1-CB 3.87Å; L290-V321 HydrophobicContact CD1-CG1 3.56Å; L290-V321 HydrophobicContact CD2-CG1 3.89Å; L290-V321 HydrophobicContact CG-CB 4.47Å; L290-V321 HydrophobicContact CG-CG1 3.63Å; L290-L334 HydrophobicContact CD1-CB 4.15Å; L290-L334 HydrophobicContact CD1-CD1 4.45Å; L290-L334 HydrophobicContact CD2-CB 3.91Å; L290-V335 HydrophobicContact CD2-CB 4.31Å; L290-V335 HydrophobicContact CD2-CG2 3.55Å; L290-A338 HydrophobicContact CB-CB 3.93Å; L290-A338 HydrophobicContact CD2-CB 4.44Å; L290-M340 PolarHBondContact N-O 3.28Å; L290-L341 HydrophobicContact CB-CD1 4.01Å; L290-L341 HydrophobicContact CD2-CD1 3.94Å; L290-L341 HydrophobicContact CG-CD1 4.03Å; L290-L341 CarbonylContact O-C 3.27Å; L290-L341 WeakPolarHBondContact O-CA 3.35Å; L290-V342 PolarHBondContact O-N 3.3Å
291	V	98.5	Very high	81.9	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.7	175.2	-174.6	0	0	0	0	108.7	I289 S293 I300 L306 L307 L310 V319 T320 V321 V342	I289-V291 HydrophobicContact CG2-CG2 4.41Å; V291-S293 PolarHBondContact O-N 2.92Å; V291-I300 HydrophobicContact CG1-CD1 4.37Å; V291-L306 HydrophobicContact CG1-CD2 4.43Å; V291-L307 HydrophobicContact CB-CD2 3.87Å; V291-L307 HydrophobicContact CG2-CD2 3.54Å; V291-L310 HydrophobicContact CG2-CD1 3.96Å; V291-V319 PolarHBondContact N-O 3.24Å; V291-T320 CarbonylContact O-C 3.55Å; V291-T320 VanDerWaalsContact O-CA 3.3Å; V291-T320 WeakPolarHBondContact O-CA 3.46Å; V291-V321 PolarHBondContact O-N 3.32Å; V291-V342 WeakPolarHBondContact CA-O 3.17Å; V291-V342 HydrophobicContact CG2-CB 4.19Å; V291-V342 HydrophobicContact CG2-CG2 4.48Å
292	F	98	Very high	84.5	Confident	3 Å²	3	51 Å²	51	1%	0.013	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	119.9	172.3	-91.6	-71.4	0	0	0	110.5	V321 L323 V331 V335 L341 V342 Q348 T351	F292-V321 CarbonylContact C-O 3.53Å; F292-V321 VanDerWaalsContact CA-O 3.32Å; F292-V321 WeakPolarHBondContact CA-O 3.43Å; F292-V321 HydrophobicContact CD1-CG1 3.61Å; F292-V321 HydrophobicContact CE1-CG1 3.65Å; F292-V321 HydrophobicContact CG-CG1 4.05Å; F292-V321 HydrophobicContact CZ-CG1 4.15Å; F292-L323 HydrophobicContact CE1-CD2 4.45Å; F292-L323 HydrophobicContact CE1-CG 4.16Å; F292-V331 HydrophobicContact CE1-CG1 3.87Å; F292-V331 HydrophobicContact CZ-CG1 3.69Å; F292-V335 HydrophobicContact CE2-CG2 4.48Å; F292-V335 HydrophobicContact CZ-CG2 4.36Å; F292-L341 HydrophobicContact CD2-CD1 3.63Å; F292-L341 HydrophobicContact CD2-CD2 4.48Å; F292-L341 HydrophobicContact CD2-CG 4.33Å; F292-L341 HydrophobicContact CE2-CD1 3.66Å; F292-L341 HydrophobicContact CE2-CD2 4.11Å; F292-L341 HydrophobicContact CE2-CG 4.35Å; F292-V342 PolarHBondContact N-O 3.16Å; F292-Q348 VanDerWaalsContact CB-NE2 3.31Å; F292-Q348 HydrophobicContact CD1-CB 4.46Å; F292-Q348 HydrophobicContact CD1-CG 4.36Å; F292-Q348 HydrophobicContact CD2-CG 4.22Å; F292-Q348 HydrophobicContact CE1-CB 4.34Å; F292-Q348 HydrophobicContact CG-CG 4.15Å; F292-Q348 HydrophobicContact CZ-CB 4.4Å; F292-T351 WeakPolarHBondContact CE2-OG1 3.29Å; F292-T351 HydrophobicContact CZ-CG2 4.37Å
293	S	95.7	Very high	87	Confident	25 Å²	25	51 Å²	51	18%	0.175	28%	0.28	C	S	.	.			trans	-89.1	158.2	167.5	-163.5	0	0	0	0	110.6	V291 E303 V321	V291-S293 PolarHBondContact O-N 2.92Å; S293-E303 WeakPolarHBondContact CA-OE2 3.4Å; S293-E303 WeakPolarHBondContact CB-OE2 3.49Å; S293-E303 PolarHBondContact OG-OE1 3.24Å; S293-E303 PolarHBondContact OG-OE2 3.37Å; S293-V321 PolarHBondContact N-O 3.27Å
294	R	94.3	Very high	89.6	Confident	30 Å²	30	49.6 Å²	49.6	11%	0.113	28%	0.277	C	S	.	.			trans	-139.5	153.5	178.9	-59.4	-179.7	77.1	120.1	19.7	108.3	N297 R298 L299 Q348	R294-N297 VanDerWaalsContact CD-O 3.27Å; R294-N297 WeakPolarHBondContact CD-O 3.45Å; R294-N297 PolarHBondContact NE-O 3.04Å; R294-N297 PolarHBondContact NH2-OD1 2.8Å; R294-N297 VanDerWaalsContact NH2-OD1 3.17Å; R294-R298 WeakPolarHBondContact CD-O 3.25Å; R294-L299 HydrophobicContact CB-CD2 4Å; R294-L299 WeakPolarHBondContact O-CD2 3.45Å; R294-Q348 VanDerWaalsContact CZ-OE1 3.29Å; R294-Q348 VanDerWaalsContact NH1-OE1 3.16Å
295	T	90.6	Very high	92.2	Very high	79 Å²	79	45.4 Å²	45.4	49%	0.485	25%	0.252	S	S	.	.	S	Bend	trans	-118.3	-14.3	-179.6	55.3	0	0	0	0	114
296	Q	88.9	Confident	94.4	Very high	122 Å²	122	42.1 Å²	42.1	57%	0.57	22%	0.218	S	C	*	.	S	Bend	trans	-110.2	-47.4	-171.7	-58.9	-176.5	25.7	0	0	114.3	R407	Q296-R407 PolarHBondContact O-NH1 2.72Å; Q296-R407 PolarHBondContact O-NH2 2.97Å
297	N	91.7	Very high	95.8	Very high	18 Å²	18	37.6 Å²	37.6	10%	0.096	20%	0.198	C	C	.	.	S	Bend	trans	-151.9	161.1	-175.8	57.2	66.2	0	0	0	110.6	R294 L299 Y447	R294-N297 VanDerWaalsContact CD-O 3.27Å; R294-N297 WeakPolarHBondContact CD-O 3.45Å; R294-N297 PolarHBondContact NE-O 3.04Å; R294-N297 PolarHBondContact NH2-OD1 2.8Å; R294-N297 VanDerWaalsContact NH2-OD1 3.17Å; N297-L299 VanDerWaalsContact C-N 3.27Å; N297-L299 PolarHBondContact O-N 2.69Å; N297-Y447 HydrophobicContact CB-CD1 3.96Å
298	R	96.1	Very high	96.4	Very high	24 Å²	24	39.9 Å²	39.9	9%	0.091	21%	0.211	C	C	.	.	S	Bend	trans	54.9	44.4	-176.7	-67	179.2	-76.2	-100.5	-3.5	111.9	R294 M344 H345 I446 Y447 Q448 D449	R294-R298 WeakPolarHBondContact CD-O 3.25Å; R298-M344 HydrophobicContact CB-CB 4.17Å; R298-M344 WeakPolarHBondContact O-CG 3.43Å; R298-H345 WeakPolarHBondContact CD-O 3.25Å; R298-H345 PolarHBondContact NE-O 2.81Å; R298-H345 VanDerWaalsContact NE-O 3.17Å; R298-I446 WeakPolarHBondContact CD-O 3.5Å; R298-I446 WeakPolarHBondContact CG-O 3.49Å; R298-Y447 VanDerWaalsContact NH1-CD1 3.34Å; R298-Q448 WeakPolarHBondContact CA-O 3.47Å; R298-D449 PolarHBondContact N-OD1 2.85Å
299	L	97.6	Very high	96.6	Very high	44 Å²	44	39.6 Å²	39.6	23%	0.23	21%	0.214	C	C	.	.			trans	-68.8	143.9	-179.6	-51	-178	0	0	0	110.5	R294 N297 L301 D449 T450	R294-L299 HydrophobicContact CB-CD2 4Å; R294-L299 WeakPolarHBondContact O-CD2 3.45Å; N297-L299 VanDerWaalsContact C-N 3.27Å; N297-L299 PolarHBondContact O-N 2.69Å; L299-L301 HydrophobicContact CB-CD2 4.26Å; L299-D449 HydrophobicContact CB-CB 3.97Å; L299-D449 HydrophobicContact CG-CB 4.5Å; L299-D449 WeakPolarHBondContact CG-OD1 3.3Å; L299-D449 PolarHBondContact N-OD1 3.25Å; L299-T450 PolarHBondContact O-N 2.81Å
300	I	98.6	Very high	96.6	Very high	14 Å²	14	39.6 Å²	39.6	7%	0.072	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-89	103.9	164.9	-61.2	174.2	0	0	0	106.7	V291 N302 E303 L306 M344 L364 T450 V452	V291-I300 HydrophobicContact CG1-CD1 4.37Å; I300-N302 VanDerWaalsContact C-N 3.27Å; I300-N302 PolarHBondContact O-N 2.9Å; I300-E303 HydrophobicContact CB-CB 4.31Å; I300-E303 HydrophobicContact CG2-CB 4.16Å; I300-E303 PolarHBondContact O-N 2.82Å; I300-L306 HydrophobicContact CD1-CD2 3.99Å; I300-L306 HydrophobicContact CG2-CD2 3.96Å; I300-M344 HydrophobicContact CD1-CG 4.11Å; I300-M344 HydrophobicContact CG1-CG 3.64Å; I300-M344 HydrophobicContact CG1-SD 4.08Å; I300-L364 HydrophobicContact CD1-CD1 3.96Å; I300-T450 WeakPolarHBondContact CA-O 3.49Å; I300-V452 HydrophobicContact CG2-CG2 3.85Å
301	L	98.4	Very high	96.5	Very high	87 Å²	87	40.8 Å²	40.8	46%	0.455	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-25	-169.1	-62.5	176.6	0	0	0	113.7	L299 V402 D449 T450 K451	L299-L301 HydrophobicContact CB-CD2 4.26Å; L301-V402 HydrophobicContact CD1-CB 4.23Å; L301-V402 HydrophobicContact CD1-CG2 3.55Å; L301-D449 HydrophobicContact CD1-CB 4.33Å; L301-D449 HydrophobicContact CD2-CB 3.89Å; L301-D449 HydrophobicContact CG-CB 4.13Å; L301-T450 PolarHBondContact N-O 3.43Å; L301-K451 HydrophobicContact CB-CB 4.34Å; L301-K451 HydrophobicContact CD1-CB 4.43Å
302	N	98.3	Very high	96.4	Very high	11 Å²	11	47.4 Å²	47.4	6%	0.059	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	42.4	176.6	63.1	-33.4	0	0	0	111.8	I300 A304 E305 L306 K451 V452	I300-N302 VanDerWaalsContact C-N 3.27Å; I300-N302 PolarHBondContact O-N 2.9Å; N302-A304 VanDerWaalsContact C-N 3.3Å; N302-A304 PolarHBondContact O-N 3.06Å; N302-E305 HydrophobicContact CB-CB 4.27Å; N302-E305 HydrophobicContact CB-CG 4.34Å; N302-E305 PolarHBondContact ND2-OE2 2.87Å; N302-E305 PolarHBondContact O-N 3.14Å; N302-E305 VanDerWaalsContact O-N 3.13Å; N302-L306 PolarHBondContact O-N 3.49Å; N302-K451 HydrophobicContact CB-CG 4.3Å; N302-V452 PolarHBondContact ND2-O 3.26Å; N302-V452 PolarHBondContact OD1-N 3.09Å
303	E	98	Very high	96.2	Very high	41 Å²	41	49.9 Å²	49.9	19%	0.192	27%	0.267	C	S	.	.	H	α-helix	trans	-54	-42.3	-176.4	-169.7	-179.9	100.1	0	0	113	S293 I300 E305 L306 L307	S293-E303 WeakPolarHBondContact CA-OE2 3.4Å; S293-E303 WeakPolarHBondContact CB-OE2 3.49Å; S293-E303 PolarHBondContact OG-OE1 3.24Å; S293-E303 PolarHBondContact OG-OE2 3.37Å; I300-E303 HydrophobicContact CB-CB 4.31Å; I300-E303 HydrophobicContact CG2-CB 4.16Å; I300-E303 PolarHBondContact O-N 2.82Å; E303-E305 PolarHBondContact O-N 2.69Å; E303-L306 WeakPolarHBondContact O-CB 3.14Å; E303-L306 PolarHBondContact O-N 3.47Å; E303-L307 HydrophobicContact CG-CD1 4.22Å; E303-L307 HydrophobicContact CG-CG 4.5Å; E303-L307 VanDerWaalsContact O-CG 3.29Å; E303-L307 WeakPolarHBondContact O-CG 3.36Å; E303-L307 PolarHBondContact O-N 2.8Å
304	A	97.9	Very high	96	Very high	68 Å²	68	49.4 Å²	49.4	56%	0.562	26%	0.261	S	S	*	.	H	α-helix	trans	-61.7	-42.7	178.3	0	0	0	0	0	112.8	N302 L306 L307 L308	N302-A304 VanDerWaalsContact C-N 3.3Å; N302-A304 PolarHBondContact O-N 3.06Å; A304-L306 VanDerWaalsContact C-N 3.34Å; A304-L307 PolarHBondContact O-N 2.99Å; A304-L308 WeakPolarHBondContact O-CG 3.22Å; A304-L308 PolarHBondContact O-N 3.05Å; A304-L308 VanDerWaalsContact O-N 3.16Å
305	E	98.5	Very high	95.9	Very high	105 Å²	105	54.4 Å²	54.4	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-64.7	-41.5	175.9	-63.2	170.8	-155.1	0	0	110.8	N302 E303 L308 A309 I454	N302-E305 HydrophobicContact CB-CB 4.27Å; N302-E305 HydrophobicContact CB-CG 4.34Å; N302-E305 PolarHBondContact ND2-OE2 2.87Å; N302-E305 PolarHBondContact O-N 3.14Å; N302-E305 VanDerWaalsContact O-N 3.13Å; E303-E305 PolarHBondContact O-N 2.69Å; E305-L308 PolarHBondContact O-N 3.29Å; E305-A309 WeakPolarHBondContact O-CB 3.24Å; E305-A309 PolarHBondContact O-N 3.15Å; E305-I454 HydrophobicContact CB-CD1 3.57Å
306	L	98.6	Very high	96	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-46.5	177.6	175	62	0	0	0	111.5	V291 I300 N302 E303 A304 L308 A309 L310 V452 L457	V291-L306 HydrophobicContact CG1-CD2 4.43Å; I300-L306 HydrophobicContact CD1-CD2 3.99Å; I300-L306 HydrophobicContact CG2-CD2 3.96Å; N302-L306 PolarHBondContact O-N 3.49Å; E303-L306 WeakPolarHBondContact O-CB 3.14Å; E303-L306 PolarHBondContact O-N 3.47Å; A304-L306 VanDerWaalsContact C-N 3.34Å; L306-L308 VanDerWaalsContact C-N 3.35Å; L306-L308 PolarHBondContact O-N 3.37Å; L306-A309 PolarHBondContact O-N 2.84Å; L306-L310 HydrophobicContact CD1-CD1 3.76Å; L306-L310 HydrophobicContact CD1-CG 3.93Å; L306-L310 HydrophobicContact CG-CD1 3.86Å; L306-L310 HydrophobicContact CG-CG 4.43Å; L306-L310 WeakPolarHBondContact O-CB 3.28Å; L306-L310 VanDerWaalsContact O-CG 3.3Å; L306-L310 WeakPolarHBondContact O-CG 3.49Å; L306-L310 PolarHBondContact O-N 2.89Å; L306-V452 HydrophobicContact CD1-CG1 4.37Å; L306-L457 HydrophobicContact CD1-CD2 3.52Å
307	L	98.2	Very high	96.2	Very high	29 Å²	29	51.6 Å²	51.6	15%	0.152	27%	0.265	C	S	.	.	H	α-helix	trans	-59.9	-44.1	177.9	-70.6	164.9	0	0	0	111.9	V291 E303 A304 A311 T318 T320	V291-L307 HydrophobicContact CB-CD2 3.87Å; V291-L307 HydrophobicContact CG2-CD2 3.54Å; E303-L307 HydrophobicContact CG-CD1 4.22Å; E303-L307 HydrophobicContact CG-CG 4.5Å; E303-L307 VanDerWaalsContact O-CG 3.29Å; E303-L307 WeakPolarHBondContact O-CG 3.36Å; E303-L307 PolarHBondContact O-N 2.8Å; A304-L307 PolarHBondContact O-N 2.99Å; L307-A311 WeakPolarHBondContact O-CB 3.25Å; L307-A311 PolarHBondContact O-N 3.39Å; L307-T318 WeakPolarHBondContact O-CG2 3.23Å; L307-T318 PolarHBondContact O-OG1 3.02Å; L307-T318 VanDerWaalsContact O-OG1 3.05Å; L307-T320 HydrophobicContact CD1-CG2 3.42Å; L307-T320 VanDerWaalsContact CD1-CG2 3.42Å; L307-T320 HydrophobicContact CD2-CG2 3.7Å; L307-T320 HydrophobicContact CG-CG2 4.13Å
308	L	98	Very high	96.5	Very high	113 Å²	113	52.3 Å²	52.3	59%	0.592	27%	0.271	S	S	*	.	H	α-helix	trans	-65.5	-45.1	178.2	-70.9	171.5	0	0	0	111.4	A304 E305 L306 A311 Q312	A304-L308 WeakPolarHBondContact O-CG 3.22Å; A304-L308 PolarHBondContact O-N 3.05Å; A304-L308 VanDerWaalsContact O-N 3.16Å; E305-L308 PolarHBondContact O-N 3.29Å; L306-L308 VanDerWaalsContact C-N 3.35Å; L306-L308 PolarHBondContact O-N 3.37Å; L308-A311 PolarHBondContact O-N 2.9Å; L308-Q312 WeakPolarHBondContact O-CB 3.12Å; L308-Q312 VanDerWaalsContact O-CG 3.29Å; L308-Q312 WeakPolarHBondContact O-CG 3.28Å; L308-Q312 PolarHBondContact O-N 3.5Å
309	A	98	Very high	96.5	Very high	18 Å²	18	52.7 Å²	52.7	15%	0.149	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-43.4	-179.6	0	0	0	0	0	112.4	E305 L306 Q312 E313 I454	E305-A309 WeakPolarHBondContact O-CB 3.24Å; E305-A309 PolarHBondContact O-N 3.15Å; L306-A309 PolarHBondContact O-N 2.84Å; A309-Q312 PolarHBondContact O-N 3.16Å; A309-E313 WeakPolarHBondContact O-CB 3.44Å; A309-E313 PolarHBondContact O-N 2.99Å; A309-I454 HydrophobicContact CB-CD1 4.24Å; A309-I454 HydrophobicContact CB-CG2 3.32Å
310	L	97.1	Very high	96.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-42.7	175.3	-72.6	170.2	0	0	0	111.6	I289 V291 L306 F314 T318 V342 I458 I461	I289-L310 HydrophobicContact CD1-CB 4.12Å; I289-L310 HydrophobicContact CG2-CD1 4.26Å; V291-L310 HydrophobicContact CG2-CD1 3.96Å; L306-L310 HydrophobicContact CD1-CD1 3.76Å; L306-L310 HydrophobicContact CD1-CG 3.93Å; L306-L310 HydrophobicContact CG-CD1 3.86Å; L306-L310 HydrophobicContact CG-CG 4.43Å; L306-L310 WeakPolarHBondContact O-CB 3.28Å; L306-L310 VanDerWaalsContact O-CG 3.3Å; L306-L310 WeakPolarHBondContact O-CG 3.49Å; L306-L310 PolarHBondContact O-N 2.89Å; L310-F314 HydrophobicContact CD2-CD2 4.22Å; L310-F314 HydrophobicContact CD2-CE2 3.91Å; L310-F314 WeakPolarHBondContact O-CD2 3.41Å; L310-F314 PolarHBondContact O-N 3.27Å; L310-T318 HydrophobicContact CB-CG2 3.8Å; L310-V342 HydrophobicContact CD1-CG2 3.98Å; L310-I458 HydrophobicContact CD2-CD1 3.85Å; L310-I461 HydrophobicContact CD2-CD1 3.99Å
311	A	95.7	Very high	96.3	Very high	25 Å²	25	52.8 Å²	52.8	21%	0.207	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-45.2	178.4	0	0	0	0	0	111.9	L307 L308 Q315 M316 T318	L307-A311 WeakPolarHBondContact O-CB 3.25Å; L307-A311 PolarHBondContact O-N 3.39Å; L308-A311 PolarHBondContact O-N 2.9Å; A311-Q315 WeakPolarHBondContact O-CA 3.4Å; A311-Q315 PolarHBondContact O-N 2.98Å; A311-M316 VanDerWaalsContact CA-O 3.26Å; A311-M316 WeakPolarHBondContact CA-O 3.46Å; A311-M316 WeakPolarHBondContact CB-O 3.43Å; A311-M316 PolarHBondContact O-N 3.15Å; A311-T318 HydrophobicContact CB-CG2 3.88Å
312	Q	95.3	Very high	96.1	Very high	140 Å²	140	48.8 Å²	48.8	65%	0.654	26%	0.258	S	S	*	.	H	α-helix	trans	-66.6	-44.4	177.8	-73.2	176.4	-10.5	0	0	112.2	L308 A309 Q315	L308-Q312 WeakPolarHBondContact O-CB 3.12Å; L308-Q312 VanDerWaalsContact O-CG 3.29Å; L308-Q312 WeakPolarHBondContact O-CG 3.28Å; L308-Q312 PolarHBondContact O-N 3.5Å; A309-Q312 PolarHBondContact O-N 3.16Å; Q312-Q315 PolarHBondContact O-NE2 2.96Å
313	E	94.7	Very high	95.8	Very high	55 Å²	55	50.8 Å²	50.8	26%	0.257	27%	0.268	S	S	.	.	H	α-helix	trans	-64.9	-48.4	-176.8	172.7	55.1	-144.2	0	0	112	A309 I458 R462	A309-E313 WeakPolarHBondContact O-CB 3.44Å; A309-E313 PolarHBondContact O-N 2.99Å; E313-I458 HydrophobicContact CB-CD1 4.18Å; E313-I458 HydrophobicContact CG-CD1 4.04Å; E313-I458 HydrophobicContact CG-CG1 4.48Å; E313-I458 HydrophobicContact CG-CG2 3.68Å; E313-R462 IonicContact OE1-CZ 3.34Å; E313-R462 IonicContact OE1-NE 2.72Å; E313-R462 PolarHBondContact OE1-NE 2.87Å; E313-R462 IonicContact OE1-NH2 2.64Å; E313-R462 PolarHBondContact OE1-NH2 2.9Å; E313-R462 IonicContact OE2-CZ 3.38Å; E313-R462 IonicContact OE2-NE 3.02Å; E313-R462 IonicContact OE2-NH2 2.86Å; E313-R462 PolarHBondContact OE2-NH2 3.49Å
314	F	92.4	Very high	95.4	Very high	15 Å²	15	52.5 Å²	52.5	7%	0.066	28%	0.276	C	S	.	.	H	α-helix	trans	-95.6	-6.4	-174.4	-64	-72.5	0	0	0	113.5	I289 L310 M316 M340 I458 I461 P469	I289-F314 HydrophobicContact CD1-CB 3.88Å; I289-F314 HydrophobicContact CD1-CD2 3.71Å; I289-F314 HydrophobicContact CD1-CG 4.06Å; L310-F314 HydrophobicContact CD2-CD2 4.22Å; L310-F314 HydrophobicContact CD2-CE2 3.91Å; L310-F314 WeakPolarHBondContact O-CD2 3.41Å; L310-F314 PolarHBondContact O-N 3.27Å; F314-M316 VanDerWaalsContact C-N 3.34Å; F314-M316 HydrophobicContact CB-CG 4.25Å; F314-M316 HydrophobicContact CB-SD 3.99Å; F314-M316 WeakPolarHBondContact O-CG 3.33Å; F314-M340 HydrophobicContact CD1-CE 4.47Å; F314-M340 HydrophobicContact CD2-CE 4.16Å; F314-M340 HydrophobicContact CE1-CE 4.32Å; F314-M340 HydrophobicContact CE2-CE 3.99Å; F314-M340 HydrophobicContact CG-CE 4.42Å; F314-M340 HydrophobicContact CZ-CE 4.1Å; F314-I458 HydrophobicContact CE2-CD1 4.18Å; F314-I461 HydrophobicContact CE1-CG2 4.07Å; F314-I461 HydrophobicContact CE2-CD1 4.3Å; F314-I461 HydrophobicContact CE2-CG2 4.18Å; F314-I461 HydrophobicContact CZ-CB 4.06Å; F314-I461 HydrophobicContact CZ-CD1 4.46Å; F314-I461 HydrophobicContact CZ-CG2 3.39Å; F314-P469 HydrophobicContact CD1-CG 4.42Å
315	Q	92.3	Very high	94.9	Very high	135 Å²	135	54.9 Å²	54.9	63%	0.631	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	49.8	-176.9	-61.8	-70.3	-49.8	0	0	111	A311 Q312 R468	A311-Q315 WeakPolarHBondContact O-CA 3.4Å; A311-Q315 PolarHBondContact O-N 2.98Å; Q312-Q315 PolarHBondContact O-NE2 2.96Å; Q315-R468 PolarHBondContact O-NH2 2.82Å; Q315-R468 VanDerWaalsContact O-NH2 3.15Å
316	M	91.8	Very high	94.6	Very high	14 Å²	14	53.6 Å²	53.6	7%	0.069	27%	0.273	C	S	.	.	S	Bend	trans	-137.2	151.8	-175.3	-68.2	173.3	70.7	0	0	110.1	E287 I289 A311 F314 P469	E287-M316 HydrophobicContact CB-CE 3.46Å; E287-M316 VanDerWaalsContact CB-CE 3.46Å; I289-M316 HydrophobicContact CD1-CB 4.34Å; I289-M316 HydrophobicContact CD1-SD 4.42Å; I289-M316 HydrophobicContact CG1-CB 4.18Å; I289-M316 HydrophobicContact CG1-CE 4.12Å; I289-M316 HydrophobicContact CG1-SD 4.18Å; A311-M316 VanDerWaalsContact CA-O 3.26Å; A311-M316 WeakPolarHBondContact CA-O 3.46Å; A311-M316 WeakPolarHBondContact CB-O 3.43Å; A311-M316 PolarHBondContact O-N 3.15Å; F314-M316 VanDerWaalsContact C-N 3.34Å; F314-M316 HydrophobicContact CB-CG 4.25Å; F314-M316 HydrophobicContact CB-SD 3.99Å; F314-M316 WeakPolarHBondContact O-CG 3.33Å; M316-P469 HydrophobicContact CE-CG 4.47Å; M316-P469 HydrophobicContact SD-CG 3.81Å
317	K	94.1	Very high	94.4	Very high	127 Å²	127	56.4 Å²	56.4	55%	0.552	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	138.3	171.9	-177	178.4	180	179.8	0	109.4	Y288 I289 V319	Y288-K317 CarbonylContact C-O 3.52Å; Y288-K317 WeakPolarHBondContact CA-O 3.5Å; Y288-K317 VanDerWaalsContact CB-O 3.22Å; Y288-K317 WeakPolarHBondContact CB-O 3.24Å; I289-K317 PolarHBondContact N-O 3.45Å; K317-V319 HydrophobicContact CD-CG2 4.26Å; K317-V319 HydrophobicContact CG-CG2 4.16Å
318	T	96	Very high	94.2	Very high	34 Å²	34	56.8 Å²	56.8	21%	0.209	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.8	169.4	46.7	0	0	0	0	109.6	I289 L307 L310 A311	I289-T318 HydrophobicContact CB-CG2 3.93Å; I289-T318 HydrophobicContact CD1-CG2 4.43Å; I289-T318 HydrophobicContact CG2-CG2 4.38Å; I289-T318 CarbonylContact O-C 3.45Å; I289-T318 WeakPolarHBondContact O-CA 3.4Å; L307-T318 WeakPolarHBondContact O-CG2 3.23Å; L307-T318 PolarHBondContact O-OG1 3.02Å; L307-T318 VanDerWaalsContact O-OG1 3.05Å; L310-T318 HydrophobicContact CB-CG2 3.8Å; A311-T318 HydrophobicContact CB-CG2 3.88Å
319	V	96.2	Very high	94.1	Very high	32 Å²	32	52.9 Å²	52.9	19%	0.194	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136	-178.8	-178.9	0	0	0	0	107.8	Y288 I289 L290 V291 K317 L334	Y288-V319 HydrophobicContact CD2-CB 4.38Å; Y288-V319 HydrophobicContact CD2-CG2 4.11Å; Y288-V319 HydrophobicContact CG-CG2 4.33Å; I289-V319 PolarHBondContact O-N 3.18Å; L290-V319 CarbonylContact C-O 3.56Å; L290-V319 WeakPolarHBondContact CA-O 3.39Å; L290-V319 HydrophobicContact CD1-CB 4.09Å; L290-V319 HydrophobicContact CD1-CG1 4.05Å; V291-V319 PolarHBondContact N-O 3.24Å; K317-V319 HydrophobicContact CD-CG2 4.26Å; K317-V319 HydrophobicContact CG-CG2 4.16Å; V319-L334 HydrophobicContact CG1-CD2 4.44Å
320	T	96.9	Very high	93.9	Very high	58 Å²	58	54.7 Å²	54.7	36%	0.356	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	149.3	171.8	50	0	0	0	0	110.9	V291 L307	V291-T320 CarbonylContact O-C 3.55Å; V291-T320 VanDerWaalsContact O-CA 3.3Å; V291-T320 WeakPolarHBondContact O-CA 3.46Å; L307-T320 HydrophobicContact CD1-CG2 3.42Å; L307-T320 VanDerWaalsContact CD1-CG2 3.42Å; L307-T320 HydrophobicContact CD2-CG2 3.7Å; L307-T320 HydrophobicContact CG-CG2 4.13Å
321	V	96.3	Very high	93.8	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	145.6	172.7	64.1	0	0	0	0	109.8	L290 V291 F292 S293 H326 V331 L334	L290-V321 HydrophobicContact CD1-CB 3.87Å; L290-V321 HydrophobicContact CD1-CG1 3.56Å; L290-V321 HydrophobicContact CD2-CG1 3.89Å; L290-V321 HydrophobicContact CG-CB 4.47Å; L290-V321 HydrophobicContact CG-CG1 3.63Å; V291-V321 PolarHBondContact O-N 3.32Å; F292-V321 CarbonylContact C-O 3.53Å; F292-V321 VanDerWaalsContact CA-O 3.32Å; F292-V321 WeakPolarHBondContact CA-O 3.43Å; F292-V321 HydrophobicContact CD1-CG1 3.61Å; F292-V321 HydrophobicContact CE1-CG1 3.65Å; F292-V321 HydrophobicContact CG-CG1 4.05Å; F292-V321 HydrophobicContact CZ-CG1 4.15Å; S293-V321 PolarHBondContact N-O 3.27Å; V321-H326 HydrophobicContact CG2-CB 4.45Å; V321-V331 HydrophobicContact CG2-CB 4.28Å; V321-V331 HydrophobicContact CG2-CG1 4.21Å; V321-V331 HydrophobicContact CG2-CG2 3.63Å; V321-L334 HydrophobicContact CB-CD1 4.16Å; V321-L334 HydrophobicContact CG2-CD1 3.92Å
322	S	94.5	Very high	93.8	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.021	28%	0.279	C	S	.	.			trans	-131.9	140.1	175.9	149.9	0	0	0	0	108.6	E324 D325 H326	S322-E324 VanDerWaalsContact C-N 3.25Å; S322-E324 WeakPolarHBondContact OG-CB 3.37Å; S322-E324 PolarHBondContact OG-N 3.06Å; S322-E324 PolarHBondContact OG-OE2 3.4Å; S322-D325 PolarHBondContact OG-N 3.2Å; S322-D325 VanDerWaalsContact OG-N 3.08Å; S322-H326 PolarHBondContact N-ND1 3.11Å; S322-H326 VanDerWaalsContact O-CB 3.3Å; S322-H326 WeakPolarHBondContact O-CB 3.41Å; S322-H326 PolarHBondContact O-N 2.95Å; S322-H326 VanDerWaalsContact O-N 3.12Å; S322-H326 PolarHBondContact O-ND1 3.02Å
323	L	91.6	Very high	93.8	Very high	53 Å²	53	52.1 Å²	52.1	28%	0.277	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-21.9	173.6	-73.2	176.6	0	0	0	112	L164 F292 F328 V331 Q348	L164-L323 HydrophobicContact CD2-CD1 3.73Å; L164-L323 HydrophobicContact CD2-CD2 4.31Å; F292-L323 HydrophobicContact CE1-CD2 4.45Å; F292-L323 HydrophobicContact CE1-CG 4.16Å; L323-F328 HydrophobicContact CD2-CD2 4.08Å; L323-F328 HydrophobicContact CD2-CE2 4.37Å; L323-V331 HydrophobicContact CD2-CB 4.41Å; L323-V331 HydrophobicContact CD2-CG1 4.07Å; L323-V331 HydrophobicContact CD2-CG2 4.11Å; L323-Q348 HydrophobicContact CD1-CB 3.44Å; L323-Q348 VanDerWaalsContact CD1-CB 3.44Å; L323-Q348 HydrophobicContact CG-CB 4.27Å
324	E	88.6	Confident	93.8	Very high	77 Å²	77	51.1 Å²	51.1	36%	0.36	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-36	177.8	-56.3	86.6	170.8	0	0	111.9	S322	S322-E324 VanDerWaalsContact C-N 3.25Å; S322-E324 WeakPolarHBondContact OG-CB 3.37Å; S322-E324 PolarHBondContact OG-N 3.06Å; S322-E324 PolarHBondContact OG-OE2 3.4Å
325	D	89	Confident	94	Very high	118 Å²	118	50.4 Å²	50.4	63%	0.631	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-17.2	-172.5	-62.5	-31.8	0	0	0	114	S322	S322-D325 PolarHBondContact OG-N 3.2Å; S322-D325 VanDerWaalsContact OG-N 3.08Å
326	H	92.3	Very high	94	Very high	78 Å²	78	44.7 Å²	44.7	36%	0.361	24%	0.235	S	C	.	.	S	Bend	trans	-117.9	145.3	-176.6	-61.1	72.6	0	0	0	112.1	V321 S322 V331	V321-H326 HydrophobicContact CG2-CB 4.45Å; S322-H326 PolarHBondContact N-ND1 3.11Å; S322-H326 VanDerWaalsContact O-CB 3.3Å; S322-H326 WeakPolarHBondContact O-CB 3.41Å; S322-H326 PolarHBondContact O-N 2.95Å; S322-H326 VanDerWaalsContact O-N 3.12Å; S322-H326 PolarHBondContact O-ND1 3.02Å; H326-V331 HydrophobicContact CB-CG2 3.94Å
327	A	93.3	Very high	94	Very high	59 Å²	59	46.4 Å²	46.4	49%	0.488	25%	0.245	S	C	.	.			trans	-61.5	143.1	170	0	0	0	0	0	110.4	A329 D330 V331	A327-A329 PolarHBondContact O-N 3.33Å; A327-D330 WeakPolarHBondContact O-CB 3.46Å; A327-D330 PolarHBondContact O-N 2.84Å; A327-V331 PolarHBondContact O-N 3.47Å; A327-V331 VanDerWaalsContact O-N 3.15Å
328	F	94.9	Very high	94	Very high	38 Å²	38	40.3 Å²	40.3	17%	0.167	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-34.8	-176	-172.6	-105.7	0	0	0	113	L164 F168 L205 L275 L323 D330 V331 V332 T351 F354	L164-F328 HydrophobicContact CD1-CE2 4.24Å; L164-F328 HydrophobicContact CD2-CE2 4.04Å; F168-F328 HydrophobicContact CE2-CE1 4.16Å; F168-F328 HydrophobicContact CE2-CE2 4.31Å; F168-F328 AromaticContact CE2-CZ 3.57Å; F168-F328 HydrophobicContact CE2-CZ 3.57Å; F168-F328 AromaticContact CZ-CE1 3.66Å; F168-F328 HydrophobicContact CZ-CE1 3.66Å; F168-F328 HydrophobicContact CZ-CE2 4.48Å; F168-F328 AromaticContact CZ-CZ 3.37Å; F168-F328 HydrophobicContact CZ-CZ 3.37Å; L205-F328 HydrophobicContact CD1-CD1 4.49Å; L205-F328 HydrophobicContact CD1-CE1 4.3Å; L205-F328 HydrophobicContact CD2-CD1 3.62Å; L205-F328 HydrophobicContact CD2-CE1 3.86Å; L205-F328 HydrophobicContact CD2-CG 4.48Å; L275-F328 HydrophobicContact CD1-CD1 4.05Å; L275-F328 HydrophobicContact CD1-CE1 4.13Å; L323-F328 HydrophobicContact CD2-CD2 4.08Å; L323-F328 HydrophobicContact CD2-CE2 4.37Å; F328-D330 VanDerWaalsContact C-N 3.31Å; F328-D330 PolarHBondContact O-N 2.93Å; F328-V331 PolarHBondContact O-N 2.9Å; F328-V332 HydrophobicContact CD1-CG2 3.93Å; F328-V332 HydrophobicContact CE1-CG2 3.47Å; F328-V332 VanDerWaalsContact CE1-CG2 3.47Å; F328-V332 HydrophobicContact CE2-CG2 4.42Å; F328-V332 HydrophobicContact CZ-CG2 3.74Å; F328-V332 WeakPolarHBondContact O-CG2 3.47Å; F328-V332 PolarHBondContact O-N 2.7Å; F328-T351 HydrophobicContact CE2-CG2 4.2Å; F328-F354 HydrophobicContact CZ-CE2 4.23Å
329	A	94.6	Very high	93.9	Very high	31 Å²	31	38.8 Å²	38.8	26%	0.256	21%	0.209	S	C	.	.	H	α-helix	trans	-60.2	-38.5	174.4	0	0	0	0	0	112.5	L275 V277 A327 V332 R333	L275-A329 HydrophobicContact CB-CB 4.26Å; L275-A329 HydrophobicContact CD2-CB 4.43Å; V277-A329 HydrophobicContact CG2-CB 4.24Å; V277-A329 WeakPolarHBondContact CG2-O 3.29Å; A327-A329 PolarHBondContact O-N 3.33Å; A329-V332 PolarHBondContact O-N 2.63Å; A329-R333 WeakPolarHBondContact O-CB 3.37Å; A329-R333 PolarHBondContact O-N 2.86Å
330	D	93.9	Very high	94	Very high	56 Å²	56	37.2 Å²	37.2	30%	0.299	20%	0.2	S	C	.	.	H	α-helix	trans	-67.5	-40.1	175.2	-72.1	-49	0	0	0	111.9	A327 F328 R333 L334	A327-D330 WeakPolarHBondContact O-CB 3.46Å; A327-D330 PolarHBondContact O-N 2.84Å; F328-D330 VanDerWaalsContact C-N 3.31Å; F328-D330 PolarHBondContact O-N 2.93Å; D330-R333 WeakPolarHBondContact O-CB 3.24Å; D330-R333 PolarHBondContact O-N 2.86Å; D330-R333 IonicContact OD1-CZ 3.48Å; D330-R333 IonicContact OD1-NE 2.66Å; D330-R333 IonicContact OD1-NH2 3.76Å; D330-R333 PolarHBondContact OD1-NH2 2.8Å; D330-L334 WeakPolarHBondContact O-CB 3.47Å; D330-L334 WeakPolarHBondContact O-CG 3.39Å; D330-L334 PolarHBondContact O-N 2.85Å
331	V	95.9	Very high	94	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.2	-47.1	174.1	-177.6	0	0	0	0	110.6	F292 V321 L323 H326 A327 F328 R333 L334 V335 T351	F292-V331 HydrophobicContact CE1-CG1 3.87Å; F292-V331 HydrophobicContact CZ-CG1 3.69Å; V321-V331 HydrophobicContact CG2-CB 4.28Å; V321-V331 HydrophobicContact CG2-CG1 4.21Å; V321-V331 HydrophobicContact CG2-CG2 3.63Å; L323-V331 HydrophobicContact CD2-CB 4.41Å; L323-V331 HydrophobicContact CD2-CG1 4.07Å; L323-V331 HydrophobicContact CD2-CG2 4.11Å; H326-V331 HydrophobicContact CB-CG2 3.94Å; A327-V331 PolarHBondContact O-N 3.47Å; A327-V331 VanDerWaalsContact O-N 3.15Å; F328-V331 PolarHBondContact O-N 2.9Å; V331-R333 VanDerWaalsContact C-N 3.31Å; V331-R333 PolarHBondContact O-N 2.78Å; V331-L334 PolarHBondContact O-N 2.89Å; V331-V335 HydrophobicContact CG1-CG2 4.17Å; V331-V335 WeakPolarHBondContact O-CB 3.39Å; V331-V335 VanDerWaalsContact O-CG2 3.23Å; V331-V335 WeakPolarHBondContact O-CG2 3.28Å; V331-V335 PolarHBondContact O-N 2.81Å; V331-T351 HydrophobicContact CG1-CG2 4.39Å
332	V	96.3	Very high	94.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.8	-42.5	176.1	171.7	0	0	0	0	111.1	L275 V277 F328 A329 V335 S336 F354	L275-V332 HydrophobicContact CD1-CB 4.31Å; L275-V332 HydrophobicContact CD1-CG1 4.42Å; L275-V332 HydrophobicContact CD1-CG2 3.91Å; V277-V332 HydrophobicContact CG2-CB 4.42Å; V277-V332 HydrophobicContact CG2-CG1 4.23Å; F328-V332 HydrophobicContact CD1-CG2 3.93Å; F328-V332 HydrophobicContact CE1-CG2 3.47Å; F328-V332 VanDerWaalsContact CE1-CG2 3.47Å; F328-V332 HydrophobicContact CE2-CG2 4.42Å; F328-V332 HydrophobicContact CZ-CG2 3.74Å; F328-V332 WeakPolarHBondContact O-CG2 3.47Å; F328-V332 PolarHBondContact O-N 2.7Å; A329-V332 PolarHBondContact O-N 2.63Å; V332-V335 PolarHBondContact O-N 3.26Å; V332-S336 WeakPolarHBondContact O-CB 3.5Å; V332-S336 PolarHBondContact O-N 3.15Å; V332-S336 PolarHBondContact O-OG 3.3Å; V332-F354 HydrophobicContact CG1-CD1 3.72Å; V332-F354 HydrophobicContact CG1-CD2 4.44Å; V332-F354 HydrophobicContact CG1-CE1 3.8Å; V332-F354 HydrophobicContact CG1-CG 4.06Å; V332-F354 HydrophobicContact CG1-CZ 4.22Å; V332-F354 HydrophobicContact CG2-CD2 4.07Å; V332-F354 HydrophobicContact CG2-CE1 4.23Å; V332-F354 HydrophobicContact CG2-CE2 3.71Å; V332-F354 HydrophobicContact CG2-CZ 3.78Å
333	R	93.9	Very high	94.3	Very high	110 Å²	110	34.3 Å²	34.3	42%	0.415	18%	0.182	S	C	.	.	H	α-helix	trans	-60.5	-46.3	176.3	-177.4	176.5	59.4	155.3	-4.8	112.2	V277 A329 D330 V331 N337	V277-R333 HydrophobicContact CG1-CB 3.67Å; V277-R333 HydrophobicContact CG1-CG 4.03Å; A329-R333 WeakPolarHBondContact O-CB 3.37Å; A329-R333 PolarHBondContact O-N 2.86Å; D330-R333 WeakPolarHBondContact O-CB 3.24Å; D330-R333 PolarHBondContact O-N 2.86Å; D330-R333 IonicContact OD1-CZ 3.48Å; D330-R333 IonicContact OD1-NE 2.66Å; D330-R333 IonicContact OD1-NH2 3.76Å; D330-R333 PolarHBondContact OD1-NH2 2.8Å; V331-R333 VanDerWaalsContact C-N 3.31Å; V331-R333 PolarHBondContact O-N 2.78Å; R333-N337 PolarHBondContact O-ND2 3.26Å
334	L	94.8	Very high	94.6	Very high	34 Å²	34	31.8 Å²	31.8	18%	0.178	17%	0.169	C	C	.	.	H	α-helix	trans	-67.5	-42.2	178.8	-71.8	171.4	0	0	0	111.5	Y288 L290 V319 V321 D330 V331 A338	Y288-L334 WeakPolarHBondContact CE2-O 3.49Å; Y288-L334 WeakPolarHBondContact OH-CA 3.28Å; Y288-L334 PolarHBondContact OH-O 2.79Å; L290-L334 HydrophobicContact CD1-CB 4.15Å; L290-L334 HydrophobicContact CD1-CD1 4.45Å; L290-L334 HydrophobicContact CD2-CB 3.91Å; V319-L334 HydrophobicContact CG1-CD2 4.44Å; V321-L334 HydrophobicContact CB-CD1 4.16Å; V321-L334 HydrophobicContact CG2-CD1 3.92Å; D330-L334 WeakPolarHBondContact O-CB 3.47Å; D330-L334 WeakPolarHBondContact O-CG 3.39Å; D330-L334 PolarHBondContact O-N 2.85Å; V331-L334 PolarHBondContact O-N 2.89Å; L334-A338 PolarHBondContact O-N 2.83Å
335	V	95.9	Very high	95.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68.8	-40.1	178.9	177.7	0	0	0	0	110.9	L290 F292 V331 V332 N337 A338 T351 F354 L355	L290-V335 HydrophobicContact CD2-CB 4.31Å; L290-V335 HydrophobicContact CD2-CG2 3.55Å; F292-V335 HydrophobicContact CE2-CG2 4.48Å; F292-V335 HydrophobicContact CZ-CG2 4.36Å; V331-V335 HydrophobicContact CG1-CG2 4.17Å; V331-V335 WeakPolarHBondContact O-CB 3.39Å; V331-V335 VanDerWaalsContact O-CG2 3.23Å; V331-V335 WeakPolarHBondContact O-CG2 3.28Å; V331-V335 PolarHBondContact O-N 2.81Å; V332-V335 PolarHBondContact O-N 3.26Å; V335-N337 PolarHBondContact O-N 3.41Å; V335-N337 VanDerWaalsContact O-N 3.09Å; V335-A338 PolarHBondContact O-N 3.32Å; V335-A338 VanDerWaalsContact O-N 3.15Å; V335-T351 VanDerWaalsContact CG1-O 3.3Å; V335-T351 WeakPolarHBondContact CG1-O 3.15Å; V335-F354 HydrophobicContact CB-CB 4.45Å; V335-F354 HydrophobicContact CG1-CB 4Å; V335-L355 HydrophobicContact CG1-CD2 3.87Å; V335-L355 HydrophobicContact CG1-CG 3.8Å; V335-L355 WeakPolarHBondContact O-CD2 3.42Å
336	S	94.2	Very high	95.4	Very high	15 Å²	15	23.7 Å²	23.7	11%	0.105	13%	0.128	C	C	.	.	H	α-helix	trans	-62.4	-20.7	-177	-61.8	0	0	0	0	114.4	V332 F354	V332-S336 WeakPolarHBondContact O-CB 3.5Å; V332-S336 PolarHBondContact O-N 3.15Å; V332-S336 PolarHBondContact O-OG 3.3Å; S336-F354 WeakPolarHBondContact CA-O 3.37Å
337	N	90.7	Very high	95.6	Very high	50 Å²	50	21.1 Å²	21.1	27%	0.267	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	2	179.6	-57.5	-60.5	0	0	0	113.5	Y288 R333 V335	Y288-N337 HydrophobicContact CE1-CB 4.14Å; Y288-N337 WeakPolarHBondContact OH-CB 3.33Å; R333-N337 PolarHBondContact O-ND2 3.26Å; V335-N337 PolarHBondContact O-N 3.41Å; V335-N337 VanDerWaalsContact O-N 3.09Å
338	A	93.8	Very high	95.7	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.099	C	C	.	.			trans	-75.9	139.4	-179.5	0	0	0	0	0	112	Y288 L290 L334 V335 L355 P356	Y288-A338 HydrophobicContact CD2-CB 4.33Å; Y288-A338 HydrophobicContact CE2-CB 3.81Å; L290-A338 HydrophobicContact CB-CB 3.93Å; L290-A338 HydrophobicContact CD2-CB 4.44Å; L334-A338 PolarHBondContact O-N 2.83Å; V335-A338 PolarHBondContact O-N 3.32Å; V335-A338 VanDerWaalsContact O-N 3.15Å; A338-L355 HydrophobicContact CB-CD2 4.06Å; A338-P356 WeakPolarHBondContact O-CD 3.1Å; A338-P356 WeakPolarHBondContact O-CG 3.26Å
339	S	94.7	Very high	95.8	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.007	9%	0.091	C	C	.	.	S	Bend	trans	-83.6	-27.2	171.9	-70.8	0	0	0	0	112.4	Y288 A359 T360 P469	Y288-S339 PolarHBondContact O-N 2.98Å; S339-A359 VanDerWaalsContact O-CA 3.26Å; S339-A359 WeakPolarHBondContact O-CA 3.34Å; S339-A359 WeakPolarHBondContact O-CB 3.23Å; S339-T360 PolarHBondContact O-N 2.78Å; S339-P469 WeakPolarHBondContact CB-O 3.33Å
340	M	96.9	Very high	96	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	138.2	174.6	-177.6	-174	-53.9	0	0	109.8	I289 L290 F314 V342 T360 V362 I461 P469	I289-M340 WeakPolarHBondContact CA-O 3.25Å; I289-M340 HydrophobicContact CB-CB 4.38Å; I289-M340 HydrophobicContact CD1-CE 4.3Å; I289-M340 HydrophobicContact CD1-SD 4.28Å; I289-M340 HydrophobicContact CG1-CB 4.06Å; I289-M340 HydrophobicContact CG2-CB 4.05Å; I289-M340 HydrophobicContact CG2-CG 4.18Å; I289-M340 HydrophobicContact CG2-SD 4.05Å; L290-M340 PolarHBondContact N-O 3.28Å; F314-M340 HydrophobicContact CD1-CE 4.47Å; F314-M340 HydrophobicContact CD2-CE 4.16Å; F314-M340 HydrophobicContact CE1-CE 4.32Å; F314-M340 HydrophobicContact CE2-CE 3.99Å; F314-M340 HydrophobicContact CG-CE 4.42Å; F314-M340 HydrophobicContact CZ-CE 4.1Å; M340-V342 HydrophobicContact CG-CG2 4.02Å; M340-V342 HydrophobicContact SD-CG2 3.78Å; M340-T360 CarbonylContact C-O 3.59Å; M340-T360 VanDerWaalsContact CA-O 3.22Å; M340-T360 WeakPolarHBondContact CA-O 3.39Å; M340-T360 HydrophobicContact CG-CG2 4.35Å; M340-V362 HydrophobicContact CG-CG2 3.84Å; M340-V362 HydrophobicContact SD-CG2 3.63Å; M340-I461 HydrophobicContact CE-CG2 4.07Å; M340-I461 HydrophobicContact SD-CD1 4.48Å; M340-P469 HydrophobicContact CE-CB 4.15Å; M340-P469 HydrophobicContact CE-CG 3.69Å
341	L	98.2	Very high	96.2	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122.2	170.6	-178.3	62.7	0	0	0	109.3	L290 F292 L349 L355 T360 V362	L290-L341 HydrophobicContact CB-CD1 4.01Å; L290-L341 HydrophobicContact CD2-CD1 3.94Å; L290-L341 HydrophobicContact CG-CD1 4.03Å; L290-L341 CarbonylContact O-C 3.27Å; L290-L341 WeakPolarHBondContact O-CA 3.35Å; F292-L341 HydrophobicContact CD2-CD1 3.63Å; F292-L341 HydrophobicContact CD2-CD2 4.48Å; F292-L341 HydrophobicContact CD2-CG 4.33Å; F292-L341 HydrophobicContact CE2-CD1 3.66Å; F292-L341 HydrophobicContact CE2-CD2 4.11Å; F292-L341 HydrophobicContact CE2-CG 4.35Å; L341-L349 HydrophobicContact CD2-CD2 4.12Å; L341-L355 HydrophobicContact CB-CD1 3.9Å; L341-L355 HydrophobicContact CB-CD2 4.22Å; L341-L355 HydrophobicContact CD2-CD1 4.13Å; L341-T360 PolarHBondContact N-O 2.61Å; L341-V362 PolarHBondContact O-N 3.11Å
342	V	98.7	Very high	96.3	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.7	176.1	-170.9	0	0	0	0	109	I289 L290 V291 F292 L310 M340 V362 L364	I289-V342 HydrophobicContact CG2-CG2 3.89Å; L290-V342 PolarHBondContact O-N 3.3Å; V291-V342 WeakPolarHBondContact CA-O 3.17Å; V291-V342 HydrophobicContact CG2-CB 4.19Å; V291-V342 HydrophobicContact CG2-CG2 4.48Å; F292-V342 PolarHBondContact N-O 3.16Å; L310-V342 HydrophobicContact CD1-CG2 3.98Å; M340-V342 HydrophobicContact CG-CG2 4.02Å; M340-V342 HydrophobicContact SD-CG2 3.78Å; V342-V362 WeakPolarHBondContact CA-O 3.27Å; V342-V362 HydrophobicContact CB-CB 4.36Å; V342-V362 HydrophobicContact CG1-CB 4.21Å; V342-V362 HydrophobicContact CG1-CG1 4.22Å; V342-V362 HydrophobicContact CG2-CB 4.04Å; V342-V362 HydrophobicContact CG2-CG2 4.26Å; V342-L364 HydrophobicContact CG1-CD1 3.97Å; V342-L364 HydrophobicContact CG1-CD2 4.37Å; V342-L364 HydrophobicContact CG1-CG 4.2Å
343	S	98.4	Very high	96.3	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	147.7	178.6	-175.9	0	0	0	0	111.8	Q348 V362 L364	S343-Q348 PolarHBondContact OG-NE2 2.93Å; S343-V362 PolarHBondContact N-O 2.77Å; S343-L364 PolarHBondContact O-N 3.33Å
344	M	98.3	Very high	96.5	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.005	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	143.3	159.2	-65.2	-62.2	-63.8	0	0	110.4	R298 I300 G346 L364 P366 T450	R298-M344 HydrophobicContact CB-CB 4.17Å; R298-M344 WeakPolarHBondContact O-CG 3.43Å; I300-M344 HydrophobicContact CD1-CG 4.11Å; I300-M344 HydrophobicContact CG1-CG 3.64Å; I300-M344 HydrophobicContact CG1-SD 4.08Å; M344-G346 PolarHBondContact O-N 3.26Å; M344-L364 CarbonylContact C-O 3.54Å; M344-L364 WeakPolarHBondContact CA-O 3.4Å; M344-L364 HydrophobicContact SD-CB 3.44Å; M344-L364 WeakPolarHBondContact SD-CB 3.25Å; M344-L364 HydrophobicContact SD-CD1 3.99Å; M344-L364 HydrophobicContact SD-CG 4.35Å; M344-P366 HydrophobicContact CE-CB 4.47Å; M344-P366 HydrophobicContact CE-CG 3.7Å; M344-T450 WeakPolarHBondContact CE-OG1 3.43Å
345	H	97.8	Very high	96.5	Very high	19 Å²	19	6.3 Å²	6.3	9%	0.088	4%	0.038	C	C	.	.	S	Bend	trans	-49.7	131.2	175.2	-179.5	92	0	0	0	110.4	R298 E363 L364 F365 I446	R298-H345 WeakPolarHBondContact CD-O 3.25Å; R298-H345 PolarHBondContact NE-O 2.81Å; R298-H345 VanDerWaalsContact NE-O 3.17Å; H345-E363 HydrophobicContact CB-CG 4.46Å; H345-E363 IonicContact CE1-OE1 3.41Å; H345-E363 PolarHBondContact CE1-OE1 3.14Å; H345-E363 IonicContact CG-OE1 3.98Å; H345-E363 IonicContact ND1-OE1 3.73Å; H345-E363 PolarHBondContact ND1-OE1 2.87Å; H345-L364 PolarHBondContact N-O 2.75Å; H345-F365 HydrophobicContact CB-CD1 3.95Å; H345-F365 HydrophobicContact CB-CE1 3.97Å; H345-F365 AromaticContact CG-CE1 3.74Å; H345-F365 AromaticContact ND1-CE1 3.25Å; H345-F365 WeakPolarHBondContact ND1-CE1 3.38Å; H345-F365 AromaticContact ND1-CZ 3.7Å; H345-I446 HydrophobicContact CB-CD1 4.41Å
346	G	96	Very high	96.4	Very high	6 Å²	6	7.5 Å²	7.5	6%	0.062	5%	0.046	C	C	.	.	S	Bend	trans	161.3	176.6	177.6	0	0	0	0	0	112.7	M344 Q348 L349 Y377	M344-G346 PolarHBondContact O-N 3.26Å; G346-Q348 PolarHBondContact O-N 3.4Å; G346-Q348 VanDerWaalsContact O-N 3.12Å; G346-L349 PolarHBondContact O-N 2.83Å; G346-L349 VanDerWaalsContact O-N 3.15Å; G346-Y377 WeakPolarHBondContact O-CE2 3.41Å; G346-Y377 PolarHBondContact O-OH 2.82Å
347	A	95.6	Very high	96.2	Very high	23 Å²	23	9.6 Å²	9.6	19%	0.19	5%	0.052	C	C	.	.	G	3₁₀ helix	trans	-55.4	-33.7	-169.9	0	0	0	0	0	114.9	N163 L164 M165 L349 V350 Y377	N163-A347 WeakPolarHBondContact OD1-CB 3.34Å; L164-A347 HydrophobicContact CB-CB 4.14Å; M165-A347 HydrophobicContact CB-CB 4.15Å; A347-L349 PolarHBondContact O-N 2.67Å; A347-L349 VanDerWaalsContact O-N 3.16Å; A347-V350 WeakPolarHBondContact O-CB 3.43Å; A347-V350 VanDerWaalsContact O-CG1 3.32Å; A347-V350 WeakPolarHBondContact O-CG1 3.33Å; A347-V350 PolarHBondContact O-N 3.42Å; A347-V350 VanDerWaalsContact O-N 3.14Å; A347-Y377 WeakPolarHBondContact CA-OH 3.41Å; A347-Y377 PolarHBondContact O-OH 2.88Å
348	Q	95.4	Very high	96.2	Very high	7 Å²	7	7.4 Å²	7.4	3%	0.033	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-58.7	-26.6	-180	68.8	-144.8	47.9	0	0	114.6	F292 R294 L323 S343 G346 V350 T351	F292-Q348 VanDerWaalsContact CB-NE2 3.31Å; F292-Q348 HydrophobicContact CD1-CB 4.46Å; F292-Q348 HydrophobicContact CD1-CG 4.36Å; F292-Q348 HydrophobicContact CD2-CG 4.22Å; F292-Q348 HydrophobicContact CE1-CB 4.34Å; F292-Q348 HydrophobicContact CG-CG 4.15Å; F292-Q348 HydrophobicContact CZ-CB 4.4Å; R294-Q348 VanDerWaalsContact CZ-OE1 3.29Å; R294-Q348 VanDerWaalsContact NH1-OE1 3.16Å; L323-Q348 HydrophobicContact CD1-CB 3.44Å; L323-Q348 VanDerWaalsContact CD1-CB 3.44Å; L323-Q348 HydrophobicContact CG-CB 4.27Å; S343-Q348 PolarHBondContact OG-NE2 2.93Å; G346-Q348 PolarHBondContact O-N 3.4Å; G346-Q348 VanDerWaalsContact O-N 3.12Å; Q348-V350 PolarHBondContact O-N 3.43Å; Q348-V350 VanDerWaalsContact O-N 3.12Å; Q348-T351 WeakPolarHBondContact O-CB 3.32Å; Q348-T351 VanDerWaalsContact O-CG2 3.32Å; Q348-T351 WeakPolarHBondContact O-CG2 3.37Å; Q348-T351 PolarHBondContact O-N 3.19Å; Q348-T351 VanDerWaalsContact O-N 3.1Å; Q348-T351 PolarHBondContact O-OG1 2.86Å
349	L	97.9	Very high	96.2	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-67.2	-10.8	179.2	-86.2	170.2	0	0	0	113.1	L341 G346 A347 T351 T352 V361 E363 Y377	L341-L349 HydrophobicContact CD2-CD2 4.12Å; G346-L349 PolarHBondContact O-N 2.83Å; G346-L349 VanDerWaalsContact O-N 3.15Å; A347-L349 PolarHBondContact O-N 2.67Å; A347-L349 VanDerWaalsContact O-N 3.16Å; L349-T351 PolarHBondContact O-N 2.91Å; L349-T352 WeakPolarHBondContact O-CB 3.49Å; L349-T352 PolarHBondContact O-N 3.37Å; L349-T352 PolarHBondContact O-OG1 3.49Å; L349-V361 HydrophobicContact CD2-CG1 4.07Å; L349-E363 HydrophobicContact CD1-CB 4.26Å; L349-E363 HydrophobicContact CD1-CG 3.6Å; L349-Y377 HydrophobicContact CB-CD1 3.87Å; L349-Y377 HydrophobicContact CB-CD2 3.5Å; L349-Y377 HydrophobicContact CB-CE1 3.75Å; L349-Y377 HydrophobicContact CB-CE2 3.35Å; L349-Y377 HydrophobicContact CB-CG 3.74Å; L349-Y377 VanDerWaalsContact CB-CZ 3.46Å; L349-Y377 HydrophobicContact CD1-CD2 3.71Å; L349-Y377 HydrophobicContact CD1-CE2 3.88Å; L349-Y377 HydrophobicContact CD1-CG 4.47Å; L349-Y377 HydrophobicContact CG-CD2 4.25Å; L349-Y377 HydrophobicContact CG-CE2 4.27Å
350	V	98.3	Very high	96.3	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-59.5	-25.4	170.4	78.7	0	0	0	0	112	L164 M165 F168 A347 Q348 T352 L353 Y377	L164-V350 HydrophobicContact CB-CG1 4.45Å; L164-V350 HydrophobicContact CD2-CG1 4.01Å; L164-V350 HydrophobicContact CG-CG1 3.85Å; M165-V350 HydrophobicContact CB-CB 4.28Å; M165-V350 HydrophobicContact CG-CB 4.35Å; M165-V350 HydrophobicContact CG-CG2 4.4Å; F168-V350 HydrophobicContact CB-CB 4.46Å; F168-V350 HydrophobicContact CB-CG1 4.09Å; F168-V350 HydrophobicContact CB-CG2 3.54Å; F168-V350 HydrophobicContact CD2-CG1 3.96Å; F168-V350 HydrophobicContact CG-CG1 4.1Å; F168-V350 HydrophobicContact CG-CG2 4.27Å; A347-V350 WeakPolarHBondContact O-CB 3.43Å; A347-V350 VanDerWaalsContact O-CG1 3.32Å; A347-V350 WeakPolarHBondContact O-CG1 3.33Å; A347-V350 PolarHBondContact O-N 3.42Å; A347-V350 VanDerWaalsContact O-N 3.14Å; Q348-V350 PolarHBondContact O-N 3.43Å; Q348-V350 VanDerWaalsContact O-N 3.12Å; V350-T352 PolarHBondContact O-N 2.89Å; V350-L353 HydrophobicContact CG2-CD2 4.26Å; V350-L353 VanDerWaalsContact O-CD2 3.26Å; V350-L353 WeakPolarHBondContact O-CD2 3.48Å; V350-L353 VanDerWaalsContact O-CG 3.28Å; V350-L353 WeakPolarHBondContact O-CG 3.45Å; V350-L353 PolarHBondContact O-N 2.89Å; V350-Y377 HydrophobicContact CB-CE1 4.15Å
351	T	98.1	Very high	96.4	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-59	-15.4	172.9	59.4	0	0	0	0	113.5	L164 F292 F328 V331 V335 Q348 L349 L353 F354	L164-T351 HydrophobicContact CD2-CG2 4.35Å; F292-T351 WeakPolarHBondContact CE2-OG1 3.29Å; F292-T351 HydrophobicContact CZ-CG2 4.37Å; F328-T351 HydrophobicContact CE2-CG2 4.2Å; V331-T351 HydrophobicContact CG1-CG2 4.39Å; V335-T351 VanDerWaalsContact CG1-O 3.3Å; V335-T351 WeakPolarHBondContact CG1-O 3.15Å; Q348-T351 WeakPolarHBondContact O-CB 3.32Å; Q348-T351 VanDerWaalsContact O-CG2 3.32Å; Q348-T351 WeakPolarHBondContact O-CG2 3.37Å; Q348-T351 PolarHBondContact O-N 3.19Å; Q348-T351 VanDerWaalsContact O-N 3.1Å; Q348-T351 PolarHBondContact O-OG1 2.86Å; L349-T351 PolarHBondContact O-N 2.91Å; T351-L353 PolarHBondContact O-N 2.76Å; T351-F354 WeakPolarHBondContact O-CB 3.29Å; T351-F354 WeakPolarHBondContact O-CD2 3.45Å; T351-F354 PolarHBondContact O-N 3.17Å
352	T	97.7	Very high	96.4	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-46.3	-29.4	166.5	-67.7	0	0	0	0	113.2	L349 V350 F354 L355 V361 L380 L388	L349-T352 WeakPolarHBondContact O-CB 3.49Å; L349-T352 PolarHBondContact O-N 3.37Å; L349-T352 PolarHBondContact O-OG1 3.49Å; V350-T352 PolarHBondContact O-N 2.89Å; T352-F354 PolarHBondContact O-N 3.03Å; T352-F354 VanDerWaalsContact O-N 3.15Å; T352-L355 HydrophobicContact CG2-CD1 4.19Å; T352-L355 WeakPolarHBondContact O-CB 3.17Å; T352-L355 PolarHBondContact O-N 3.38Å; T352-V361 HydrophobicContact CG2-CG2 3.5Å; T352-L380 HydrophobicContact CG2-CD2 3.88Å; T352-L380 HydrophobicContact CG2-CG 4.34Å; T352-L388 HydrophobicContact CG2-CD1 3.46Å; T352-L388 VanDerWaalsContact CG2-CD1 3.46Å
353	L	97.6	Very high	96.4	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-58.5	-24.7	175.7	71.4	87.8	0	0	0	113.8	F168 I264 F267 A268 V350 T351 L380	F168-L353 HydrophobicContact CB-CD2 4.41Å; F168-L353 HydrophobicContact CD1-CD2 3.46Å; F168-L353 VanDerWaalsContact CD1-CD2 3.46Å; F168-L353 HydrophobicContact CE1-CD2 4.02Å; F168-L353 HydrophobicContact CG-CD2 4.17Å; I264-L353 HydrophobicContact CG2-CB 3.71Å; F267-L353 HydrophobicContact CD1-CD1 4.22Å; F267-L353 HydrophobicContact CE1-CD1 4.3Å; F267-L353 HydrophobicContact CE1-CD2 4.29Å; A268-L353 HydrophobicContact CB-CD1 3.7Å; A268-L353 WeakPolarHBondContact CB-O 3.39Å; V350-L353 HydrophobicContact CG2-CD2 4.26Å; V350-L353 VanDerWaalsContact O-CD2 3.26Å; V350-L353 WeakPolarHBondContact O-CD2 3.48Å; V350-L353 VanDerWaalsContact O-CG 3.28Å; V350-L353 WeakPolarHBondContact O-CG 3.45Å; V350-L353 PolarHBondContact O-N 2.89Å; T351-L353 PolarHBondContact O-N 2.76Å; L353-L380 HydrophobicContact CB-CD2 4.44Å
354	F	97.3	Very high	96.4	Very high	10 Å²	10	7.4 Å²	7.4	4%	0.044	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-86.3	-13.1	178.8	-62.2	-72.7	0	0	0	113.1	F168 A268 M271 F328 V332 V335 S336 T351 T352	F168-F354 HydrophobicContact CE1-CE2 4.06Å; F168-F354 AromaticContact CE1-CZ 3.9Å; F168-F354 HydrophobicContact CE1-CZ 3.9Å; F168-F354 HydrophobicContact CZ-CE2 4.27Å; F168-F354 HydrophobicContact CZ-CZ 4.26Å; A268-F354 HydrophobicContact CB-CD1 3.9Å; A268-F354 HydrophobicContact CB-CE1 4.23Å; M271-F354 HydrophobicContact CB-CE1 3.83Å; M271-F354 HydrophobicContact CB-CZ 4.09Å; F328-F354 HydrophobicContact CZ-CE2 4.23Å; V332-F354 HydrophobicContact CG1-CD1 3.72Å; V332-F354 HydrophobicContact CG1-CD2 4.44Å; V332-F354 HydrophobicContact CG1-CE1 3.8Å; V332-F354 HydrophobicContact CG1-CG 4.06Å; V332-F354 HydrophobicContact CG1-CZ 4.22Å; V332-F354 HydrophobicContact CG2-CD2 4.07Å; V332-F354 HydrophobicContact CG2-CE1 4.23Å; V332-F354 HydrophobicContact CG2-CE2 3.71Å; V332-F354 HydrophobicContact CG2-CZ 3.78Å; V335-F354 HydrophobicContact CB-CB 4.45Å; V335-F354 HydrophobicContact CG1-CB 4Å; S336-F354 WeakPolarHBondContact CA-O 3.37Å; T351-F354 WeakPolarHBondContact O-CB 3.29Å; T351-F354 WeakPolarHBondContact O-CD2 3.45Å; T351-F354 PolarHBondContact O-N 3.17Å; T352-F354 PolarHBondContact O-N 3.03Å; T352-F354 VanDerWaalsContact O-N 3.15Å
355	L	96	Very high	96.4	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.04	C	C	.	.	P	Polyproline II helix	trans	-63.1	142.4	-175.9	-77.4	168.4	0	0	0	112.5	R265 V335 A338 L341 T352 A359 V361 L388	R265-L355 PolarHBondContact NH1-O 2.89Å; R265-L355 PolarHBondContact NH2-O 3.06Å; V335-L355 HydrophobicContact CG1-CD2 3.87Å; V335-L355 HydrophobicContact CG1-CG 3.8Å; V335-L355 WeakPolarHBondContact O-CD2 3.42Å; A338-L355 HydrophobicContact CB-CD2 4.06Å; L341-L355 HydrophobicContact CB-CD1 3.9Å; L341-L355 HydrophobicContact CB-CD2 4.22Å; L341-L355 HydrophobicContact CD2-CD1 4.13Å; T352-L355 HydrophobicContact CG2-CD1 4.19Å; T352-L355 WeakPolarHBondContact O-CB 3.17Å; T352-L355 PolarHBondContact O-N 3.38Å; L355-A359 HydrophobicContact CB-CB 4.15Å; L355-A359 HydrophobicContact CD2-CB 4.1Å; L355-V361 HydrophobicContact CD1-CG2 3.49Å; L355-V361 VanDerWaalsContact CD1-CG2 3.49Å; L355-L388 HydrophobicContact CB-CD1 4.36Å; L355-L388 HydrophobicContact CB-CD2 3.93Å
356	P	92.9	Very high	96.5	Very high	26 Å²	26	6.4 Å²	6.4	17%	0.169	4%	0.036	C	C	.	.	P	Polyproline II helix	trans	-68.9	155.7	175.6	28.6	-31.4	0	0	0	110.8	A338 G358 A359 L388 P471	A338-P356 WeakPolarHBondContact O-CD 3.1Å; A338-P356 WeakPolarHBondContact O-CG 3.26Å; P356-G358 PolarHBondContact O-N 2.86Å; P356-A359 HydrophobicContact CG-CB 4.11Å; P356-A359 WeakPolarHBondContact O-CB 3.36Å; P356-A359 PolarHBondContact O-N 2.88Å; P356-A359 VanDerWaalsContact O-N 3.16Å; P356-L388 VanDerWaalsContact O-CD2 3.27Å; P356-L388 WeakPolarHBondContact O-CD2 3.43Å; P356-P471 HydrophobicContact CB-CB 4.33Å
357	R	90.3	Very high	96.6	Very high	59 Å²	59	7.3 Å²	7.3	22%	0.223	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	136	176.4	-70.6	-176.1	165.2	120.1	0.7	110.8	R265 A359 D387 P471 R472 Q474	R265-R357 VanDerWaalsContact CZ-CG 3.43Å; R265-R357 VanDerWaalsContact NH2-CG 3.29Å; R357-A359 VanDerWaalsContact C-N 3.28Å; R357-D387 HydrophobicContact CB-CB 4.13Å; R357-D387 VanDerWaalsContact CD-OD2 3.23Å; R357-D387 WeakPolarHBondContact CD-OD2 3.35Å; R357-D387 HydrophobicContact CG-CB 4.06Å; R357-D387 IonicContact CZ-OD2 2.99Å; R357-D387 IonicContact NE-OD2 2.85Å; R357-D387 PolarHBondContact NE-OD2 3.12Å; R357-P471 CarbonylContact O-C 3.55Å; R357-P471 VanDerWaalsContact O-CA 3.22Å; R357-P471 WeakPolarHBondContact O-CA 3.09Å; R357-R472 PolarHBondContact O-N 2.9Å; R357-Q474 VanDerWaalsContact NH1-CG 3.33Å; R357-Q474 VanDerWaalsContact NH1-NE2 3.17Å
358	G	89.6	Confident	96.6	Very high	4 Å²	4	6.2 Å²	6.2	4%	0.041	3%	0.029	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	-9.3	-178.1	0	0	0	0	0	114.3	P356 D387 G470	P356-G358 PolarHBondContact O-N 2.86Å; G358-D387 WeakPolarHBondContact CA-O 3.35Å; G358-D387 PolarHBondContact N-O 2.87Å; G358-G470 CarbonylContact C-O 3.57Å; G358-G470 VanDerWaalsContact C-O 3.27Å
359	A	94.3	Very high	96.8	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.027	C	C	.	.			trans	-65.5	157.7	172.1	0	0	0	0	0	111.8	S339 L355 P356 R357 L388 Q389	S339-A359 VanDerWaalsContact O-CA 3.26Å; S339-A359 WeakPolarHBondContact O-CA 3.34Å; S339-A359 WeakPolarHBondContact O-CB 3.23Å; L355-A359 HydrophobicContact CB-CB 4.15Å; L355-A359 HydrophobicContact CD2-CB 4.1Å; P356-A359 HydrophobicContact CG-CB 4.11Å; P356-A359 WeakPolarHBondContact O-CB 3.36Å; P356-A359 PolarHBondContact O-N 2.88Å; P356-A359 VanDerWaalsContact O-N 3.16Å; R357-A359 VanDerWaalsContact C-N 3.28Å; A359-L388 HydrophobicContact CB-CD2 4.24Å; A359-Q389 PolarHBondContact O-N 2.75Å
360	T	97.1	Very high	96.7	Very high	0 Å²	0	7 Å²	7	0%	0	3%	0.034	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132.7	179.7	-57.9	0	0	0	0	111.2	S339 M340 L341 V362 Q389 V391 V465	S339-T360 PolarHBondContact O-N 2.78Å; M340-T360 CarbonylContact C-O 3.59Å; M340-T360 VanDerWaalsContact CA-O 3.22Å; M340-T360 WeakPolarHBondContact CA-O 3.39Å; M340-T360 HydrophobicContact CG-CG2 4.35Å; L341-T360 PolarHBondContact N-O 2.61Å; T360-V362 HydrophobicContact CG2-CG2 3.86Å; T360-Q389 CarbonylContact C-O 3.57Å; T360-Q389 WeakPolarHBondContact CA-O 3.38Å; T360-Q389 HydrophobicContact CG2-CB 4.23Å; T360-Q389 PolarHBondContact OG1-OE1 3.18Å; T360-V391 HydrophobicContact CG2-CG2 3.92Å; T360-V465 HydrophobicContact CG2-CG2 3.78Å
361	V	98.2	Very high	96.7	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.039	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	122.9	166.6	-174.9	0	0	0	0	107.8	L349 T352 L355 L388 Q389 Y390 V391	L349-V361 HydrophobicContact CD2-CG1 4.07Å; T352-V361 HydrophobicContact CG2-CG2 3.5Å; L355-V361 HydrophobicContact CD1-CG2 3.49Å; L355-V361 VanDerWaalsContact CD1-CG2 3.49Å; V361-L388 HydrophobicContact CG2-CD1 4.15Å; V361-Q389 PolarHBondContact N-O 3.12Å; V361-Y390 HydrophobicContact CB-CD2 4.35Å; V361-Y390 HydrophobicContact CG1-CD2 4.44Å; V361-V391 PolarHBondContact O-N 3.5Å
362	V	98.6	Very high	96.6	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	104.2	174.1	-174.1	0	0	0	0	108.1	M340 L341 V342 S343 T360 L364 V391 L457 I461	M340-V362 HydrophobicContact CG-CG2 3.84Å; M340-V362 HydrophobicContact SD-CG2 3.63Å; L341-V362 PolarHBondContact O-N 3.11Å; V342-V362 WeakPolarHBondContact CA-O 3.27Å; V342-V362 HydrophobicContact CB-CB 4.36Å; V342-V362 HydrophobicContact CG1-CB 4.21Å; V342-V362 HydrophobicContact CG1-CG1 4.22Å; V342-V362 HydrophobicContact CG2-CB 4.04Å; V342-V362 HydrophobicContact CG2-CG2 4.26Å; S343-V362 PolarHBondContact N-O 2.77Å; T360-V362 HydrophobicContact CG2-CG2 3.86Å; V362-L364 HydrophobicContact CG1-CD2 3.96Å; V362-V391 WeakPolarHBondContact CA-O 3.37Å; V362-V391 HydrophobicContact CB-CB 4.47Å; V362-V391 HydrophobicContact CG1-CB 4.36Å; V362-V391 HydrophobicContact CG1-CG1 4.27Å; V362-V391 HydrophobicContact CG2-CB 4.18Å; V362-V391 HydrophobicContact CG2-CG2 4.45Å; V362-L457 HydrophobicContact CG1-CD1 3.85Å; V362-I461 HydrophobicContact CG1-CD1 4.12Å; V362-I461 HydrophobicContact CG1-CG1 4.07Å; V362-I461 HydrophobicContact CG2-CD1 4.14Å; V362-I461 HydrophobicContact CG2-CG1 4.06Å
363	E	98.8	Very high	96.5	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.5	-179	-174.1	169.5	179.4	0	0	110.4	H345 L349 F365 Y377 Y390 V391 A392 W393	H345-E363 HydrophobicContact CB-CG 4.46Å; H345-E363 IonicContact CE1-OE1 3.41Å; H345-E363 PolarHBondContact CE1-OE1 3.14Å; H345-E363 IonicContact CG-OE1 3.98Å; H345-E363 IonicContact ND1-OE1 3.73Å; H345-E363 PolarHBondContact ND1-OE1 2.87Å; L349-E363 HydrophobicContact CD1-CB 4.26Å; L349-E363 HydrophobicContact CD1-CG 3.6Å; E363-F365 HydrophobicContact CB-CE2 4.05Å; E363-F365 VanDerWaalsContact CD-CZ 3.41Å; E363-F365 HydrophobicContact CG-CD2 4.16Å; E363-F365 HydrophobicContact CG-CE2 3.44Å; E363-F365 VanDerWaalsContact CG-CE2 3.44Å; E363-F365 HydrophobicContact CG-CZ 3.74Å; E363-F365 WeakPolarHBondContact OE1-CZ 3.21Å; E363-Y377 WeakPolarHBondContact OE1-CD2 3.35Å; E363-Y390 HydrophobicContact CB-CE2 4.06Å; E363-Y390 WeakPolarHBondContact OE2-CE2 3.43Å; E363-Y390 PolarHBondContact OE2-OH 2.9Å; E363-V391 PolarHBondContact N-O 3.42Å; E363-A392 WeakPolarHBondContact O-CA 3.42Å; E363-W393 PolarHBondContact O-N 3.08Å
364	L	98.8	Very high	96.4	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130.3	-178.2	-48.9	-179.5	0	0	0	110.2	I300 V342 S343 M344 H345 V362 W393 V452 L457	I300-L364 HydrophobicContact CD1-CD1 3.96Å; V342-L364 HydrophobicContact CG1-CD1 3.97Å; V342-L364 HydrophobicContact CG1-CD2 4.37Å; V342-L364 HydrophobicContact CG1-CG 4.2Å; S343-L364 PolarHBondContact O-N 3.33Å; M344-L364 CarbonylContact C-O 3.54Å; M344-L364 WeakPolarHBondContact CA-O 3.4Å; M344-L364 HydrophobicContact SD-CB 3.44Å; M344-L364 WeakPolarHBondContact SD-CB 3.25Å; M344-L364 HydrophobicContact SD-CD1 3.99Å; M344-L364 HydrophobicContact SD-CG 4.35Å; H345-L364 PolarHBondContact N-O 2.75Å; V362-L364 HydrophobicContact CG1-CD2 3.96Å; L364-W393 CarbonylContact C-O 3.09Å; L364-W393 WeakPolarHBondContact CA-O 3.41Å; L364-W393 HydrophobicContact CB-CE3 4.16Å; L364-W393 HydrophobicContact CD2-CB 3.91Å; L364-W393 HydrophobicContact CD2-CD2 4.33Å; L364-W393 HydrophobicContact CD2-CE3 3.9Å; L364-W393 HydrophobicContact CD2-CG 4.39Å; L364-V452 HydrophobicContact CD1-CG2 4.11Å; L364-L457 HydrophobicContact CD2-CD1 3.55Å; L364-L457 HydrophobicContact CD2-CD2 4.02Å; L364-L457 HydrophobicContact CD2-CG 4.45Å
365	F	98.7	Very high	96.4	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.1	-179.3	-69.6	-93	0	0	0	110.8	H345 E363 V369 P371 A392 W393 R394 N395	H345-F365 HydrophobicContact CB-CD1 3.95Å; H345-F365 HydrophobicContact CB-CE1 3.97Å; H345-F365 AromaticContact CG-CE1 3.74Å; H345-F365 AromaticContact ND1-CE1 3.25Å; H345-F365 WeakPolarHBondContact ND1-CE1 3.38Å; H345-F365 AromaticContact ND1-CZ 3.7Å; E363-F365 HydrophobicContact CB-CE2 4.05Å; E363-F365 VanDerWaalsContact CD-CZ 3.41Å; E363-F365 HydrophobicContact CG-CD2 4.16Å; E363-F365 HydrophobicContact CG-CE2 3.44Å; E363-F365 VanDerWaalsContact CG-CE2 3.44Å; E363-F365 HydrophobicContact CG-CZ 3.74Å; E363-F365 WeakPolarHBondContact OE1-CZ 3.21Å; F365-V369 HydrophobicContact CB-CB 4.38Å; F365-V369 HydrophobicContact CB-CG1 4.43Å; F365-V369 HydrophobicContact CD1-CB 4.43Å; F365-V369 HydrophobicContact CD1-CG1 3.6Å; F365-V369 HydrophobicContact CE1-CG1 4.36Å; F365-V369 HydrophobicContact CG-CG1 4.46Å; F365-P371 HydrophobicContact CB-CG 4.32Å; F365-P371 HydrophobicContact CD2-CB 3.79Å; F365-P371 HydrophobicContact CD2-CG 3.56Å; F365-P371 HydrophobicContact CE1-CB 4.44Å; F365-P371 HydrophobicContact CE2-CB 3.56Å; F365-P371 HydrophobicContact CE2-CG 3.91Å; F365-P371 HydrophobicContact CG-CB 4.31Å; F365-P371 HydrophobicContact CG-CG 3.89Å; F365-P371 HydrophobicContact CZ-CB 3.9Å; F365-A392 HydrophobicContact CD2-CB 4.42Å; F365-A392 HydrophobicContact CE2-CB 3.99Å; F365-W393 PolarHBondContact N-O 3.38Å; F365-R394 HydrophobicContact CB-CB 4.27Å; F365-R394 HydrophobicContact CB-CG 4.44Å; F365-N395 PolarHBondContact O-N 2.78Å
366	P	98.3	Very high	96.5	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.076	C	C	.	.			trans	-60.4	172.1	172.2	-21.1	31.9	0	0	0	113	M344 V369 R445 I446 Q448	M344-P366 HydrophobicContact CE-CB 4.47Å; M344-P366 HydrophobicContact CE-CG 3.7Å; P366-V369 HydrophobicContact CB-CG2 4.39Å; P366-V369 PolarHBondContact O-N 2.91Å; P366-R445 WeakPolarHBondContact CB-O 3.41Å; P366-I446 HydrophobicContact CG-CD1 4.31Å; P366-Q448 HydrophobicContact CB-CB 4.22Å
367	Y	98.3	Very high	96.8	Very high	24 Å²	24	13.7 Å²	13.7	9%	0.094	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	146.2	177.4	-179.9	-94.9	0	0	0	112	V369 N395 M396 P398 T401	Y367-V369 PolarHBondContact O-N 3.49Å; Y367-N395 WeakPolarHBondContact CA-O 3.5Å; Y367-M396 WeakPolarHBondContact CE2-O 3.46Å; Y367-P398 HydrophobicContact CD2-CG 4.44Å; Y367-P398 HydrophobicContact CE1-CG 4.46Å; Y367-P398 HydrophobicContact CE2-CG 3.7Å; Y367-T401 WeakPolarHBondContact CB-OG1 3.39Å
368	A	97.3	Very high	97.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	-2.8	-176.5	0	0	0	0	0	116.6	R429 E430 V431 R445	A368-R429 VanDerWaalsContact CA-O 3.3Å; A368-R429 WeakPolarHBondContact CA-O 3.23Å; A368-R429 VanDerWaalsContact CB-C 3.5Å; A368-R429 WeakPolarHBondContact CB-O 3.33Å; A368-E430 CarbonylContact O-C 3.52Å; A368-E430 WeakPolarHBondContact O-CA 3.47Å; A368-V431 PolarHBondContact O-N 3.34Å; A368-R445 HydrophobicContact CB-CG 3.97Å
369	V	98	Very high	97.5	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.073	C	C	.	.			trans	-89.7	112.9	176.1	-179.9	0	0	0	0	110.3	F365 P366 Y367 P371 Y374 R394 W442 R445 I446	F365-V369 HydrophobicContact CB-CB 4.38Å; F365-V369 HydrophobicContact CB-CG1 4.43Å; F365-V369 HydrophobicContact CD1-CB 4.43Å; F365-V369 HydrophobicContact CD1-CG1 3.6Å; F365-V369 HydrophobicContact CE1-CG1 4.36Å; F365-V369 HydrophobicContact CG-CG1 4.46Å; P366-V369 HydrophobicContact CB-CG2 4.39Å; P366-V369 PolarHBondContact O-N 2.91Å; Y367-V369 PolarHBondContact O-N 3.49Å; V369-P371 WeakPolarHBondContact O-CD 3.48Å; V369-Y374 HydrophobicContact CG1-CD2 3.61Å; V369-Y374 HydrophobicContact CG1-CE2 3.71Å; V369-R394 WeakPolarHBondContact O-CD 3.42Å; V369-R394 WeakPolarHBondContact O-CG 3.43Å; V369-R394 PolarHBondContact O-NE 3.02Å; V369-W442 HydrophobicContact CG1-CH2 4.37Å; V369-W442 HydrophobicContact CG1-CZ3 3.72Å; V369-W442 HydrophobicContact CG2-CZ3 4.09Å; V369-R445 HydrophobicContact CG2-CB 4Å; V369-I446 HydrophobicContact CG1-CD1 4.19Å; V369-I446 HydrophobicContact CG2-CD1 4.05Å
370	N	97.6	Very high	97.7	Very high	25 Å²	25	14.3 Å²	14.3	13%	0.134	7%	0.073	C	C	.	.			trans	-80.4	117	179.6	-171.5	-25.6	0	0	0	111.9	D372 H373 Y374 E430	N370-D372 PolarHBondContact O-N 3.38Å; N370-D372 VanDerWaalsContact O-N 3.14Å; N370-D372 PolarHBondContact OD1-N 2.84Å; N370-H373 PolarHBondContact O-N 3.43Å; N370-Y374 VanDerWaalsContact O-CD2 3.23Å; N370-Y374 WeakPolarHBondContact O-CD2 3.28Å; N370-E430 HydrophobicContact CB-CG 4.22Å; N370-E430 PolarHBondContact ND2-OE1 3.01Å
371	P	97.4	Very high	97.7	Very high	18 Å²	18	14.5 Å²	14.5	12%	0.117	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24	-179.7	-24.5	33.4	0	0	0	115.1	F365 V369 H373 T375 A392 R394	F365-P371 HydrophobicContact CB-CG 4.32Å; F365-P371 HydrophobicContact CD2-CB 3.79Å; F365-P371 HydrophobicContact CD2-CG 3.56Å; F365-P371 HydrophobicContact CE1-CB 4.44Å; F365-P371 HydrophobicContact CE2-CB 3.56Å; F365-P371 HydrophobicContact CE2-CG 3.91Å; F365-P371 HydrophobicContact CG-CB 4.31Å; F365-P371 HydrophobicContact CG-CG 3.89Å; F365-P371 HydrophobicContact CZ-CB 3.9Å; V369-P371 WeakPolarHBondContact O-CD 3.48Å; P371-H373 VanDerWaalsContact C-N 3.25Å; P371-H373 PolarHBondContact O-N 3.48Å; P371-T375 VanDerWaalsContact O-CG2 3.24Å; P371-T375 WeakPolarHBondContact O-CG2 3.36Å; P371-A392 HydrophobicContact CB-CB 3.72Å; P371-A392 HydrophobicContact CG-CB 4.15Å; P371-R394 HydrophobicContact CG-CB 4.07Å
372	D	96.4	Very high	97.5	Very high	100 Å²	100	20.9 Å²	20.9	54%	0.535	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-10.3	179.3	-70.7	-38.9	0	0	0	112.9	N370 K378	N370-D372 PolarHBondContact O-N 3.38Å; N370-D372 VanDerWaalsContact O-N 3.14Å; N370-D372 PolarHBondContact OD1-N 2.84Å; D372-K378 IonicContact OD1-NZ 3.66Å; D372-K378 PolarHBondContact OD1-NZ 3.01Å
373	H	95.3	Very high	97.4	Very high	32 Å²	32	21.3 Å²	21.3	15%	0.148	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-22	176	-65	170.8	0	0	0	113.3	N370 P371 E430 R433	N370-H373 PolarHBondContact O-N 3.43Å; P371-H373 VanDerWaalsContact C-N 3.25Å; P371-H373 PolarHBondContact O-N 3.48Å; H373-E430 IonicContact CE1-OE1 3.22Å; H373-R433 PolarHBondContact CD2-NE 2.71Å; H373-R433 PolarHBondContact NE2-NE 2.69Å
374	Y	96.1	Very high	96.9	Very high	2 Å²	2	26 Å²	26	1%	0.008	14%	0.138	C	C	.	.			trans	-127.7	86.1	-174.6	-47.4	-84	0	0	0	109.3	Q251 V369 N370 P376 V431 H434 W442	Q251-Y374 HydrophobicContact CG-CD1 4.17Å; Q251-Y374 HydrophobicContact CG-CE1 4.34Å; Q251-Y374 VanDerWaalsContact NE2-CD1 3.34Å; Q251-Y374 VanDerWaalsContact NE2-CE1 3.28Å; V369-Y374 HydrophobicContact CG1-CD2 3.61Å; V369-Y374 HydrophobicContact CG1-CE2 3.71Å; N370-Y374 VanDerWaalsContact O-CD2 3.23Å; N370-Y374 WeakPolarHBondContact O-CD2 3.28Å; Y374-P376 WeakPolarHBondContact O-CD 3.23Å; Y374-V431 WeakPolarHBondContact OH-CG1 3.34Å; Y374-H434 AromaticContact CE1-CE1 3.8Å; Y374-H434 AromaticContact CZ-CE1 3.84Å; Y374-H434 PolarHBondContact OH-CE1 3.44Å; Y374-W442 HydrophobicContact CD1-CE3 4.45Å; Y374-W442 AromaticContact CD1-CH2 3.45Å; Y374-W442 HydrophobicContact CD1-CH2 3.45Å; Y374-W442 VanDerWaalsContact CD1-CH2 3.45Å; Y374-W442 AromaticContact CD1-CZ2 3.98Å; Y374-W442 HydrophobicContact CD1-CZ2 3.98Å; Y374-W442 AromaticContact CD1-CZ3 3.74Å; Y374-W442 HydrophobicContact CD1-CZ3 3.74Å; Y374-W442 HydrophobicContact CD2-CH2 4.11Å; Y374-W442 AromaticContact CD2-CZ3 3.85Å; Y374-W442 HydrophobicContact CD2-CZ3 3.85Å; Y374-W442 HydrophobicContact CE1-CD2 4.07Å; Y374-W442 AromaticContact CE1-CE3 3.65Å; Y374-W442 HydrophobicContact CE1-CE3 3.65Å; Y374-W442 AromaticContact CE1-CH2 3.51Å; Y374-W442 HydrophobicContact CE1-CH2 3.51Å; Y374-W442 AromaticContact CE1-CZ2 3.96Å; Y374-W442 HydrophobicContact CE1-CZ2 3.96Å; Y374-W442 AromaticContact CE1-CZ3 3.36Å; Y374-W442 HydrophobicContact CE1-CZ3 3.36Å; Y374-W442 HydrophobicContact CE2-CE3 4.08Å; Y374-W442 HydrophobicContact CE2-CH2 4.16Å; Y374-W442 AromaticContact CE2-CZ3 3.49Å; Y374-W442 HydrophobicContact CE2-CZ3 3.49Å; Y374-W442 VanDerWaalsContact CE2-CZ3 3.49Å; Y374-W442 AromaticContact CG-CH2 3.8Å; Y374-W442 HydrophobicContact CG-CH2 3.8Å; Y374-W442 HydrophobicContact CG-CZ3 4Å; Y374-W442 AromaticContact CZ-CE3 3.46Å; Y374-W442 VanDerWaalsContact CZ-CE3 3.46Å; Y374-W442 AromaticContact CZ-CH2 3.89Å; Y374-W442 AromaticContact CZ-CZ3 3.24Å
375	T	97.1	Very high	96.4	Very high	11 Å²	11	26.9 Å²	26.9	7%	0.067	15%	0.148	C	C	.	.			trans	-114.7	24.2	-164.4	52.4	0	0	0	0	116.7	Y243 P253 P371 Y377 K378 T379	Y243-T375 PolarHBondContact OH-N 2.93Å; Y243-T375 VanDerWaalsContact OH-N 3.15Å; P253-T375 WeakPolarHBondContact CD-OG1 3.28Å; P371-T375 VanDerWaalsContact O-CG2 3.24Å; P371-T375 WeakPolarHBondContact O-CG2 3.36Å; T375-Y377 VanDerWaalsContact C-N 3.29Å; T375-Y377 PolarHBondContact O-N 3.38Å; T375-K378 HydrophobicContact CG2-CB 4.38Å; T375-K378 HydrophobicContact CG2-CD 3.92Å; T375-K378 PolarHBondContact O-N 2.78Å; T375-T379 WeakPolarHBondContact O-CB 2.9Å; T375-T379 PolarHBondContact O-N 2.87Å; T375-T379 PolarHBondContact O-OG1 3.47Å
376	P	97.7	Very high	96.1	Very high	8 Å²	8	26.9 Å²	26.9	5%	0.052	15%	0.148	C	C	.	.	H	α-helix	trans	-60.2	-38.5	-174.1	26	-33.2	0	0	0	112.8	M165 W242 Y243 Y374 L380	M165-P376 HydrophobicContact CE-CB 3.87Å; W242-P376 PolarHBondContact NE1-O 3.41Å; Y243-P376 HydrophobicContact CD1-CB 3.96Å; Y243-P376 VanDerWaalsContact CD2-CA 3.45Å; Y243-P376 HydrophobicContact CD2-CB 3.86Å; Y243-P376 HydrophobicContact CE1-CB 4.19Å; Y243-P376 HydrophobicContact CE1-CG 4.42Å; Y243-P376 HydrophobicContact CE2-CB 4.09Å; Y243-P376 VanDerWaalsContact CE2-N 3.29Å; Y243-P376 HydrophobicContact CG-CB 3.78Å; Y374-P376 WeakPolarHBondContact O-CD 3.23Å; P376-L380 WeakPolarHBondContact O-CB 3.45Å; P376-L380 PolarHBondContact O-N 2.79Å
377	Y	98.4	Very high	95.8	Very high	5 Å²	5	30.3 Å²	30.3	2%	0.02	17%	0.166	C	C	.	.	H	α-helix	trans	-85.6	-31	-178.2	-48.3	-58.4	0	0	0	112.9	M165 G346 A347 L349 V350 E363 T375 T379 L380 A381	M165-Y377 HydrophobicContact CG-CE1 4.14Å; G346-Y377 WeakPolarHBondContact O-CE2 3.41Å; G346-Y377 PolarHBondContact O-OH 2.82Å; A347-Y377 WeakPolarHBondContact CA-OH 3.41Å; A347-Y377 PolarHBondContact O-OH 2.88Å; L349-Y377 HydrophobicContact CB-CD1 3.87Å; L349-Y377 HydrophobicContact CB-CD2 3.5Å; L349-Y377 HydrophobicContact CB-CE1 3.75Å; L349-Y377 HydrophobicContact CB-CE2 3.35Å; L349-Y377 HydrophobicContact CB-CG 3.74Å; L349-Y377 VanDerWaalsContact CB-CZ 3.46Å; L349-Y377 HydrophobicContact CD1-CD2 3.71Å; L349-Y377 HydrophobicContact CD1-CE2 3.88Å; L349-Y377 HydrophobicContact CD1-CG 4.47Å; L349-Y377 HydrophobicContact CG-CD2 4.25Å; L349-Y377 HydrophobicContact CG-CE2 4.27Å; V350-Y377 HydrophobicContact CB-CE1 4.15Å; E363-Y377 WeakPolarHBondContact OE1-CD2 3.35Å; T375-Y377 VanDerWaalsContact C-N 3.29Å; T375-Y377 PolarHBondContact O-N 3.38Å; Y377-T379 VanDerWaalsContact C-N 3.35Å; Y377-L380 PolarHBondContact O-N 3Å; Y377-A381 VanDerWaalsContact O-CB 3.3Å; Y377-A381 WeakPolarHBondContact O-CB 3.08Å; Y377-A381 PolarHBondContact O-N 3.04Å
378	K	98.2	Very high	95.6	Very high	61 Å²	61	30.1 Å²	30.1	27%	0.265	17%	0.167	S	C	.	.	H	α-helix	trans	-57.7	-48.8	166.2	-173.7	175.5	-179.1	178.5	0	110.5	D372 T375 A381 M382 Y390	D372-K378 IonicContact OD1-NZ 3.66Å; D372-K378 PolarHBondContact OD1-NZ 3.01Å; T375-K378 HydrophobicContact CG2-CB 4.38Å; T375-K378 HydrophobicContact CG2-CD 3.92Å; T375-K378 PolarHBondContact O-N 2.78Å; K378-A381 PolarHBondContact O-N 2.02Å; K378-M382 HydrophobicContact CG-SD 3.84Å; K378-M382 WeakPolarHBondContact O-CB 3.27Å; K378-M382 WeakPolarHBondContact O-CG 3.17Å; K378-M382 PolarHBondContact O-N 2.94Å; K378-Y390 HydrophobicContact CB-CD1 4.04Å; K378-Y390 HydrophobicContact CB-CD2 4.25Å; K378-Y390 HydrophobicContact CB-CE1 3.66Å; K378-Y390 HydrophobicContact CB-CE2 3.88Å; K378-Y390 HydrophobicContact CB-CG 4.31Å; K378-Y390 HydrophobicContact CD-CD1 4.28Å; K378-Y390 HydrophobicContact CD-CE1 3.87Å; K378-Y390 HydrophobicContact CG-CD1 3.76Å; K378-Y390 HydrophobicContact CG-CE1 3.67Å; K378-Y390 HydrophobicContact CG-CG 4.29Å
379	T	98	Very high	95.5	Very high	15 Å²	15	32 Å²	32	9%	0.092	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-47.5	177.1	-57.1	0	0	0	0	111.3	W242 P253 I257 T375 Y377 A381 M382 L383	W242-T379 HydrophobicContact CB-CG2 4.07Å; W242-T379 HydrophobicContact CG-CG2 4.13Å; P253-T379 HydrophobicContact CB-CG2 4.16Å; P253-T379 WeakPolarHBondContact CG-OG1 3.34Å; I257-T379 HydrophobicContact CD1-CG2 3.54Å; T375-T379 WeakPolarHBondContact O-CB 2.9Å; T375-T379 PolarHBondContact O-N 2.87Å; T375-T379 PolarHBondContact O-OG1 3.47Å; Y377-T379 VanDerWaalsContact C-N 3.35Å; T379-A381 PolarHBondContact O-N 2.76Å; T379-M382 PolarHBondContact O-N 2.97Å; T379-L383 WeakPolarHBondContact O-CG 3.23Å; T379-L383 PolarHBondContact O-N 2.86Å; T379-L383 VanDerWaalsContact O-N 3.1Å
380	L	98.1	Very high	95.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-55.1	-52.8	175.3	174.9	59.3	0	0	0	111.5	W242 I264 T352 L353 P376 Y377 M382 L383 M386	W242-L380 HydrophobicContact CH2-CD1 4.13Å; W242-L380 HydrophobicContact CZ2-CB 4.05Å; W242-L380 HydrophobicContact CZ2-CD1 4.02Å; W242-L380 HydrophobicContact CZ2-CD2 4.1Å; W242-L380 HydrophobicContact CZ2-CG 4.27Å; I264-L380 HydrophobicContact CG1-CD1 4.28Å; I264-L380 HydrophobicContact CG2-CD1 4.14Å; T352-L380 HydrophobicContact CG2-CD2 3.88Å; T352-L380 HydrophobicContact CG2-CG 4.34Å; L353-L380 HydrophobicContact CB-CD2 4.44Å; P376-L380 WeakPolarHBondContact O-CB 3.45Å; P376-L380 PolarHBondContact O-N 2.79Å; Y377-L380 PolarHBondContact O-N 3Å; L380-M382 PolarHBondContact O-N 3.38Å; L380-L383 HydrophobicContact CD1-CD1 4.01Å; L380-L383 WeakPolarHBondContact O-CB 3.27Å; L380-L383 WeakPolarHBondContact O-CG 3.42Å; L380-L383 PolarHBondContact O-N 2.91Å; L380-L383 VanDerWaalsContact O-N 3.16Å; L380-M386 HydrophobicContact CD1-CE 4.13Å; L380-M386 HydrophobicContact CG-CE 4.36Å; L380-M386 VanDerWaalsContact O-CG 3.27Å; L380-M386 WeakPolarHBondContact O-CG 3.47Å
381	A	97	Very high	95.5	Very high	4 Å²	4	32.4 Å²	32.4	3%	0.033	18%	0.176	C	C	.	.	H	α-helix	trans	-60.8	-31.6	-178.8	0	0	0	0	0	113	Y377 K378 T379 L388 Y390	Y377-A381 VanDerWaalsContact O-CB 3.3Å; Y377-A381 WeakPolarHBondContact O-CB 3.08Å; Y377-A381 PolarHBondContact O-N 3.04Å; K378-A381 PolarHBondContact O-N 2.02Å; T379-A381 PolarHBondContact O-N 2.76Å; A381-L388 HydrophobicContact CB-CB 3.95Å; A381-L388 HydrophobicContact CB-CD1 4.37Å; A381-Y390 HydrophobicContact CB-CD2 4.25Å; A381-Y390 HydrophobicContact CB-CG 4.48Å
382	M	94.3	Very high	95.5	Very high	134 Å²	134	33.2 Å²	33.2	66%	0.66	18%	0.183	S	C	*	.	H	α-helix	trans	-88.2	-4.3	-179.5	-68.4	179.6	67.6	0	0	114.3	K378 T379 L380	K378-M382 HydrophobicContact CG-SD 3.84Å; K378-M382 WeakPolarHBondContact O-CB 3.27Å; K378-M382 WeakPolarHBondContact O-CG 3.17Å; K378-M382 PolarHBondContact O-N 2.94Å; T379-M382 PolarHBondContact O-N 2.97Å; L380-M382 PolarHBondContact O-N 3.38Å
383	L	94.9	Very high	95.6	Very high	9 Å²	9	28.8 Å²	28.8	5%	0.047	16%	0.159	C	C	.	.	S	Bend	trans	-57.3	137.4	175.5	-67.8	179.3	0	0	0	110.4	W242 I257 V259 I264 T379 L380 G385 M386	W242-L383 HydrophobicContact CB-CD2 4.42Å; I257-L383 HydrophobicContact CG2-CD2 3.64Å; V259-L383 HydrophobicContact CG1-CD1 3.93Å; V259-L383 HydrophobicContact CG1-CD2 4.23Å; I264-L383 HydrophobicContact CG1-CD1 3.99Å; T379-L383 WeakPolarHBondContact O-CG 3.23Å; T379-L383 PolarHBondContact O-N 2.86Å; T379-L383 VanDerWaalsContact O-N 3.1Å; L380-L383 HydrophobicContact CD1-CD1 4.01Å; L380-L383 WeakPolarHBondContact O-CB 3.27Å; L380-L383 WeakPolarHBondContact O-CG 3.42Å; L380-L383 PolarHBondContact O-N 2.91Å; L380-L383 VanDerWaalsContact O-N 3.16Å; L383-G385 PolarHBondContact O-N 2.94Å; L383-G385 VanDerWaalsContact O-N 3.12Å; L383-M386 HydrophobicContact CB-CB 4.41Å; L383-M386 HydrophobicContact CB-CG 3.82Å; L383-M386 WeakPolarHBondContact O-CB 3.44Å; L383-M386 PolarHBondContact O-N 3.04Å
384	P	89.6	Confident	95.8	Very high	97 Å²	97	29 Å²	29	63%	0.63	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	121.3	177.9	-26.9	34.7	0	0	0	111.8	S260 G261	S260-P384 WeakPolarHBondContact CB-O 3.24Å; G261-P384 PolarHBondContact N-O 3.26Å
385	G	87.6	Confident	95.9	Very high	20 Å²	20	28.9 Å²	28.9	21%	0.206	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	-0	-179.4	0	0	0	0	0	116.1	R265 L383	R265-G385 PolarHBondContact NE-O 2.84Å; L383-G385 PolarHBondContact O-N 2.94Å; L383-G385 VanDerWaalsContact O-N 3.12Å
386	M	92.6	Very high	95.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-36.2	165.1	-80.9	-59.4	-69.6	0	0	111.2	I264 R265 L380 L383 L388	I264-M386 HydrophobicContact CB-SD 3.89Å; I264-M386 HydrophobicContact CG2-CE 4.2Å; I264-M386 HydrophobicContact CG2-SD 3.73Å; R265-M386 HydrophobicContact CG-SD 4.32Å; R265-M386 PolarHBondContact NH2-O 3.33Å; L380-M386 HydrophobicContact CD1-CE 4.13Å; L380-M386 HydrophobicContact CG-CE 4.36Å; L380-M386 VanDerWaalsContact O-CG 3.27Å; L380-M386 WeakPolarHBondContact O-CG 3.47Å; L383-M386 HydrophobicContact CB-CB 4.41Å; L383-M386 HydrophobicContact CB-CG 3.82Å; L383-M386 WeakPolarHBondContact O-CB 3.44Å; L383-M386 PolarHBondContact O-N 3.04Å; M386-L388 HydrophobicContact CE-CD1 3.69Å; M386-L388 HydrophobicContact CE-CG 4.26Å; M386-L388 PolarHBondContact O-N 3.26Å
387	D	91.3	Very high	95.8	Very high	71 Å²	71	36.4 Å²	36.4	38%	0.38	19%	0.194	S	C	.	.			trans	54	35.9	173.5	-49	-42.3	0	0	0	113.7	R357 G358	R357-D387 HydrophobicContact CB-CB 4.13Å; R357-D387 VanDerWaalsContact CD-OD2 3.23Å; R357-D387 WeakPolarHBondContact CD-OD2 3.35Å; R357-D387 HydrophobicContact CG-CB 4.06Å; R357-D387 IonicContact CZ-OD2 2.99Å; R357-D387 IonicContact NE-OD2 2.85Å; R357-D387 PolarHBondContact NE-OD2 3.12Å; G358-D387 WeakPolarHBondContact CA-O 3.35Å; G358-D387 PolarHBondContact N-O 2.87Å
388	L	93.8	Very high	95.7	Very high	20 Å²	20	39.5 Å²	39.5	11%	0.105	22%	0.215	C	C	.	.			trans	-96.6	150.1	176.4	-61.7	-176.9	0	0	0	110.7	T352 L355 P356 A359 V361 A381 M386	T352-L388 HydrophobicContact CG2-CD1 3.46Å; T352-L388 VanDerWaalsContact CG2-CD1 3.46Å; L355-L388 HydrophobicContact CB-CD1 4.36Å; L355-L388 HydrophobicContact CB-CD2 3.93Å; P356-L388 VanDerWaalsContact O-CD2 3.27Å; P356-L388 WeakPolarHBondContact O-CD2 3.43Å; A359-L388 HydrophobicContact CB-CD2 4.24Å; V361-L388 HydrophobicContact CG2-CD1 4.15Å; A381-L388 HydrophobicContact CB-CB 3.95Å; A381-L388 HydrophobicContact CB-CD1 4.37Å; M386-L388 HydrophobicContact CE-CD1 3.69Å; M386-L388 HydrophobicContact CE-CG 4.26Å; M386-L388 PolarHBondContact O-N 3.26Å
389	Q	95.5	Very high	95.7	Very high	39 Å²	39	43.4 Å²	43.4	18%	0.182	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	136	165.2	-54.3	-166.4	-83.1	0	0	108.5	A359 T360 V361 V464	A359-Q389 PolarHBondContact O-N 2.75Å; T360-Q389 CarbonylContact C-O 3.57Å; T360-Q389 WeakPolarHBondContact CA-O 3.38Å; T360-Q389 HydrophobicContact CG2-CB 4.23Å; T360-Q389 PolarHBondContact OG1-OE1 3.18Å; V361-Q389 PolarHBondContact N-O 3.12Å; Q389-V464 HydrophobicContact CB-CG1 4.44Å; Q389-V464 PolarHBondContact NE2-O 2.97Å
390	Y	97.6	Very high	95.7	Very high	33 Å²	33	44 Å²	44	13%	0.129	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.4	-179.9	177.9	-90.3	0	0	0	110.5	V361 E363 K378 A381 A392	V361-Y390 HydrophobicContact CB-CD2 4.35Å; V361-Y390 HydrophobicContact CG1-CD2 4.44Å; E363-Y390 HydrophobicContact CB-CE2 4.06Å; E363-Y390 WeakPolarHBondContact OE2-CE2 3.43Å; E363-Y390 PolarHBondContact OE2-OH 2.9Å; K378-Y390 HydrophobicContact CB-CD1 4.04Å; K378-Y390 HydrophobicContact CB-CD2 4.25Å; K378-Y390 HydrophobicContact CB-CE1 3.66Å; K378-Y390 HydrophobicContact CB-CE2 3.88Å; K378-Y390 HydrophobicContact CB-CG 4.31Å; K378-Y390 HydrophobicContact CD-CD1 4.28Å; K378-Y390 HydrophobicContact CD-CE1 3.87Å; K378-Y390 HydrophobicContact CG-CD1 3.76Å; K378-Y390 HydrophobicContact CG-CE1 3.67Å; K378-Y390 HydrophobicContact CG-CG 4.29Å; A381-Y390 HydrophobicContact CB-CD2 4.25Å; A381-Y390 HydrophobicContact CB-CG 4.48Å; Y390-A392 HydrophobicContact CE1-CB 3.79Å
391	V	98.4	Very high	95.7	Very high	2 Å²	2	45 Å²	45	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.1	177.2	-178	0	0	0	0	107.9	T360 V361 V362 E363 T460 I461 V464	T360-V391 HydrophobicContact CG2-CG2 3.92Å; V361-V391 PolarHBondContact O-N 3.5Å; V362-V391 WeakPolarHBondContact CA-O 3.37Å; V362-V391 HydrophobicContact CB-CB 4.47Å; V362-V391 HydrophobicContact CG1-CB 4.36Å; V362-V391 HydrophobicContact CG1-CG1 4.27Å; V362-V391 HydrophobicContact CG2-CB 4.18Å; V362-V391 HydrophobicContact CG2-CG2 4.45Å; E363-V391 PolarHBondContact N-O 3.42Å; V391-T460 HydrophobicContact CG1-CG2 3.75Å; V391-I461 HydrophobicContact CG1-CG1 4.16Å; V391-V464 HydrophobicContact CG2-CB 3.8Å; V391-V464 HydrophobicContact CG2-CG1 4.01Å; V391-V464 HydrophobicContact CG2-CG2 4.01Å
392	A	98.6	Very high	95.7	Very high	34 Å²	34	47.8 Å²	47.8	28%	0.281	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.4	168.6	0	0	0	0	0	109.5	E363 F365 P371 Y390 T460	E363-A392 WeakPolarHBondContact O-CA 3.42Å; F365-A392 HydrophobicContact CD2-CB 4.42Å; F365-A392 HydrophobicContact CE2-CB 3.99Å; P371-A392 HydrophobicContact CB-CB 3.72Å; P371-A392 HydrophobicContact CG-CB 4.15Å; Y390-A392 HydrophobicContact CE1-CB 3.79Å; A392-T460 WeakPolarHBondContact O-CG2 3.47Å
393	W	98.6	Very high	95.8	Very high	7 Å²	7	43.9 Å²	43.9	3%	0.027	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.3	170.2	177.5	87.4	0	0	0	109.2	E363 L364 F365 N395 T450 V452 D453 S456 L457 T460	E363-W393 PolarHBondContact O-N 3.08Å; L364-W393 CarbonylContact C-O 3.09Å; L364-W393 WeakPolarHBondContact CA-O 3.41Å; L364-W393 HydrophobicContact CB-CE3 4.16Å; L364-W393 HydrophobicContact CD2-CB 3.91Å; L364-W393 HydrophobicContact CD2-CD2 4.33Å; L364-W393 HydrophobicContact CD2-CE3 3.9Å; L364-W393 HydrophobicContact CD2-CG 4.39Å; F365-W393 PolarHBondContact N-O 3.38Å; W393-N395 HydrophobicContact CH2-CB 3.71Å; W393-N395 HydrophobicContact CZ3-CB 3.96Å; W393-T450 HydrophobicContact CH2-CG2 4.24Å; W393-T450 HydrophobicContact CZ3-CG2 4.12Å; W393-V452 HydrophobicContact CH2-CG1 4.27Å; W393-V452 HydrophobicContact CZ2-CG1 4.47Å; W393-V452 HydrophobicContact CZ3-CG1 4.47Å; W393-V452 HydrophobicContact CZ3-CG2 4.33Å; W393-D453 HydrophobicContact CZ2-CB 4.01Å; W393-S456 PolarHBondContact NE1-OG 2.85Å; W393-L457 HydrophobicContact CB-CD1 3.6Å; W393-L457 HydrophobicContact CD2-CD1 4.31Å; W393-L457 HydrophobicContact CG-CB 4.32Å; W393-L457 HydrophobicContact CG-CD1 3.68Å; W393-T460 HydrophobicContact CB-CG2 4.38Å
394	R	98.4	Very high	95.9	Very high	36 Å²	36	45.1 Å²	45.1	14%	0.136	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.9	178.9	175.2	-174.9	175.3	174.2	-3	109.1	F365 V369 P371 M396 R429 E430	F365-R394 HydrophobicContact CB-CB 4.27Å; F365-R394 HydrophobicContact CB-CG 4.44Å; V369-R394 WeakPolarHBondContact O-CD 3.42Å; V369-R394 WeakPolarHBondContact O-CG 3.43Å; V369-R394 PolarHBondContact O-NE 3.02Å; P371-R394 HydrophobicContact CG-CB 4.07Å; R394-M396 HydrophobicContact CB-SD 4.49Å; R394-M396 HydrophobicContact CG-SD 3.96Å; R394-M396 PolarHBondContact O-N 3.03Å; R394-R429 PolarHBondContact NH2-O 3.48Å; R394-R429 VanDerWaalsContact NH2-O 3.16Å; R394-E430 IonicContact CZ-OE2 2.94Å; R394-E430 VanDerWaalsContact CZ-OE2 3.29Å; R394-E430 IonicContact NH1-OE2 3.5Å; R394-E430 PolarHBondContact NH1-OE2 2.89Å; R394-E430 IonicContact NH2-OE2 2.7Å; R394-E430 PolarHBondContact NH2-OE2 3.05Å
395	N	98.3	Very high	96.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.			trans	-67.5	119.2	167.3	-177.5	24.3	0	0	0	110.2	F365 Y367 W393 M397 T401 T450	F365-N395 PolarHBondContact O-N 2.78Å; Y367-N395 WeakPolarHBondContact CA-O 3.5Å; W393-N395 HydrophobicContact CH2-CB 3.71Å; W393-N395 HydrophobicContact CZ3-CB 3.96Å; N395-M397 PolarHBondContact ND2-O 2.68Å; N395-M397 PolarHBondContact OD1-N 3.38Å; N395-M397 PolarHBondContact OD1-O 3.2Å; N395-T401 PolarHBondContact ND2-OG1 3.4Å; N395-T450 HydrophobicContact CB-CG2 3.87Å
396	M	96.6	Very high	96.7	Very high	128 Å²	128	47.3 Å²	47.3	63%	0.631	25%	0.249	S	C	*	.			trans	-100.2	-5.2	177.4	-63	-58.9	-67.9	0	0	112.9	Y367 R394	Y367-M396 WeakPolarHBondContact CE2-O 3.46Å; R394-M396 HydrophobicContact CB-SD 4.49Å; R394-M396 HydrophobicContact CG-SD 3.96Å; R394-M396 PolarHBondContact O-N 3.03Å
397	M	96.8	Very high	96.8	Very high	49 Å²	49	49.8 Å²	49.8	24%	0.241	26%	0.258	C	S	.	.			trans	-106.7	113.5	-173.4	-72.1	-174	-70.9	0	0	111.4	N395 E399 N400 T401 D453	N395-M397 PolarHBondContact ND2-O 2.68Å; N395-M397 PolarHBondContact OD1-N 3.38Å; N395-M397 PolarHBondContact OD1-O 3.2Å; M397-E399 HydrophobicContact CB-CG 4.11Å; M397-E399 PolarHBondContact O-N 3.23Å; M397-N400 HydrophobicContact CB-CB 4.1Å; M397-N400 WeakPolarHBondContact CE-ND2 3.07Å; M397-N400 PolarHBondContact O-N 3.37Å; M397-N400 VanDerWaalsContact O-N 3.13Å; M397-T401 PolarHBondContact O-OG1 3.1Å; M397-D453 HydrophobicContact CE-CB 3.47Å; M397-D453 VanDerWaalsContact CE-CB 3.47Å; M397-D453 WeakPolarHBondContact CE-OD2 3.34Å
398	P	95.9	Very high	97.1	Very high	70 Å²	70	49.6 Å²	49.6	46%	0.455	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-54	-38.7	173.6	-24.8	32.3	0	0	0	113.4	Y367 N400 T401	Y367-P398 HydrophobicContact CD2-CG 4.44Å; Y367-P398 HydrophobicContact CE1-CG 4.46Å; Y367-P398 HydrophobicContact CE2-CG 3.7Å; P398-N400 PolarHBondContact O-N 3.18Å; P398-T401 WeakPolarHBondContact O-CB 3.37Å; P398-T401 PolarHBondContact O-N 3.4Å; P398-T401 PolarHBondContact O-OG1 2.94Å
399	E	97.3	Very high	97.1	Very high	144 Å²	144	53.8 Å²	53.8	67%	0.673	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-63	-21.6	179.9	59.5	-91.4	-142.2	0	0	113.8	M397 T401	M397-E399 HydrophobicContact CB-CG 4.11Å; M397-E399 PolarHBondContact O-N 3.23Å; E399-T401 VanDerWaalsContact C-N 3.28Å
400	N	98.1	Very high	96.9	Very high	26 Å²	26	55.5 Å²	55.5	14%	0.139	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-92.3	16.2	175.9	-85.1	6.6	0	0	0	112.9	M397 P398 T450 K451	M397-N400 HydrophobicContact CB-CB 4.1Å; M397-N400 WeakPolarHBondContact CE-ND2 3.07Å; M397-N400 PolarHBondContact O-N 3.37Å; M397-N400 VanDerWaalsContact O-N 3.13Å; P398-N400 PolarHBondContact O-N 3.18Å; N400-T450 WeakPolarHBondContact O-CA 3.39Å; N400-K451 HydrophobicContact CB-CB 4.05Å; N400-K451 VanDerWaalsContact CB-O 3.3Å; N400-K451 WeakPolarHBondContact CB-O 3.36Å; N400-K451 PolarHBondContact ND2-O 2.78Å; N400-K451 VanDerWaalsContact ND2-O 3.11Å; N400-K451 PolarHBondContact O-N 3.3Å
401	T	97.8	Very high	96.7	Very high	23 Å²	23	57.6 Å²	57.6	14%	0.141	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.8	-174.2	-50	0	0	0	0	110.6	Y367 N395 M397 P398 E399 T403 Q448	Y367-T401 WeakPolarHBondContact CB-OG1 3.39Å; N395-T401 PolarHBondContact ND2-OG1 3.4Å; M397-T401 PolarHBondContact O-OG1 3.1Å; P398-T401 WeakPolarHBondContact O-CB 3.37Å; P398-T401 PolarHBondContact O-N 3.4Å; P398-T401 PolarHBondContact O-OG1 2.94Å; E399-T401 VanDerWaalsContact C-N 3.28Å; T401-T403 HydrophobicContact CG2-CG2 4.34Å; T401-Q448 HydrophobicContact CG2-CB 3.87Å; T401-Q448 VanDerWaalsContact CG2-CD 3.46Å; T401-Q448 HydrophobicContact CG2-CG 4.09Å
402	V	97.8	Very high	96.5	Very high	61 Å²	61	57.7 Å²	57.7	37%	0.37	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.3	169.9	176.9	0	0	0	0	109.3	L301 Q448 D449	L301-V402 HydrophobicContact CD1-CB 4.23Å; L301-V402 HydrophobicContact CD1-CG2 3.55Å; V402-Q448 WeakPolarHBondContact O-CA 3.26Å; V402-D449 HydrophobicContact CB-CB 4.24Å; V402-D449 PolarHBondContact N-O 3.04Å; V402-D449 PolarHBondContact O-N 3.36Å
403	T	96.7	Very high	96.4	Very high	53 Å²	53	56.1 Å²	56.1	33%	0.325	29%	0.286	S	S	.	.			trans	-102.8	156.5	179.6	50.3	0	0	0	0	111.3	T401 F444 Q448	T401-T403 HydrophobicContact CG2-CG2 4.34Å; T403-F444 HydrophobicContact CG2-CE1 3.84Å; T403-F444 HydrophobicContact CG2-CE2 3.96Å; T403-F444 HydrophobicContact CG2-CZ 3.33Å; T403-Q448 HydrophobicContact CG2-CG 3.9Å
404	H	96.7	Very high	96.4	Very high	35 Å²	35	55.9 Å²	55.9	16%	0.162	29%	0.285	C	S	.	.			trans	-131.4	66.8	-177.6	-58.5	-83.8	0	0	0	110.8	E406 R407 D449	H404-E406 VanDerWaalsContact C-OE2 3.25Å; H404-E406 IonicContact ND1-OE1 3.39Å; H404-E406 PolarHBondContact O-N 3.34Å; H404-E406 VanDerWaalsContact O-N 3.15Å; H404-R407 VanDerWaalsContact CB-CD 3.45Å; H404-R407 HydrophobicContact CB-CG 3.76Å; H404-R407 VanDerWaalsContact CB-NE 3.27Å; H404-R407 VanDerWaalsContact CD2-CZ 3.45Å; H404-R407 PolarHBondContact CE1-NH2 2.9Å; H404-R407 VanDerWaalsContact CE1-NH2 3.3Å; H404-R407 VanDerWaalsContact CG-NE 3.31Å; H404-R407 PolarHBondContact ND1-NH2 3.09Å; H404-R407 PolarHBondContact NE2-NH2 3.33Å; H404-R407 PolarHBondContact O-N 2.89Å; H404-D449 IonicContact CD2-OD2 2.71Å; H404-D449 IonicContact CE1-OD2 3.8Å; H404-D449 IonicContact NE2-OD2 3Å; H404-D449 PolarHBondContact NE2-OD2 2.89Å
405	P	96.4	Very high	96.3	Very high	42 Å²	42	58.3 Å²	58.3	27%	0.273	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.3	-173.2	26.9	-36.3	0	0	0	114.1	G413 I414 T415 F444	P405-G413 CarbonylContact O-C 3.58Å; P405-G413 WeakPolarHBondContact O-CA 3.26Å; P405-I414 HydrophobicContact CB-CD1 4.34Å; P405-I414 HydrophobicContact CB-CG1 3.74Å; P405-I414 PolarHBondContact O-N 3.24Å; P405-T415 WeakPolarHBondContact O-CG2 3.31Å; P405-T415 PolarHBondContact O-N 3.13Å; P405-F444 HydrophobicContact CB-CE2 4.44Å
406	E	96.4	Very high	96.2	Very high	120 Å²	120	63.4 Å²	63.4	56%	0.561	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-12.9	-178.3	74.7	-64.2	152.4	0	0	114.9	H404	H404-E406 VanDerWaalsContact C-OE2 3.25Å; H404-E406 IonicContact ND1-OE1 3.39Å; H404-E406 PolarHBondContact O-N 3.34Å; H404-E406 VanDerWaalsContact O-N 3.15Å
407	R	96	Very high	96.3	Very high	52 Å²	52	59.2 Å²	59.2	20%	0.196	31%	0.307	C	S	.	.	S	Bend	trans	-63.7	168.9	178.9	-75.6	-177.6	-172.3	-174.4	-3	112.1	Q296 H404 Q411 G413	Q296-R407 PolarHBondContact O-NH1 2.72Å; Q296-R407 PolarHBondContact O-NH2 2.97Å; H404-R407 VanDerWaalsContact CB-CD 3.45Å; H404-R407 HydrophobicContact CB-CG 3.76Å; H404-R407 VanDerWaalsContact CB-NE 3.27Å; H404-R407 VanDerWaalsContact CD2-CZ 3.45Å; H404-R407 PolarHBondContact CE1-NH2 2.9Å; H404-R407 VanDerWaalsContact CE1-NH2 3.3Å; H404-R407 VanDerWaalsContact CG-NE 3.31Å; H404-R407 PolarHBondContact ND1-NH2 3.09Å; H404-R407 PolarHBondContact NE2-NH2 3.33Å; H404-R407 PolarHBondContact O-N 2.89Å; R407-Q411 HydrophobicContact CB-CB 4.24Å; R407-G413 VanDerWaalsContact O-CA 3.27Å; R407-G413 WeakPolarHBondContact O-CA 3.49Å
408	P	96.7	Very high	96.3	Very high	68 Å²	68	61.9 Å²	61.9	44%	0.442	32%	0.322	S	S	.	.			trans	-53.7	150.8	164.3	-28.3	38.2	0	0	0	112.3	D410 Q411 G412 G413	P408-D410 VanDerWaalsContact C-N 3.25Å; P408-D410 WeakPolarHBondContact CB-OD1 3.41Å; P408-D410 PolarHBondContact O-N 3.45Å; P408-Q411 CarbonylContact O-C 3.48Å; P408-Q411 WeakPolarHBondContact O-CA 3.31Å; P408-Q411 PolarHBondContact O-N 3.08Å; P408-G412 PolarHBondContact O-N 3.38Å; P408-G413 PolarHBondContact O-N 2.86Å
409	W	94.8	Very high	96.4	Very high	107 Å²	107	69.1 Å²	69.1	41%	0.405	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-59.7	-35.8	-175.4	70.8	-89.8	0	0	0	112.8	Q411 G412 H416 R438 L443	W409-Q411 PolarHBondContact O-N 3.02Å; W409-G412 PolarHBondContact O-N 2.72Å; W409-H416 WeakPolarHBondContact CB-CE1 3.18Å; W409-R438 HydrophobicContact CH2-CG 3.84Å; W409-R438 HydrophobicContact CZ3-CB 4.07Å; W409-R438 HydrophobicContact CZ3-CG 3.79Å; W409-L443 HydrophobicContact CE3-CD1 3.77Å; W409-L443 HydrophobicContact CZ3-CD1 3.83Å
410	D	91.3	Very high	96.4	Very high	75 Å²	75	65.8 Å²	65.8	40%	0.401	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-74.8	-5.3	177.5	61.4	-34.6	0	0	0	113.3	P408 Y447	P408-D410 VanDerWaalsContact C-N 3.25Å; P408-D410 WeakPolarHBondContact CB-OD1 3.41Å; P408-D410 PolarHBondContact O-N 3.45Å; D410-Y447 WeakPolarHBondContact O-CE2 3.06Å; D410-Y447 PolarHBondContact O-OH 3.44Å
411	Q	93.1	Very high	96.4	Very high	77 Å²	77	66.8 Å²	66.8	36%	0.36	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-118.9	18.9	174.2	-58.9	-175.8	34.3	0	0	112.4	R407 P408 W409 Y447	R407-Q411 HydrophobicContact CB-CB 4.24Å; P408-Q411 CarbonylContact O-C 3.48Å; P408-Q411 WeakPolarHBondContact O-CA 3.31Å; P408-Q411 PolarHBondContact O-N 3.08Å; W409-Q411 PolarHBondContact O-N 3.02Å; Q411-Y447 VanDerWaalsContact C-CD2 3.44Å; Q411-Y447 WeakPolarHBondContact O-CB 2.81Å
412	G	94.1	Very high	96.4	Very high	4 Å²	4	67.8 Å²	67.8	4%	0.041	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	6.6	172.2	0	0	0	0	0	115.6	P408 W409 L443 F444	P408-G412 PolarHBondContact O-N 3.38Å; W409-G412 PolarHBondContact O-N 2.72Å; G412-L443 WeakPolarHBondContact CA-O 3.48Å; G412-F444 WeakPolarHBondContact O-CD2 3.4Å
413	G	96.8	Very high	96.4	Very high	2 Å²	2	66.8 Å²	66.8	2%	0.021	34%	0.343	C	S	.	.			trans	-74	147.4	174.6	0	0	0	0	0	113.5	P405 R407 P408 H416	P405-G413 CarbonylContact O-C 3.58Å; P405-G413 WeakPolarHBondContact O-CA 3.26Å; R407-G413 VanDerWaalsContact O-CA 3.27Å; R407-G413 WeakPolarHBondContact O-CA 3.49Å; P408-G413 PolarHBondContact O-N 2.86Å; G413-H416 PolarHBondContact O-CE1 3.24Å; G413-H416 PolarHBondContact O-ND1 3.25Å
414	I	98.1	Very high	96.4	Very high	2 Å²	2	69.2 Å²	69.2	1%	0.01	35%	0.346	C	S	.	.			trans	-127.4	1	-175.2	58.5	169.6	0	0	0	113.3	P405 H416 L417 Q422 I425 L426 F444	P405-I414 HydrophobicContact CB-CD1 4.34Å; P405-I414 HydrophobicContact CB-CG1 3.74Å; P405-I414 PolarHBondContact O-N 3.24Å; I414-H416 PolarHBondContact O-N 2.86Å; I414-H416 VanDerWaalsContact O-N 3.13Å; I414-L417 HydrophobicContact CB-CD1 4.02Å; I414-L417 HydrophobicContact CG2-CD1 4.02Å; I414-L417 WeakPolarHBondContact O-CB 3.24Å; I414-L417 PolarHBondContact O-N 3.35Å; I414-Q422 HydrophobicContact CB-CG 4.29Å; I414-Q422 HydrophobicContact CD1-CB 4.23Å; I414-Q422 HydrophobicContact CD1-CG 4.15Å; I414-Q422 HydrophobicContact CG1-CG 4.25Å; I414-Q422 VanDerWaalsContact O-CG 3.3Å; I414-Q422 WeakPolarHBondContact O-CG 2.75Å; I414-Q422 PolarHBondContact O-NE2 2.8Å; I414-I425 HydrophobicContact CD1-CG2 4.5Å; I414-I425 HydrophobicContact CG2-CD1 4.16Å; I414-L426 HydrophobicContact CD1-CD2 4.45Å; I414-L426 HydrophobicContact CD1-CG 4.29Å; I414-F444 HydrophobicContact CB-CD2 4.49Å; I414-F444 HydrophobicContact CD1-CD2 3.85Å; I414-F444 HydrophobicContact CD1-CE2 3.71Å; I414-F444 HydrophobicContact CD1-CZ 4.29Å; I414-F444 HydrophobicContact CG1-CD2 4.02Å; I414-F444 HydrophobicContact CG1-CE2 4.12Å; I414-F444 HydrophobicContact CG2-CB 3.85Å; I414-F444 HydrophobicContact CG2-CD2 3.7Å; I414-F444 HydrophobicContact CG2-CG 4.02Å
415	T	97.4	Very high	96.4	Very high	86 Å²	86	67.6 Å²	67.6	53%	0.528	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.4	179.6	47.5	0	0	0	0	114.1	P405 L417	P405-T415 WeakPolarHBondContact O-CG2 3.31Å; P405-T415 PolarHBondContact O-N 3.13Å; T415-L417 VanDerWaalsContact C-N 3.29Å
416	H	96.3	Very high	96.4	Very high	108 Å²	108	70.1 Å²	70.1	50%	0.5	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-14.1	177.3	68.4	-76.8	0	0	0	113.8	W409 G413 I414	W409-H416 WeakPolarHBondContact CB-CE1 3.18Å; G413-H416 PolarHBondContact O-CE1 3.24Å; G413-H416 PolarHBondContact O-ND1 3.25Å; I414-H416 PolarHBondContact O-N 2.86Å; I414-H416 VanDerWaalsContact O-N 3.13Å
417	L	97.5	Very high	96.4	Very high	40 Å²	40	71.7 Å²	71.7	21%	0.209	36%	0.356	C	S	.	.	S	Bend	trans	-86.8	161.7	178.6	-56	174	0	0	0	110.6	I414 T415 E421 Q422 I425 P440	I414-L417 HydrophobicContact CB-CD1 4.02Å; I414-L417 HydrophobicContact CG2-CD1 4.02Å; I414-L417 WeakPolarHBondContact O-CB 3.24Å; I414-L417 PolarHBondContact O-N 3.35Å; T415-L417 VanDerWaalsContact C-N 3.29Å; L417-E421 HydrophobicContact CB-CB 4.4Å; L417-E421 HydrophobicContact CB-CG 4.32Å; L417-E421 HydrophobicContact CD1-CG 3.98Å; L417-Q422 HydrophobicContact CB-CG 4.15Å; L417-Q422 PolarHBondContact O-NE2 3.36Å; L417-I425 HydrophobicContact CD1-CD1 3.67Å; L417-P440 HydrophobicContact CD1-CB 3.61Å; L417-P440 HydrophobicContact CD1-CG 4.14Å
418	D	97.7	Very high	96.3	Very high	104 Å²	104	70.2 Å²	70.2	56%	0.556	35%	0.354	S	S	*	.			trans	-66.4	161.1	172.5	71.1	59.8	0	0	0	112.1	A420 E421 Q422	D418-A420 VanDerWaalsContact C-N 3.26Å; D418-A420 PolarHBondContact O-N 3.14Å; D418-A420 WeakPolarHBondContact OD1-CA 3.46Å; D418-A420 WeakPolarHBondContact OD1-CB 3.39Å; D418-A420 PolarHBondContact OD1-N 3.19Å; D418-E421 PolarHBondContact O-N 3.01Å; D418-E421 PolarHBondContact OD1-N 2.86Å; D418-Q422 WeakPolarHBondContact O-CG 3.36Å; D418-Q422 PolarHBondContact O-N 2.96Å
419	R	97.6	Very high	96.3	Very high	222 Å²	222	76.3 Å²	76.3	84%	0.838	37%	0.369	S	S	*	.	H	α-helix	trans	-64.7	-28.6	-175.9	-69.4	-172.6	178.4	-174.7	0.2	113.4	A423	R419-A423 WeakPolarHBondContact O-CB 3.37Å; R419-A423 PolarHBondContact O-N 2.54Å
420	A	97.9	Very high	96.4	Very high	75 Å²	75	74.9 Å²	74.9	62%	0.62	37%	0.366	S	S	*	.	H	α-helix	trans	-72.7	-43.2	-179.5	0	0	0	0	0	110.3	D418 A423 R424	D418-A420 VanDerWaalsContact C-N 3.26Å; D418-A420 PolarHBondContact O-N 3.14Å; D418-A420 WeakPolarHBondContact OD1-CA 3.46Å; D418-A420 WeakPolarHBondContact OD1-CB 3.39Å; D418-A420 PolarHBondContact OD1-N 3.19Å; A420-A423 PolarHBondContact O-N 3.31Å; A420-R424 WeakPolarHBondContact O-CB 3.2Å; A420-R424 PolarHBondContact O-N 2.83Å
421	E	97.4	Very high	96.6	Very high	47 Å²	47	71.3 Å²	71.3	22%	0.22	35%	0.347	C	S	.	.	H	α-helix	trans	-67.2	-41.2	175.8	-178.3	59.9	-171.7	0	0	111.6	L417 D418 A423 R424 I425	L417-E421 HydrophobicContact CB-CB 4.4Å; L417-E421 HydrophobicContact CB-CG 4.32Å; L417-E421 HydrophobicContact CD1-CG 3.98Å; D418-E421 PolarHBondContact O-N 3.01Å; D418-E421 PolarHBondContact OD1-N 2.86Å; E421-A423 VanDerWaalsContact C-N 3.33Å; E421-A423 PolarHBondContact O-N 3.28Å; E421-R424 WeakPolarHBondContact O-CB 3.46Å; E421-R424 PolarHBondContact O-N 2.92Å; E421-R424 IonicContact OE1-CZ 3.34Å; E421-R424 IonicContact OE1-NE 2.69Å; E421-R424 PolarHBondContact OE1-NE 2.76Å; E421-R424 IonicContact OE1-NH2 3.02Å; E421-R424 PolarHBondContact OE1-NH2 3.35Å; E421-R424 IonicContact OE2-CZ 3.05Å; E421-R424 IonicContact OE2-NE 2.63Å; E421-R424 PolarHBondContact OE2-NE 3.4Å; E421-R424 IonicContact OE2-NH2 2.7Å; E421-I425 HydrophobicContact CG-CD1 4.08Å; E421-I425 WeakPolarHBondContact O-CG1 3.43Å; E421-I425 PolarHBondContact O-N 3.29Å
422	Q	97.9	Very high	96.7	Very high	44 Å²	44	71.1 Å²	71.1	21%	0.206	35%	0.353	C	S	.	.	H	α-helix	trans	-56.7	-47.4	171.5	-70.5	-178.3	43.8	0	0	111.4	I414 L417 D418 R424 I425 L426	I414-Q422 HydrophobicContact CB-CG 4.29Å; I414-Q422 HydrophobicContact CD1-CB 4.23Å; I414-Q422 HydrophobicContact CD1-CG 4.15Å; I414-Q422 HydrophobicContact CG1-CG 4.25Å; I414-Q422 VanDerWaalsContact O-CG 3.3Å; I414-Q422 WeakPolarHBondContact O-CG 2.75Å; I414-Q422 PolarHBondContact O-NE2 2.8Å; L417-Q422 HydrophobicContact CB-CG 4.15Å; L417-Q422 PolarHBondContact O-NE2 3.36Å; D418-Q422 WeakPolarHBondContact O-CG 3.36Å; D418-Q422 PolarHBondContact O-N 2.96Å; Q422-R424 PolarHBondContact O-N 2.85Å; Q422-I425 PolarHBondContact O-N 2.95Å; Q422-L426 WeakPolarHBondContact O-CB 3.3Å; Q422-L426 VanDerWaalsContact O-CG 3.23Å; Q422-L426 WeakPolarHBondContact O-CG 3.14Å; Q422-L426 PolarHBondContact O-N 3.06Å
423	A	97.4	Very high	96.7	Very high	39 Å²	39	78.8 Å²	78.8	32%	0.322	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-41.3	177.9	0	0	0	0	0	112.2	R419 A420 E421 L426 Q427	R419-A423 WeakPolarHBondContact O-CB 3.37Å; R419-A423 PolarHBondContact O-N 2.54Å; A420-A423 PolarHBondContact O-N 3.31Å; E421-A423 VanDerWaalsContact C-N 3.33Å; E421-A423 PolarHBondContact O-N 3.28Å; A423-L426 PolarHBondContact O-N 2.83Å; A423-Q427 WeakPolarHBondContact O-CB 3.42Å; A423-Q427 VanDerWaalsContact O-CG 3.24Å; A423-Q427 WeakPolarHBondContact O-CG 3.43Å; A423-Q427 PolarHBondContact O-N 3.41Å
424	R	97.5	Very high	96.6	Very high	105 Å²	105	79.5 Å²	79.5	40%	0.396	38%	0.383	S	S	.	.	H	α-helix	trans	-59.9	-48.9	175.7	-170	-163.5	69.4	72.1	2.3	111.3	A420 E421 Q422 L426 Q427 S428 E441	A420-R424 WeakPolarHBondContact O-CB 3.2Å; A420-R424 PolarHBondContact O-N 2.83Å; E421-R424 WeakPolarHBondContact O-CB 3.46Å; E421-R424 PolarHBondContact O-N 2.92Å; E421-R424 IonicContact OE1-CZ 3.34Å; E421-R424 IonicContact OE1-NE 2.69Å; E421-R424 PolarHBondContact OE1-NE 2.76Å; E421-R424 IonicContact OE1-NH2 3.02Å; E421-R424 PolarHBondContact OE1-NH2 3.35Å; E421-R424 IonicContact OE2-CZ 3.05Å; E421-R424 IonicContact OE2-NE 2.63Å; E421-R424 PolarHBondContact OE2-NE 3.4Å; E421-R424 IonicContact OE2-NH2 2.7Å; Q422-R424 PolarHBondContact O-N 2.85Å; R424-L426 PolarHBondContact O-N 3.42Å; R424-Q427 PolarHBondContact O-N 3.43Å; R424-S428 PolarHBondContact O-N 2.83Å; R424-S428 VanDerWaalsContact O-N 3.13Å; R424-E441 IonicContact CZ-OE2 3.61Å; R424-E441 IonicContact NH1-OE2 3.1Å; R424-E441 PolarHBondContact NH1-OE2 2.95Å; R424-E441 IonicContact NH2-OE2 3.5Å; R424-E441 PolarHBondContact NH2-OE2 2.85Å
425	I	97	Very high	96.4	Very high	0 Å²	0	83.7 Å²	83.7	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-60.6	-47.1	178.9	-70.9	172.3	0	0	0	110.3	I414 L417 E421 Q422 Q427 S428 P440 E441 F444 R445	I414-I425 HydrophobicContact CD1-CG2 4.5Å; I414-I425 HydrophobicContact CG2-CD1 4.16Å; L417-I425 HydrophobicContact CD1-CD1 3.67Å; E421-I425 HydrophobicContact CG-CD1 4.08Å; E421-I425 WeakPolarHBondContact O-CG1 3.43Å; E421-I425 PolarHBondContact O-N 3.29Å; Q422-I425 PolarHBondContact O-N 2.95Å; I425-Q427 VanDerWaalsContact C-N 3.33Å; I425-Q427 PolarHBondContact O-N 3.38Å; I425-S428 WeakPolarHBondContact O-CB 3.37Å; I425-S428 PolarHBondContact O-N 2.74Å; I425-P440 HydrophobicContact CD1-CB 3.98Å; I425-P440 HydrophobicContact CD1-CG 4.17Å; I425-E441 HydrophobicContact CD1-CB 4.45Å; I425-E441 HydrophobicContact CG1-CB 4.04Å; I425-E441 HydrophobicContact CG1-CG 4.33Å; I425-E441 HydrophobicContact CG2-CG 4.35Å; I425-F444 HydrophobicContact CG2-CB 3.93Å; I425-F444 HydrophobicContact CG2-CD1 3.34Å; I425-F444 HydrophobicContact CG2-CE1 3.95Å; I425-F444 HydrophobicContact CG2-CG 3.67Å; I425-R445 PolarHBondContact O-NH2 3.38Å
426	L	95.9	Very high	95.8	Very high	95 Å²	95	81.6 Å²	81.6	50%	0.497	39%	0.394	S	S	.	.	H	α-helix	trans	-62.3	-37.3	-178.9	-73	168.4	0	0	0	112.8	I414 Q422 A423 R424 F444 R445	I414-L426 HydrophobicContact CD1-CD2 4.45Å; I414-L426 HydrophobicContact CD1-CG 4.29Å; Q422-L426 WeakPolarHBondContact O-CB 3.3Å; Q422-L426 VanDerWaalsContact O-CG 3.23Å; Q422-L426 WeakPolarHBondContact O-CG 3.14Å; Q422-L426 PolarHBondContact O-N 3.06Å; A423-L426 PolarHBondContact O-N 2.83Å; R424-L426 PolarHBondContact O-N 3.42Å; L426-F444 HydrophobicContact CD2-CE1 4.08Å; L426-F444 HydrophobicContact CD2-CE2 4.36Å; L426-F444 HydrophobicContact CD2-CZ 3.53Å; L426-R445 PolarHBondContact O-NH2 2.66Å
427	Q	95.6	Very high	95.4	Very high	153 Å²	153	79.6 Å²	79.6	72%	0.715	39%	0.391	S	S	*	.	H	α-helix	trans	-78.4	-18.9	179.1	-69.3	172.7	22.5	0	0	113.9	A423 R424 I425	A423-Q427 WeakPolarHBondContact O-CB 3.42Å; A423-Q427 VanDerWaalsContact O-CG 3.24Å; A423-Q427 WeakPolarHBondContact O-CG 3.43Å; A423-Q427 PolarHBondContact O-N 3.41Å; R424-Q427 PolarHBondContact O-N 3.43Å; I425-Q427 VanDerWaalsContact C-N 3.33Å; I425-Q427 PolarHBondContact O-N 3.38Å
428	S	95.1	Very high	95.1	Very high	22 Å²	22	86.8 Å²	86.8	15%	0.154	42%	0.415	C	S	.	.			trans	-62.2	140.6	-179.9	-178	0	0	0	0	112.6	R424 I425 E430 E441 R445	R424-S428 PolarHBondContact O-N 2.83Å; R424-S428 VanDerWaalsContact O-N 3.13Å; I425-S428 WeakPolarHBondContact O-CB 3.37Å; I425-S428 PolarHBondContact O-N 2.74Å; S428-E430 PolarHBondContact OG-N 2.85Å; S428-E430 PolarHBondContact OG-O 2.83Å; S428-E441 WeakPolarHBondContact CB-OE1 3.37Å; S428-E441 PolarHBondContact OG-OE1 2.85Å; S428-R445 PolarHBondContact O-NH2 3.13Å
429	R	95.7	Very high	94.9	Very high	196 Å²	196	83.9 Å²	83.9	74%	0.74	40%	0.399	S	S	*	.	S	Bend	trans	-107.4	-11.7	179.4	-61.3	-171.6	176.6	-168.9	-1.8	113.4	A368 R394	A368-R429 VanDerWaalsContact CA-O 3.3Å; A368-R429 WeakPolarHBondContact CA-O 3.23Å; A368-R429 VanDerWaalsContact CB-C 3.5Å; A368-R429 WeakPolarHBondContact CB-O 3.33Å; R394-R429 PolarHBondContact NH2-O 3.48Å; R394-R429 VanDerWaalsContact NH2-O 3.16Å
430	E	97	Very high	94.9	Very high	77 Å²	77	74.9 Å²	74.9	36%	0.36	37%	0.37	S	S	.	.	S	Bend	trans	-156.2	130.9	178.7	-177.5	155.1	130	0	0	110.3	A368 N370 H373 R394 S428 P432	A368-E430 CarbonylContact O-C 3.52Å; A368-E430 WeakPolarHBondContact O-CA 3.47Å; N370-E430 HydrophobicContact CB-CG 4.22Å; N370-E430 PolarHBondContact ND2-OE1 3.01Å; H373-E430 IonicContact CE1-OE1 3.22Å; R394-E430 IonicContact CZ-OE2 2.94Å; R394-E430 VanDerWaalsContact CZ-OE2 3.29Å; R394-E430 IonicContact NH1-OE2 3.5Å; R394-E430 PolarHBondContact NH1-OE2 2.89Å; R394-E430 IonicContact NH2-OE2 2.7Å; R394-E430 PolarHBondContact NH2-OE2 3.05Å; S428-E430 PolarHBondContact OG-N 2.85Å; S428-E430 PolarHBondContact OG-O 2.83Å; E430-P432 VanDerWaalsContact O-CD 3.26Å; E430-P432 WeakPolarHBondContact O-CD 3.12Å
431	V	96.1	Very high	94.8	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-69.3	119.3	175.6	-175.8	0	0	0	0	109.3	A368 Y374 E441 W442 R445	A368-V431 PolarHBondContact O-N 3.34Å; Y374-V431 WeakPolarHBondContact OH-CG1 3.34Å; V431-E441 HydrophobicContact CG2-CG 4.43Å; V431-W442 HydrophobicContact CG1-CB 4.04Å; V431-W442 HydrophobicContact CG1-CE3 4.39Å; V431-R445 HydrophobicContact CG2-CB 3.58Å; V431-R445 HydrophobicContact CG2-CG 3.5Å; V431-R445 VanDerWaalsContact CG2-CG 3.5Å
432	P	94.3	Very high	94.8	Very high	73 Å²	73	70.8 Å²	70.8	47%	0.474	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-62.2	157.5	173.9	-21.3	33.8	0	0	0	111.8	E430 H434	E430-P432 VanDerWaalsContact O-CD 3.26Å; E430-P432 WeakPolarHBondContact O-CD 3.12Å; P432-H434 PolarHBondContact O-N 3.05Å; P432-H434 PolarHBondContact O-ND1 3.41Å
433	R	94.9	Very high	94.7	Very high	164 Å²	164	69.3 Å²	69.3	62%	0.619	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-57.5	134.4	167.4	-71.5	-171.9	179.6	-162	-2.6	109.3	P250 H373	P250-R433 HydrophobicContact CB-CB 4.02Å; P250-R433 HydrophobicContact CB-CG 4.49Å; P250-R433 HydrophobicContact CG-CB 4.12Å; H373-R433 PolarHBondContact CD2-NE 2.71Å; H373-R433 PolarHBondContact NE2-NE 2.69Å
434	H	94.1	Very high	94.7	Very high	18 Å²	18	67.6 Å²	67.6	8%	0.083	32%	0.315	C	S	.	.			trans	-145.8	162.8	-173.2	58.6	-92.5	0	0	0	110.6	Y374 P432 N439 W442	Y374-H434 AromaticContact CE1-CE1 3.8Å; Y374-H434 AromaticContact CZ-CE1 3.84Å; Y374-H434 PolarHBondContact OH-CE1 3.44Å; P432-H434 PolarHBondContact O-N 3.05Å; P432-H434 PolarHBondContact O-ND1 3.41Å; H434-N439 HydrophobicContact CB-CB 4.24Å; H434-W442 VanDerWaalsContact CE1-CB 3.4Å; H434-W442 WeakPolarHBondContact CE1-CB 3.27Å; H434-W442 AromaticContact CE1-CD2 3.76Å; H434-W442 AromaticContact CE1-CG 3.49Å; H434-W442 VanDerWaalsContact CE1-CG 3.49Å; H434-W442 AromaticContact NE2-CD1 3.66Å; H434-W442 AromaticContact NE2-CD2 3.89Å; H434-W442 AromaticContact NE2-CG 3.37Å
435	L	93.2	Very high	94.7	Very high	90 Å²	90	63.1 Å²	63.1	47%	0.471	30%	0.299	S	S	.	.			trans	-82.3	150.8	170.2	-59.8	-178.5	0	0	0	110.6	G246 Q249	G246-L435 CarbonylContact O-C 3.55Å; G246-L435 WeakPolarHBondContact O-CA 3.33Å; Q249-L435 WeakPolarHBondContact O-CD2 3.45Å
436	C	86.5	Confident	94.7	Very high	42 Å²	42	63.3 Å²	63.3	28%	0.284	30%	0.3	S	S	.	.	S	Bend	trans	-62.6	155.9	174.5	-151.9	0	0	0	0	111.5	Y245 G246 F247	Y245-C436 WeakPolarHBondContact O-CB 3.44Å; G246-C436 PolarHBondContact O-N 2.93Å; F247-C436 HydrophobicContact CD1-CB 4.41Å; F247-C436 HydrophobicContact CE1-CB 4.37Å
437	C	86.3	Confident	94.7	Very high	65 Å²	65	61.4 Å²	61.4	44%	0.439	29%	0.286	S	S	.	.	S	Bend	cis	-131.8	9.8	-7	-48	0	0	0	0	111.3
438	R	91.1	Very high	94.8	Very high	191 Å²	191	54.2 Å²	54.2	72%	0.721	25%	0.252	S	S	*	.			trans	-116.2	20.3	-169.1	-59.1	-169.1	173.7	-175.5	-3	112.6	W409 P440	W409-R438 HydrophobicContact CH2-CG 3.84Å; W409-R438 HydrophobicContact CZ3-CB 4.07Å; W409-R438 HydrophobicContact CZ3-CG 3.79Å; R438-P440 VanDerWaalsContact O-CD 3.27Å; R438-P440 WeakPolarHBondContact O-CD 3.19Å
439	N	95.1	Very high	94.9	Very high	43 Å²	43	53.4 Å²	53.4	23%	0.23	25%	0.246	C	C	.	.			trans	-66.4	115.7	176.9	-178.8	-77.4	0	0	0	109	H434 E441 W442 L443	H434-N439 HydrophobicContact CB-CB 4.24Å; N439-E441 VanDerWaalsContact C-N 3.35Å; N439-E441 PolarHBondContact O-N 2.94Å; N439-E441 WeakPolarHBondContact OD1-CB 3.46Å; N439-E441 PolarHBondContact OD1-N 2.86Å; N439-W442 HydrophobicContact CB-CB 3.97Å; N439-W442 PolarHBondContact O-N 2.76Å; N439-W442 WeakPolarHBondContact OD1-CB 3.17Å; N439-W442 PolarHBondContact OD1-N 3.2Å; N439-L443 WeakPolarHBondContact O-CG 3.36Å; N439-L443 PolarHBondContact O-N 2.94Å; N439-L443 VanDerWaalsContact O-N 3.08Å
440	P	95.8	Very high	95.1	Very high	34 Å²	34	44 Å²	44	22%	0.221	21%	0.211	C	C	.	.	H	α-helix	trans	-68.4	-34.3	-172	24.8	-33	0	0	0	112.5	L417 I425 R438 L443 F444	L417-P440 HydrophobicContact CD1-CB 3.61Å; L417-P440 HydrophobicContact CD1-CG 4.14Å; I425-P440 HydrophobicContact CD1-CB 3.98Å; I425-P440 HydrophobicContact CD1-CG 4.17Å; R438-P440 VanDerWaalsContact O-CD 3.27Å; R438-P440 WeakPolarHBondContact O-CD 3.19Å; P440-L443 PolarHBondContact O-N 2.58Å; P440-F444 VanDerWaalsContact O-CB 3.23Å; P440-F444 WeakPolarHBondContact O-CB 3.4Å; P440-F444 PolarHBondContact O-N 3.08Å
441	E	96.9	Very high	95.2	Very high	4 Å²	4	45 Å²	45	2%	0.019	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-45.3	177.2	-172.4	177.2	163.1	0	0	111.2	R424 I425 S428 V431 N439 F444 R445	R424-E441 IonicContact CZ-OE2 3.61Å; R424-E441 IonicContact NH1-OE2 3.1Å; R424-E441 PolarHBondContact NH1-OE2 2.95Å; R424-E441 IonicContact NH2-OE2 3.5Å; R424-E441 PolarHBondContact NH2-OE2 2.85Å; I425-E441 HydrophobicContact CD1-CB 4.45Å; I425-E441 HydrophobicContact CG1-CB 4.04Å; I425-E441 HydrophobicContact CG1-CG 4.33Å; I425-E441 HydrophobicContact CG2-CG 4.35Å; S428-E441 WeakPolarHBondContact CB-OE1 3.37Å; S428-E441 PolarHBondContact OG-OE1 2.85Å; V431-E441 HydrophobicContact CG2-CG 4.43Å; N439-E441 VanDerWaalsContact C-N 3.35Å; N439-E441 PolarHBondContact O-N 2.94Å; N439-E441 WeakPolarHBondContact OD1-CB 3.46Å; N439-E441 PolarHBondContact OD1-N 2.86Å; E441-F444 PolarHBondContact O-N 2.84Å; E441-R445 HydrophobicContact CG-CG 4.49Å; E441-R445 WeakPolarHBondContact O-CB 3.31Å; E441-R445 VanDerWaalsContact O-CG 3.25Å; E441-R445 WeakPolarHBondContact O-CG 3.4Å; E441-R445 PolarHBondContact O-N 3Å
442	W	96.4	Very high	95.3	Very high	31 Å²	31	45.2 Å²	45.2	12%	0.117	22%	0.215	C	C	.	.	H	α-helix	trans	-56.5	-52.4	173	165.6	-117.2	0	0	0	111.9	V369 Y374 V431 H434 N439 F444 R445 I446	V369-W442 HydrophobicContact CG1-CH2 4.37Å; V369-W442 HydrophobicContact CG1-CZ3 3.72Å; V369-W442 HydrophobicContact CG2-CZ3 4.09Å; Y374-W442 HydrophobicContact CD1-CE3 4.45Å; Y374-W442 AromaticContact CD1-CH2 3.45Å; Y374-W442 HydrophobicContact CD1-CH2 3.45Å; Y374-W442 VanDerWaalsContact CD1-CH2 3.45Å; Y374-W442 AromaticContact CD1-CZ2 3.98Å; Y374-W442 HydrophobicContact CD1-CZ2 3.98Å; Y374-W442 AromaticContact CD1-CZ3 3.74Å; Y374-W442 HydrophobicContact CD1-CZ3 3.74Å; Y374-W442 HydrophobicContact CD2-CH2 4.11Å; Y374-W442 AromaticContact CD2-CZ3 3.85Å; Y374-W442 HydrophobicContact CD2-CZ3 3.85Å; Y374-W442 HydrophobicContact CE1-CD2 4.07Å; Y374-W442 AromaticContact CE1-CE3 3.65Å; Y374-W442 HydrophobicContact CE1-CE3 3.65Å; Y374-W442 AromaticContact CE1-CH2 3.51Å; Y374-W442 HydrophobicContact CE1-CH2 3.51Å; Y374-W442 AromaticContact CE1-CZ2 3.96Å; Y374-W442 HydrophobicContact CE1-CZ2 3.96Å; Y374-W442 AromaticContact CE1-CZ3 3.36Å; Y374-W442 HydrophobicContact CE1-CZ3 3.36Å; Y374-W442 HydrophobicContact CE2-CE3 4.08Å; Y374-W442 HydrophobicContact CE2-CH2 4.16Å; Y374-W442 AromaticContact CE2-CZ3 3.49Å; Y374-W442 HydrophobicContact CE2-CZ3 3.49Å; Y374-W442 VanDerWaalsContact CE2-CZ3 3.49Å; Y374-W442 AromaticContact CG-CH2 3.8Å; Y374-W442 HydrophobicContact CG-CH2 3.8Å; Y374-W442 HydrophobicContact CG-CZ3 4Å; Y374-W442 AromaticContact CZ-CE3 3.46Å; Y374-W442 VanDerWaalsContact CZ-CE3 3.46Å; Y374-W442 AromaticContact CZ-CH2 3.89Å; Y374-W442 AromaticContact CZ-CZ3 3.24Å; V431-W442 HydrophobicContact CG1-CB 4.04Å; V431-W442 HydrophobicContact CG1-CE3 4.39Å; H434-W442 VanDerWaalsContact CE1-CB 3.4Å; H434-W442 WeakPolarHBondContact CE1-CB 3.27Å; H434-W442 AromaticContact CE1-CD2 3.76Å; H434-W442 AromaticContact CE1-CG 3.49Å; H434-W442 VanDerWaalsContact CE1-CG 3.49Å; H434-W442 AromaticContact NE2-CD1 3.66Å; H434-W442 AromaticContact NE2-CD2 3.89Å; H434-W442 AromaticContact NE2-CG 3.37Å; N439-W442 HydrophobicContact CB-CB 3.97Å; N439-W442 PolarHBondContact O-N 2.76Å; N439-W442 WeakPolarHBondContact OD1-CB 3.17Å; N439-W442 PolarHBondContact OD1-N 3.2Å; W442-F444 VanDerWaalsContact C-N 3.32Å; W442-F444 PolarHBondContact O-N 2.86Å; W442-R445 PolarHBondContact O-N 3.39Å; W442-I446 HydrophobicContact CD2-CB 4.15Å; W442-I446 HydrophobicContact CD2-CG2 4.24Å; W442-I446 HydrophobicContact CE3-CB 4.02Å; W442-I446 HydrophobicContact CH2-CB 3.79Å; W442-I446 HydrophobicContact CH2-CD1 3.45Å; W442-I446 VanDerWaalsContact CH2-CD1 3.45Å; W442-I446 HydrophobicContact CH2-CG1 3.44Å; W442-I446 VanDerWaalsContact CH2-CG1 3.44Å; W442-I446 HydrophobicContact CZ2-CB 3.9Å; W442-I446 HydrophobicContact CZ2-CD1 4.17Å; W442-I446 HydrophobicContact CZ2-CG1 3.64Å; W442-I446 HydrophobicContact CZ2-CG2 4.12Å; W442-I446 HydrophobicContact CZ3-CB 3.83Å; W442-I446 HydrophobicContact CZ3-CD1 3.79Å; W442-I446 HydrophobicContact CZ3-CG1 3.93Å; W442-I446 WeakPolarHBondContact O-CB 3Å; W442-I446 VanDerWaalsContact O-CG2 3.27Å; W442-I446 WeakPolarHBondContact O-CG2 3.41Å; W442-I446 PolarHBondContact O-N 2.77Å
443	L	96.7	Very high	95.5	Very high	13 Å²	13	43.8 Å²	43.8	7%	0.068	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-43.9	-179.3	-67	169.8	0	0	0	110.8	W409 G412 N439 P440 R445 Y447	W409-L443 HydrophobicContact CE3-CD1 3.77Å; W409-L443 HydrophobicContact CZ3-CD1 3.83Å; G412-L443 WeakPolarHBondContact CA-O 3.48Å; N439-L443 WeakPolarHBondContact O-CG 3.36Å; N439-L443 PolarHBondContact O-N 2.94Å; N439-L443 VanDerWaalsContact O-N 3.08Å; P440-L443 PolarHBondContact O-N 2.58Å; L443-R445 VanDerWaalsContact C-N 3.35Å; L443-R445 PolarHBondContact O-N 2.94Å; L443-Y447 HydrophobicContact CD2-CD2 4.48Å; L443-Y447 HydrophobicContact CD2-CE2 3.85Å; L443-Y447 VanDerWaalsContact O-CD2 3.26Å; L443-Y447 WeakPolarHBondContact O-CD2 3Å; L443-Y447 PolarHBondContact O-N 3.31Å
444	F	97.5	Very high	95.7	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-39.8	176.4	178	-99.5	0	0	0	112.9	T403 P405 G412 I414 I425 L426 P440 E441 W442 Q448	T403-F444 HydrophobicContact CG2-CE1 3.84Å; T403-F444 HydrophobicContact CG2-CE2 3.96Å; T403-F444 HydrophobicContact CG2-CZ 3.33Å; P405-F444 HydrophobicContact CB-CE2 4.44Å; G412-F444 WeakPolarHBondContact O-CD2 3.4Å; I414-F444 HydrophobicContact CB-CD2 4.49Å; I414-F444 HydrophobicContact CD1-CD2 3.85Å; I414-F444 HydrophobicContact CD1-CE2 3.71Å; I414-F444 HydrophobicContact CD1-CZ 4.29Å; I414-F444 HydrophobicContact CG1-CD2 4.02Å; I414-F444 HydrophobicContact CG1-CE2 4.12Å; I414-F444 HydrophobicContact CG2-CB 3.85Å; I414-F444 HydrophobicContact CG2-CD2 3.7Å; I414-F444 HydrophobicContact CG2-CG 4.02Å; I425-F444 HydrophobicContact CG2-CB 3.93Å; I425-F444 HydrophobicContact CG2-CD1 3.34Å; I425-F444 HydrophobicContact CG2-CE1 3.95Å; I425-F444 HydrophobicContact CG2-CG 3.67Å; L426-F444 HydrophobicContact CD2-CE1 4.08Å; L426-F444 HydrophobicContact CD2-CE2 4.36Å; L426-F444 HydrophobicContact CD2-CZ 3.53Å; P440-F444 VanDerWaalsContact O-CB 3.23Å; P440-F444 WeakPolarHBondContact O-CB 3.4Å; P440-F444 PolarHBondContact O-N 3.08Å; E441-F444 PolarHBondContact O-N 2.84Å; W442-F444 VanDerWaalsContact C-N 3.32Å; W442-F444 PolarHBondContact O-N 2.86Å; F444-Q448 WeakPolarHBondContact O-CG 3.49Å; F444-Q448 PolarHBondContact O-NE2 3.29Å
445	R	97.2	Very high	95.9	Very high	11 Å²	11	41.1 Å²	41.1	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-80.5	-38.2	-178.6	-65.1	-54.1	-176.7	173.1	-10.4	113.1	P366 A368 V369 I425 L426 S428 V431 E441 W442 L443 Q448	P366-R445 WeakPolarHBondContact CB-O 3.41Å; A368-R445 HydrophobicContact CB-CG 3.97Å; V369-R445 HydrophobicContact CG2-CB 4Å; I425-R445 PolarHBondContact O-NH2 3.38Å; L426-R445 PolarHBondContact O-NH2 2.66Å; S428-R445 PolarHBondContact O-NH2 3.13Å; V431-R445 HydrophobicContact CG2-CB 3.58Å; V431-R445 HydrophobicContact CG2-CG 3.5Å; V431-R445 VanDerWaalsContact CG2-CG 3.5Å; E441-R445 HydrophobicContact CG-CG 4.49Å; E441-R445 WeakPolarHBondContact O-CB 3.31Å; E441-R445 VanDerWaalsContact O-CG 3.25Å; E441-R445 WeakPolarHBondContact O-CG 3.4Å; E441-R445 PolarHBondContact O-N 3Å; W442-R445 PolarHBondContact O-N 3.39Å; L443-R445 VanDerWaalsContact C-N 3.35Å; L443-R445 PolarHBondContact O-N 2.94Å; R445-Q448 VanDerWaalsContact O-CG 3.25Å; R445-Q448 WeakPolarHBondContact O-CG 3.33Å; R445-Q448 PolarHBondContact O-OE1 3Å
446	I	97.1	Very high	96.1	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-76.1	-25.6	-175.6	-162.9	56.6	0	0	0	113.3	R298 H345 P366 V369 W442 Q448	R298-I446 WeakPolarHBondContact CD-O 3.5Å; R298-I446 WeakPolarHBondContact CG-O 3.49Å; H345-I446 HydrophobicContact CB-CD1 4.41Å; P366-I446 HydrophobicContact CG-CD1 4.31Å; V369-I446 HydrophobicContact CG1-CD1 4.19Å; V369-I446 HydrophobicContact CG2-CD1 4.05Å; W442-I446 HydrophobicContact CD2-CB 4.15Å; W442-I446 HydrophobicContact CD2-CG2 4.24Å; W442-I446 HydrophobicContact CE3-CB 4.02Å; W442-I446 HydrophobicContact CH2-CB 3.79Å; W442-I446 HydrophobicContact CH2-CD1 3.45Å; W442-I446 VanDerWaalsContact CH2-CD1 3.45Å; W442-I446 HydrophobicContact CH2-CG1 3.44Å; W442-I446 VanDerWaalsContact CH2-CG1 3.44Å; W442-I446 HydrophobicContact CZ2-CB 3.9Å; W442-I446 HydrophobicContact CZ2-CD1 4.17Å; W442-I446 HydrophobicContact CZ2-CG1 3.64Å; W442-I446 HydrophobicContact CZ2-CG2 4.12Å; W442-I446 HydrophobicContact CZ3-CB 3.83Å; W442-I446 HydrophobicContact CZ3-CD1 3.79Å; W442-I446 HydrophobicContact CZ3-CG1 3.93Å; W442-I446 WeakPolarHBondContact O-CB 3Å; W442-I446 VanDerWaalsContact O-CG2 3.27Å; W442-I446 WeakPolarHBondContact O-CG2 3.41Å; W442-I446 PolarHBondContact O-N 2.77Å; I446-Q448 VanDerWaalsContact C-N 3.34Å
447	Y	97.3	Very high	96.7	Very high	54 Å²	54	36.9 Å²	36.9	21%	0.212	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	8.2	-179	-74.2	-62.6	0	0	0	114.7	N297 R298 D410 Q411 L443	N297-Y447 HydrophobicContact CB-CD1 3.96Å; R298-Y447 VanDerWaalsContact NH1-CD1 3.34Å; D410-Y447 WeakPolarHBondContact O-CE2 3.06Å; D410-Y447 PolarHBondContact O-OH 3.44Å; Q411-Y447 VanDerWaalsContact C-CD2 3.44Å; Q411-Y447 WeakPolarHBondContact O-CB 2.81Å; L443-Y447 HydrophobicContact CD2-CD2 4.48Å; L443-Y447 HydrophobicContact CD2-CE2 3.85Å; L443-Y447 VanDerWaalsContact O-CD2 3.26Å; L443-Y447 WeakPolarHBondContact O-CD2 3Å; L443-Y447 PolarHBondContact O-N 3.31Å
448	Q	96.7	Very high	97.2	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.009	17%	0.169	C	C	.	.			trans	-70.5	145.1	179.2	-58.5	178.7	-21.4	0	0	111.7	R298 P366 T401 V402 T403 F444 R445 I446	R298-Q448 WeakPolarHBondContact CA-O 3.47Å; P366-Q448 HydrophobicContact CB-CB 4.22Å; T401-Q448 HydrophobicContact CG2-CB 3.87Å; T401-Q448 VanDerWaalsContact CG2-CD 3.46Å; T401-Q448 HydrophobicContact CG2-CG 4.09Å; V402-Q448 WeakPolarHBondContact O-CA 3.26Å; T403-Q448 HydrophobicContact CG2-CG 3.9Å; F444-Q448 WeakPolarHBondContact O-CG 3.49Å; F444-Q448 PolarHBondContact O-NE2 3.29Å; R445-Q448 VanDerWaalsContact O-CG 3.25Å; R445-Q448 WeakPolarHBondContact O-CG 3.33Å; R445-Q448 PolarHBondContact O-OE1 3Å; I446-Q448 VanDerWaalsContact C-N 3.34Å
449	D	98.2	Very high	97.5	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.027	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	150	168.5	-54.6	-31.2	0	0	0	109.6	R298 L299 L301 V402 H404	R298-D449 PolarHBondContact N-OD1 2.85Å; L299-D449 HydrophobicContact CB-CB 3.97Å; L299-D449 HydrophobicContact CG-CB 4.5Å; L299-D449 WeakPolarHBondContact CG-OD1 3.3Å; L299-D449 PolarHBondContact N-OD1 3.25Å; L301-D449 HydrophobicContact CD1-CB 4.33Å; L301-D449 HydrophobicContact CD2-CB 3.89Å; L301-D449 HydrophobicContact CG-CB 4.13Å; V402-D449 HydrophobicContact CB-CB 4.24Å; V402-D449 PolarHBondContact N-O 3.04Å; V402-D449 PolarHBondContact O-N 3.36Å; H404-D449 IonicContact CD2-OD2 2.71Å; H404-D449 IonicContact CE1-OD2 3.8Å; H404-D449 IonicContact NE2-OD2 3Å; H404-D449 PolarHBondContact NE2-OD2 2.89Å
450	T	98.6	Very high	97.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	127.1	-168.6	-60.7	0	0	0	0	110.7	L299 I300 L301 M344 W393 N395 N400 V452	L299-T450 PolarHBondContact O-N 2.81Å; I300-T450 WeakPolarHBondContact CA-O 3.49Å; L301-T450 PolarHBondContact N-O 3.43Å; M344-T450 WeakPolarHBondContact CE-OG1 3.43Å; W393-T450 HydrophobicContact CH2-CG2 4.24Å; W393-T450 HydrophobicContact CZ3-CG2 4.12Å; N395-T450 HydrophobicContact CB-CG2 3.87Å; N400-T450 WeakPolarHBondContact O-CA 3.39Å; T450-V452 HydrophobicContact CG2-CG2 4.4Å
451	K	98.7	Very high	97.7	Very high	97 Å²	97	28 Å²	28	42%	0.422	14%	0.144	S	C	.	.			trans	-83.3	115.2	160	-174	178.2	-179.1	179	0	108	L301 N302 N400 D453	L301-K451 HydrophobicContact CB-CB 4.34Å; L301-K451 HydrophobicContact CD1-CB 4.43Å; N302-K451 HydrophobicContact CB-CG 4.3Å; N400-K451 HydrophobicContact CB-CB 4.05Å; N400-K451 VanDerWaalsContact CB-O 3.3Å; N400-K451 WeakPolarHBondContact CB-O 3.36Å; N400-K451 PolarHBondContact ND2-O 2.78Å; N400-K451 VanDerWaalsContact ND2-O 3.11Å; N400-K451 PolarHBondContact O-N 3.3Å; K451-D453 PolarHBondContact O-N 2.69Å
452	V	98.7	Very high	97.6	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.024	17%	0.169	C	C	.	.			trans	-75.8	127.6	-175.7	173.8	0	0	0	0	109.6	I300 N302 L306 L364 W393 T450 I454 L457	I300-V452 HydrophobicContact CG2-CG2 3.85Å; N302-V452 PolarHBondContact ND2-O 3.26Å; N302-V452 PolarHBondContact OD1-N 3.09Å; L306-V452 HydrophobicContact CD1-CG1 4.37Å; L364-V452 HydrophobicContact CD1-CG2 4.11Å; W393-V452 HydrophobicContact CH2-CG1 4.27Å; W393-V452 HydrophobicContact CZ2-CG1 4.47Å; W393-V452 HydrophobicContact CZ3-CG1 4.47Å; W393-V452 HydrophobicContact CZ3-CG2 4.33Å; T450-V452 HydrophobicContact CG2-CG2 4.4Å; V452-I454 PolarHBondContact O-N 3Å; V452-I454 VanDerWaalsContact O-N 3.11Å; V452-L457 HydrophobicContact CG1-CB 4.12Å; V452-L457 HydrophobicContact CG1-CD2 3.66Å
453	D	98.6	Very high	97.5	Very high	44 Å²	44	40.5 Å²	40.5	24%	0.235	19%	0.191	C	C	.	.			trans	-74.2	97.9	165.6	-174.8	-57.9	0	0	0	108.6	W393 M397 K451 P455 S456 L457	W393-D453 HydrophobicContact CZ2-CB 4.01Å; M397-D453 HydrophobicContact CE-CB 3.47Å; M397-D453 VanDerWaalsContact CE-CB 3.47Å; M397-D453 WeakPolarHBondContact CE-OD2 3.34Å; K451-D453 PolarHBondContact O-N 2.69Å; D453-P455 VanDerWaalsContact OD1-CD 3.28Å; D453-P455 WeakPolarHBondContact OD1-CD 3.36Å; D453-S456 PolarHBondContact O-N 3.31Å; D453-S456 WeakPolarHBondContact OD1-CB 3.5Å; D453-S456 PolarHBondContact OD1-N 2.75Å; D453-L457 WeakPolarHBondContact O-CB 3.28Å; D453-L457 PolarHBondContact O-N 3.08Å
454	I	98.5	Very high	97.2	Very high	28 Å²	28	42.7 Å²	42.7	14%	0.144	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-49.9	-175.5	-67.6	171.1	0	0	0	111.5	E305 A309 V452 S456 L457 I458	E305-I454 HydrophobicContact CB-CD1 3.57Å; A309-I454 HydrophobicContact CB-CD1 4.24Å; A309-I454 HydrophobicContact CB-CG2 3.32Å; V452-I454 PolarHBondContact O-N 3Å; V452-I454 VanDerWaalsContact O-N 3.11Å; I454-S456 VanDerWaalsContact C-N 3.33Å; I454-S456 PolarHBondContact O-N 2.78Å; I454-L457 PolarHBondContact O-N 3.3Å; I454-I458 HydrophobicContact CG2-CG1 4.16Å; I454-I458 WeakPolarHBondContact O-CG1 3.36Å; I454-I458 PolarHBondContact O-N 2.89Å
455	P	98.2	Very high	96.8	Very high	97 Å²	97	42.9 Å²	42.9	63%	0.63	21%	0.206	S	C	*	.	H	α-helix	trans	-54.4	-45.6	177.3	-27.9	35.4	0	0	0	113.8	D453 I458 Q459	D453-P455 VanDerWaalsContact OD1-CD 3.28Å; D453-P455 WeakPolarHBondContact OD1-CD 3.36Å; P455-I458 PolarHBondContact O-N 3.24Å; P455-Q459 WeakPolarHBondContact O-CB 3.48Å; P455-Q459 PolarHBondContact O-N 2.71Å
456	S	98.4	Very high	95.8	Very high	44 Å²	44	51.7 Å²	51.7	31%	0.308	24%	0.244	S	C	.	.	H	α-helix	trans	-64.2	-42.3	178.4	179.6	0	0	0	0	111.8	W393 D453 I454 T460	W393-S456 PolarHBondContact NE1-OG 2.85Å; D453-S456 PolarHBondContact O-N 3.31Å; D453-S456 WeakPolarHBondContact OD1-CB 3.5Å; D453-S456 PolarHBondContact OD1-N 2.75Å; I454-S456 VanDerWaalsContact C-N 3.33Å; I454-S456 PolarHBondContact O-N 2.78Å; S456-T460 WeakPolarHBondContact O-CB 3.27Å; S456-T460 PolarHBondContact O-N 2.76Å; S456-T460 PolarHBondContact O-OG1 2.89Å
457	L	98.6	Very high	94.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-51.4	176.2	176.2	59.3	0	0	0	111.5	L306 V362 L364 W393 V452 D453 I454 Q459 T460 I461	L306-L457 HydrophobicContact CD1-CD2 3.52Å; V362-L457 HydrophobicContact CG1-CD1 3.85Å; L364-L457 HydrophobicContact CD2-CD1 3.55Å; L364-L457 HydrophobicContact CD2-CD2 4.02Å; L364-L457 HydrophobicContact CD2-CG 4.45Å; W393-L457 HydrophobicContact CB-CD1 3.6Å; W393-L457 HydrophobicContact CD2-CD1 4.31Å; W393-L457 HydrophobicContact CG-CB 4.32Å; W393-L457 HydrophobicContact CG-CD1 3.68Å; V452-L457 HydrophobicContact CG1-CB 4.12Å; V452-L457 HydrophobicContact CG1-CD2 3.66Å; D453-L457 WeakPolarHBondContact O-CB 3.28Å; D453-L457 PolarHBondContact O-N 3.08Å; I454-L457 PolarHBondContact O-N 3.3Å; L457-Q459 VanDerWaalsContact C-N 3.3Å; L457-Q459 PolarHBondContact O-N 2.73Å; L457-T460 WeakPolarHBondContact O-CA 3.47Å; L457-T460 WeakPolarHBondContact O-CB 3.45Å; L457-T460 PolarHBondContact O-N 3.13Å; L457-I461 HydrophobicContact CD1-CD1 3.97Å; L457-I461 HydrophobicContact CD1-CG1 4.13Å; L457-I461 HydrophobicContact CG-CD1 3.94Å; L457-I461 HydrophobicContact CG-CG1 4.5Å; L457-I461 WeakPolarHBondContact O-CG1 3.42Å; L457-I461 PolarHBondContact O-N 3.36Å
458	I	97.9	Very high	93.2	Very high	18 Å²	18	58.5 Å²	58.5	9%	0.092	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-43.9	178.9	-66.2	-48.7	0	0	0	111	L310 E313 F314 I454 P455 T460 I461 R462	L310-I458 HydrophobicContact CD2-CD1 3.85Å; E313-I458 HydrophobicContact CB-CD1 4.18Å; E313-I458 HydrophobicContact CG-CD1 4.04Å; E313-I458 HydrophobicContact CG-CG1 4.48Å; E313-I458 HydrophobicContact CG-CG2 3.68Å; F314-I458 HydrophobicContact CE2-CD1 4.18Å; I454-I458 HydrophobicContact CG2-CG1 4.16Å; I454-I458 WeakPolarHBondContact O-CG1 3.36Å; I454-I458 PolarHBondContact O-N 2.89Å; P455-I458 PolarHBondContact O-N 3.24Å; I458-T460 VanDerWaalsContact C-N 3.26Å; I458-T460 PolarHBondContact O-N 2.75Å; I458-I461 HydrophobicContact CD1-CD1 4.46Å; I458-I461 PolarHBondContact O-N 2.99Å; I458-R462 PolarHBondContact O-N 2.05Å
459	Q	97.1	Very high	91.9	Very high	108 Å²	108	58.4 Å²	58.4	51%	0.505	28%	0.284	S	S	.	.	H	α-helix	trans	-59	-40.9	175.4	-168.2	-172.5	13.3	0	0	111.4	P455 L457 R462 R463	P455-Q459 WeakPolarHBondContact O-CB 3.48Å; P455-Q459 PolarHBondContact O-N 2.71Å; L457-Q459 VanDerWaalsContact C-N 3.3Å; L457-Q459 PolarHBondContact O-N 2.73Å; Q459-R462 PolarHBondContact O-N 3.32Å; Q459-R463 VanDerWaalsContact NE2-NH2 3.18Å; Q459-R463 WeakPolarHBondContact O-CG 3.38Å; Q459-R463 PolarHBondContact O-N 2.99Å
460	T	97.9	Very high	90.3	Very high	21 Å²	21	58.5 Å²	58.5	13%	0.129	29%	0.286	C	S	.	.	H	α-helix	trans	-66.1	-42.4	179.3	-59.9	0	0	0	0	111.8	V391 A392 W393 S456 L457 I458 R463	V391-T460 HydrophobicContact CG1-CG2 3.75Å; A392-T460 WeakPolarHBondContact O-CG2 3.47Å; W393-T460 HydrophobicContact CB-CG2 4.38Å; S456-T460 WeakPolarHBondContact O-CB 3.27Å; S456-T460 PolarHBondContact O-N 2.76Å; S456-T460 PolarHBondContact O-OG1 2.89Å; L457-T460 WeakPolarHBondContact O-CA 3.47Å; L457-T460 WeakPolarHBondContact O-CB 3.45Å; L457-T460 PolarHBondContact O-N 3.13Å; I458-T460 VanDerWaalsContact C-N 3.26Å; I458-T460 PolarHBondContact O-N 2.75Å; T460-R463 PolarHBondContact O-N 2.94Å
461	I	97.1	Very high	88.7	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.7	-47.3	176.1	-61.2	166.1	0	0	0	110.5	L310 F314 M340 V362 V391 L457 I458 R463 V464 V465	L310-I461 HydrophobicContact CD2-CD1 3.99Å; F314-I461 HydrophobicContact CE1-CG2 4.07Å; F314-I461 HydrophobicContact CE2-CD1 4.3Å; F314-I461 HydrophobicContact CE2-CG2 4.18Å; F314-I461 HydrophobicContact CZ-CB 4.06Å; F314-I461 HydrophobicContact CZ-CD1 4.46Å; F314-I461 HydrophobicContact CZ-CG2 3.39Å; M340-I461 HydrophobicContact CE-CG2 4.07Å; M340-I461 HydrophobicContact SD-CD1 4.48Å; V362-I461 HydrophobicContact CG1-CD1 4.12Å; V362-I461 HydrophobicContact CG1-CG1 4.07Å; V362-I461 HydrophobicContact CG2-CD1 4.14Å; V362-I461 HydrophobicContact CG2-CG1 4.06Å; V391-I461 HydrophobicContact CG1-CG1 4.16Å; L457-I461 HydrophobicContact CD1-CD1 3.97Å; L457-I461 HydrophobicContact CD1-CG1 4.13Å; L457-I461 HydrophobicContact CG-CD1 3.94Å; L457-I461 HydrophobicContact CG-CG1 4.5Å; L457-I461 WeakPolarHBondContact O-CG1 3.42Å; L457-I461 PolarHBondContact O-N 3.36Å; I458-I461 HydrophobicContact CD1-CD1 4.46Å; I458-I461 PolarHBondContact O-N 2.99Å; I461-R463 PolarHBondContact O-N 2.86Å; I461-V464 PolarHBondContact O-N 3.34Å; I461-V465 HydrophobicContact CG2-CB 4.06Å; I461-V465 HydrophobicContact CG2-CG2 3.87Å; I461-V465 WeakPolarHBondContact O-CB 3.38Å; I461-V465 PolarHBondContact O-N 3.38Å
462	R	94.6	Very high	87.2	Confident	144 Å²	144	65.2 Å²	65.2	54%	0.543	32%	0.319	S	S	.	.	H	α-helix	trans	-59.5	-28	-179.9	-81	-173.3	170.7	175.8	1.7	114.2	E313 I458 Q459 V464	E313-R462 IonicContact OE1-CZ 3.34Å; E313-R462 IonicContact OE1-NE 2.72Å; E313-R462 PolarHBondContact OE1-NE 2.87Å; E313-R462 IonicContact OE1-NH2 2.64Å; E313-R462 PolarHBondContact OE1-NH2 2.9Å; E313-R462 IonicContact OE2-CZ 3.38Å; E313-R462 IonicContact OE2-NE 3.02Å; E313-R462 IonicContact OE2-NH2 2.86Å; E313-R462 PolarHBondContact OE2-NH2 3.49Å; I458-R462 PolarHBondContact O-N 2.05Å; Q459-R462 PolarHBondContact O-N 3.32Å; R462-V464 PolarHBondContact O-N 2.94Å
463	R	94.3	Very high	85.2	Confident	153 Å²	153	74.8 Å²	74.8	58%	0.577	36%	0.36	S	S	*	.	H	α-helix	trans	-63.8	-31.6	176.1	-72.2	173.9	-166	146.8	3.8	112.3	Q459 T460 I461	Q459-R463 VanDerWaalsContact NE2-NH2 3.18Å; Q459-R463 WeakPolarHBondContact O-CG 3.38Å; Q459-R463 PolarHBondContact O-N 2.99Å; T460-R463 PolarHBondContact O-N 2.94Å; I461-R463 PolarHBondContact O-N 2.86Å
464	V	90.8	Very high	83.2	Confident	59 Å²	59	77.6 Å²	77.6	36%	0.358	37%	0.372	S	S	.	.	H	α-helix	trans	-100.4	-42.2	-177.4	-178.8	0	0	0	0	111.2	Q389 V391 I461 R462 K466	Q389-V464 HydrophobicContact CB-CG1 4.44Å; Q389-V464 PolarHBondContact NE2-O 2.97Å; V391-V464 HydrophobicContact CG2-CB 3.8Å; V391-V464 HydrophobicContact CG2-CG1 4.01Å; V391-V464 HydrophobicContact CG2-CG2 4.01Å; I461-V464 PolarHBondContact O-N 3.34Å; R462-V464 PolarHBondContact O-N 2.94Å; V464-K466 PolarHBondContact O-N 3.45Å
465	V	88.7	Confident	81.2	Confident	7 Å²	7	84.6 Å²	84.6	4%	0.042	40%	0.401	C	S	.	.			trans	-96.3	91.2	-175.3	-177.9	0	0	0	0	108.9	T360 I461 G467 P469	T360-V465 HydrophobicContact CG2-CG2 3.78Å; I461-V465 HydrophobicContact CG2-CB 4.06Å; I461-V465 HydrophobicContact CG2-CG2 3.87Å; I461-V465 WeakPolarHBondContact O-CB 3.38Å; I461-V465 PolarHBondContact O-N 3.38Å; V465-G467 VanDerWaalsContact C-N 3.26Å; V465-G467 WeakPolarHBondContact CG1-O 3.14Å; V465-G467 PolarHBondContact O-N 3.44Å; V465-P469 HydrophobicContact CG1-CB 4.14Å; V465-P469 HydrophobicContact CG1-CG 4.46Å
466	K	75.6	Confident	78.9	Confident	196 Å²	196	89.7 Å²	89.7	85%	0.852	41%	0.408	S	S	*	.			trans	-81.4	10.3	-176.6	-64.3	-175.2	177.3	-177.5	0	114.9	V464	V464-K466 PolarHBondContact O-N 3.45Å
467	G	71.2	Confident	76.9	Confident	47 Å²	47	92.9 Å²	92.9	49%	0.485	43%	0.426	S	S	.	.	S	Bend	trans	-170.4	-167	-177.2	0	0	0	0	0	110.6	V465	V465-G467 VanDerWaalsContact C-N 3.26Å; V465-G467 WeakPolarHBondContact CG1-O 3.14Å; V465-G467 PolarHBondContact O-N 3.44Å
468	R	68.2	Low	75.2	Confident	155 Å²	155	97 Å²	97	59%	0.585	45%	0.451	S	S	*	.			trans	-63.4	128.4	175.3	-90.9	-172.1	175.7	172.5	-0.3	111.1	Q315	Q315-R468 PolarHBondContact O-NH2 2.82Å; Q315-R468 VanDerWaalsContact O-NH2 3.15Å
469	P	69.8	Low	73.8	Confident	0 Å²	0	98.1 Å²	98.1	0%	0	47%	0.467	C	S	.	.			trans	-68.7	140.7	171.4	29.6	-32.2	0	0	0	108.6	F314 M316 S339 M340 V465	F314-P469 HydrophobicContact CD1-CG 4.42Å; M316-P469 HydrophobicContact CE-CG 4.47Å; M316-P469 HydrophobicContact SD-CG 3.81Å; S339-P469 WeakPolarHBondContact CB-O 3.33Å; M340-P469 HydrophobicContact CE-CB 4.15Å; M340-P469 HydrophobicContact CE-CG 3.69Å; V465-P469 HydrophobicContact CG1-CB 4.14Å; V465-P469 HydrophobicContact CG1-CG 4.46Å
470	G	66.1	Low	73	Confident	7 Å²	7	97.5 Å²	97.5	7%	0.072	47%	0.466	C	S	.	.			trans	168.3	170.4	179.8	0	0	0	0	0	115.1	G358 R472	G358-G470 CarbonylContact C-O 3.57Å; G358-G470 VanDerWaalsContact C-O 3.27Å; G470-R472 PolarHBondContact O-N 3.22Å
471	P	64.6	Low	72.5	Confident	80 Å²	80	102.9 Å²	102.9	52%	0.519	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-60.5	123.1	-177	3.8	-3.3	0	0	0	111.2	P356 R357	P356-P471 HydrophobicContact CB-CB 4.33Å; R357-P471 CarbonylContact O-C 3.55Å; R357-P471 VanDerWaalsContact O-CA 3.22Å; R357-P471 WeakPolarHBondContact O-CA 3.09Å
472	R	66.4	Low	72.3	Confident	157 Å²	157	103.1 Å²	103.1	59%	0.592	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-99.3	143.6	176.3	-68.3	-175	-178.4	-179	2.5	110.9	R357 G470 Q474	R357-R472 PolarHBondContact O-N 2.9Å; G470-R472 PolarHBondContact O-N 3.22Å; R472-Q474 PolarHBondContact O-N 3.39Å
473	K	57.5	Low	72.2	Confident	206 Å²	206	96.9 Å²	96.9	90%	0.896	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-54.5	129.3	174.4	-75.6	-170.8	178.6	-178.2	0	110	K475	K473-K475 PolarHBondContact O-N 3.11Å; K473-K475 VanDerWaalsContact O-N 3.12Å
474	Q	56.7	Low	72.3	Confident	103 Å²	103	94.1 Å²	94.1	48%	0.481	46%	0.46	S	S	.	.			trans	-54.7	115.1	177.2	177.6	175.1	6.2	0	0	110.1	R357 R472 W476	R357-Q474 VanDerWaalsContact NH1-CG 3.33Å; R357-Q474 VanDerWaalsContact NH1-NE2 3.17Å; R472-Q474 PolarHBondContact O-N 3.39Å; Q474-W476 VanDerWaalsContact NE2-NE1 3.14Å
475	K	56.1	Low	72.5	Confident	175 Å²	175	91.7 Å²	91.7	76%	0.761	45%	0.445	S	S	*	.			trans	-89.7	113.1	158.9	-75.5	-176.9	178.6	177.3	0	106.8	K473 T477	K473-K475 PolarHBondContact O-N 3.11Å; K473-K475 VanDerWaalsContact O-N 3.12Å; K475-T477 HydrophobicContact CB-CG2 4.48Å; K475-T477 PolarHBondContact O-N 2.8Å
476	W	49.9	Very low	72.8	Confident	203 Å²	203	96.4 Å²	96.4	77%	0.769	46%	0.462	S	S	*	.			trans	-63	106.5	168.4	-92.2	74.7	0	0	0	108.6	Q474 V478	Q474-W476 VanDerWaalsContact NE2-NE1 3.14Å; W476-V478 HydrophobicContact CE3-CG2 3.62Å; W476-V478 HydrophobicContact CZ3-CG2 3.81Å
477	T	56.3	Low	73.7	Confident	111 Å²	111	92 Å²	92	68%	0.681	45%	0.445	S	S	*	.			trans	-114	71.3	171.5	55.1	0	0	0	0	108.7	K475	K475-T477 HydrophobicContact CB-CG2 4.48Å; K475-T477 PolarHBondContact O-N 2.8Å
478	V	62.4	Low	74.9	Confident	87 Å²	87	90.9 Å²	90.9	53%	0.527	43%	0.43	S	S	.	.			trans	-70.9	127.9	163	175.9	0	0	0	0	106.8	W476 L480	W476-V478 HydrophobicContact CE3-CG2 3.62Å; W476-V478 HydrophobicContact CZ3-CG2 3.81Å; V478-L480 HydrophobicContact CB-CD2 4.47Å; V478-L480 HydrophobicContact CG1-CD2 3.84Å; V478-L480 HydrophobicContact CG1-CG 4.35Å; V478-L480 PolarHBondContact O-N 2.99Å
479	G	67.6	Low	76.1	Confident	41 Å²	41	90.6 Å²	90.6	42%	0.423	43%	0.429	S	S	.	.			trans	-66.3	102.9	170.7	0	0	0	0	0	109.2	Y481	G479-Y481 VanDerWaalsContact O-CD2 3.31Å; G479-Y481 WeakPolarHBondContact O-CD2 3.46Å; G479-Y481 WeakPolarHBondContact O-CE2 3.42Å
480	L	81.4	Confident	77.3	Confident	95 Å²	95	92.4 Å²	92.4	50%	0.497	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-96.7	119.1	176.1	-61.1	172.8	0	0	0	108.3	V478 L515 L568	V478-L480 HydrophobicContact CB-CD2 4.47Å; V478-L480 HydrophobicContact CG1-CD2 3.84Å; V478-L480 HydrophobicContact CG1-CG 4.35Å; V478-L480 PolarHBondContact O-N 2.99Å; L480-L515 HydrophobicContact CB-CD1 4.44Å; L480-L515 HydrophobicContact CB-CD2 3.9Å; L480-L515 HydrophobicContact CD1-CD2 3.45Å; L480-L515 VanDerWaalsContact CD1-CD2 3.45Å; L480-L515 HydrophobicContact CG-CD2 4.2Å; L480-L568 WeakPolarHBondContact O-CD1 3.16Å
481	Y	88.1	Confident	78.6	Confident	134 Å²	134	99 Å²	99	53%	0.525	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-98.6	151	-174.1	-65.1	-94.9	0	0	0	111.9	G479 N511 L568	G479-Y481 VanDerWaalsContact O-CD2 3.31Å; G479-Y481 WeakPolarHBondContact O-CD2 3.46Å; G479-Y481 WeakPolarHBondContact O-CE2 3.42Å; Y481-N511 PolarHBondContact O-ND2 2.94Å; Y481-L568 HydrophobicContact CD1-CB 4.09Å; Y481-L568 HydrophobicContact CD1-CD2 4.29Å; Y481-L568 HydrophobicContact CE1-CB 4.32Å; Y481-L568 HydrophobicContact CE1-CD2 3.74Å
482	P	92.3	Very high	79.7	Confident	5 Å²	5	97 Å²	97	3%	0.032	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-63.3	146.5	171.7	-2.5	10.9	0	0	0	111.6	P509 C562 F564 L568 G570 P571	P482-P509 HydrophobicContact CB-CG 4.23Å; P482-C562 HydrophobicContact CB-CB 3.77Å; P482-C562 HydrophobicContact CG-CB 4.27Å; P482-C562 WeakPolarHBondContact CG-O 3.09Å; P482-F564 VanDerWaalsContact CA-CZ 3.48Å; P482-F564 HydrophobicContact CB-CD1 4.07Å; P482-F564 HydrophobicContact CB-CD2 4.17Å; P482-F564 HydrophobicContact CB-CE1 3.61Å; P482-F564 HydrophobicContact CB-CE2 3.72Å; P482-F564 HydrophobicContact CB-CG 4.33Å; P482-F564 HydrophobicContact CB-CZ 3.45Å; P482-F564 VanDerWaalsContact CB-CZ 3.45Å; P482-F564 HydrophobicContact CG-CB 4.36Å; P482-F564 HydrophobicContact CG-CD1 3.7Å; P482-F564 HydrophobicContact CG-CD2 3.72Å; P482-F564 HydrophobicContact CG-CE1 3.81Å; P482-F564 HydrophobicContact CG-CE2 3.82Å; P482-F564 HydrophobicContact CG-CG 3.66Å; P482-F564 HydrophobicContact CG-CZ 3.88Å; P482-F564 VanDerWaalsContact N-CE2 3.35Å; P482-L568 WeakPolarHBondContact CD-O 3.49Å; P482-L568 WeakPolarHBondContact CG-O 3.3Å; P482-G570 VanDerWaalsContact O-CA 3.3Å; P482-G570 WeakPolarHBondContact O-CA 3.09Å; P482-P571 VanDerWaalsContact O-CD 3.23Å; P482-P571 WeakPolarHBondContact O-CD 3.48Å
483	G	92.8	Very high	80.6	Confident	14 Å²	14	91.8 Å²	91.8	14%	0.144	45%	0.448	C	S	.	.			trans	-74.8	-179.2	162.7	0	0	0	0	0	112.3	P509 N511	G483-P509 WeakPolarHBondContact O-CB 3.45Å; G483-P509 WeakPolarHBondContact O-CG 3.27Å; G483-N511 PolarHBondContact N-ND2 3.21Å; G483-N511 PolarHBondContact N-OD1 3.01Å
484	K	95.5	Very high	81.8	Confident	95 Å²	95	84.1 Å²	84.1	41%	0.413	42%	0.418	S	S	.	.			trans	-58.5	144.8	170.6	-68.8	-174.3	170.7	-170.3	0	110.1	P509 P571 F572 D574	K484-P509 WeakPolarHBondContact O-CA 3.34Å; K484-P571 HydrophobicContact CB-CG 4.35Å; K484-P571 HydrophobicContact CG-CB 3.99Å; K484-P571 HydrophobicContact CG-CG 3.51Å; K484-F572 VanDerWaalsContact CE-O 3.29Å; K484-F572 WeakPolarHBondContact CE-O 3.4Å; K484-D574 IonicContact NZ-OD1 2.7Å; K484-D574 PolarHBondContact NZ-OD1 2.82Å
485	V	95.3	Very high	82.6	Confident	7 Å²	7	84 Å²	84	4%	0.042	42%	0.418	C	S	.	.			trans	-63.7	152.9	162.9	-58.2	0	0	0	0	109.2	W506 Q507 P509 Y522 V560 C562 A573	V485-W506 HydrophobicContact CB-CB 4.18Å; V485-W506 HydrophobicContact CB-CG 4.1Å; V485-W506 HydrophobicContact CG1-CG 4.37Å; V485-W506 HydrophobicContact CG2-CB 4.11Å; V485-W506 HydrophobicContact CG2-CG 4.18Å; V485-Q507 WeakPolarHBondContact CB-O 3.43Å; V485-P509 HydrophobicContact CG1-CG 4.44Å; V485-Y522 HydrophobicContact CG1-CD1 3.81Å; V485-Y522 HydrophobicContact CG1-CE1 3.87Å; V485-V560 HydrophobicContact CG1-CG1 4.15Å; V485-V560 HydrophobicContact CG2-CB 3.81Å; V485-V560 HydrophobicContact CG2-CG1 3.71Å; V485-C562 HydrophobicContact CG1-CB 4.01Å; V485-A573 HydrophobicContact CG2-CB 3.46Å; V485-A573 VanDerWaalsContact CG2-CB 3.46Å
486	R	95.4	Very high	83.2	Confident	107 Å²	107	78.7 Å²	78.7	40%	0.404	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	153.5	-172.8	-59.9	-173.7	-62.7	150.1	13.5	110.6	A488 Q507 I508	R486-A488 PolarHBondContact O-N 2.02Å; R486-A488 VanDerWaalsContact O-N 3.13Å; R486-Q507 HydrophobicContact CB-CB 4.1Å; R486-Q507 PolarHBondContact N-O 2.73Å; R486-Q507 WeakPolarHBondContact O-CA 3.39Å; R486-Q507 WeakPolarHBondContact O-CB 3.34Å; R486-Q507 PolarHBondContact O-N 2.64Å; R486-I508 PolarHBondContact NE-O 2.82Å
487	E	94.8	Very high	84	Confident	104 Å²	104	73.3 Å²	73.3	49%	0.486	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.3	45.1	174.8	-60.1	-174.4	-141.6	0	0	113.5	R489 Q507	E487-R489 PolarHBondContact O-N 3.33Å; E487-R489 IonicContact OE2-NH2 3.31Å; E487-R489 PolarHBondContact OE2-NH2 3.44Å; E487-R489 VanDerWaalsContact OE2-NH2 3.12Å; E487-Q507 HydrophobicContact CB-CG 4.3Å; E487-Q507 PolarHBondContact OE1-NE2 3.16Å; E487-Q507 PolarHBondContact OE2-NE2 2.77Å; E487-Q507 VanDerWaalsContact OE2-NE2 3.09Å
488	A	94.9	Very high	84.6	Confident	22 Å²	22	72.6 Å²	72.6	18%	0.182	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	134.6	176.2	0	0	0	0	0	109.1	R486 S505 W506 L576	R486-A488 PolarHBondContact O-N 2.02Å; R486-A488 VanDerWaalsContact O-N 3.13Å; A488-S505 CarbonylContact C-O 3.55Å; A488-S505 VanDerWaalsContact CA-O 3.28Å; A488-S505 WeakPolarHBondContact CA-O 3.42Å; A488-W506 HydrophobicContact CB-CB 4.04Å; A488-L576 HydrophobicContact CB-CD1 3.81Å; A488-L576 HydrophobicContact CB-CD2 4.07Å; A488-L576 HydrophobicContact CB-CG 4.18Å; A488-L576 VanDerWaalsContact O-CD2 3.24Å; A488-L576 WeakPolarHBondContact O-CD2 3.39Å
489	R	95.4	Very high	85.6	Confident	150 Å²	150	73.8 Å²	73.8	57%	0.566	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.1	152.2	-177.2	-60.9	-179.4	-163.7	-167.1	6.1	109.5	E487 V504 S505	E487-R489 PolarHBondContact O-N 3.33Å; E487-R489 IonicContact OE2-NH2 3.31Å; E487-R489 PolarHBondContact OE2-NH2 3.44Å; E487-R489 VanDerWaalsContact OE2-NH2 3.12Å; R489-V504 WeakPolarHBondContact O-CA 3.22Å; R489-S505 PolarHBondContact N-O 2.71Å; R489-S505 PolarHBondContact O-N 3.4Å
490	C	94.4	Very high	86.6	Confident	37 Å²	37	72 Å²	72	25%	0.25	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	150.9	170.4	54.7	0	0	0	0	112	L502 T503 V504 L576 C578	C490-L502 HydrophobicContact CB-CD1 3.98Å; C490-T503 CarbonylContact C-O 3.53Å; C490-T503 WeakPolarHBondContact CA-O 3.35Å; C490-V504 HydrophobicContact CB-CG2 4.27Å; C490-L576 HydrophobicContact CB-CD1 4.5Å; C490-C578 HydrophobicContact CB-CB 3.84Å; C490-C578 WeakPolarHBondContact CB-SG 3.4Å; C490-C578 VanDerWaalsContact SG-CA 3.57Å; C490-C578 WeakPolarHBondContact SG-CB 3.32Å; C490-C578 CovalentContact SG-SG 2.02Å; C490-C578 PolarHBondContact SG-SG 3.12Å
491	Q	92.3	Very high	87.1	Confident	145 Å²	145	72.4 Å²	72.4	68%	0.678	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	128.8	176.1	-68.1	177.4	-7.9	0	0	107.2	T503	Q491-T503 PolarHBondContact N-O 2.71Å; Q491-T503 WeakPolarHBondContact O-CA 3.28Å; Q491-T503 PolarHBondContact O-N 2.93Å
492	A	88.4	Confident	87.3	Confident	40 Å²	40	66 Å²	66	33%	0.331	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	152.3	176.1	0	0	0	0	0	111.3	R501 L502 S579 T580	A492-R501 CarbonylContact C-O 3.57Å; A492-R501 VanDerWaalsContact CA-O 3.23Å; A492-R501 WeakPolarHBondContact CA-O 3.23Å; A492-L502 HydrophobicContact CB-CD1 4.24Å; A492-S579 VanDerWaalsContact CB-O 3.28Å; A492-S579 WeakPolarHBondContact CB-O 3.46Å; A492-T580 HydrophobicContact CB-CG2 3.85Å
493	S	85.9	Confident	87.5	Confident	47 Å²	47	67.1 Å²	67.1	33%	0.329	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	130.7	173.8	61.1	0	0	0	0	109.5	R501	S493-R501 PolarHBondContact N-O 2.89Å; S493-R501 PolarHBondContact O-N 2.93Å
494	V	81.9	Confident	87.6	Confident	44 Å²	44	66.5 Å²	66.5	27%	0.267	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.4	172.8	-169.3	0	0	0	0	109.2	G496 E499 P552 F553 T580	V494-G496 VanDerWaalsContact CG1-O 3.26Å; V494-G496 WeakPolarHBondContact CG1-O 3.46Å; V494-E499 WeakPolarHBondContact CA-O 3.18Å; V494-E499 WeakPolarHBondContact CG1-O 3.45Å; V494-P552 HydrophobicContact CG1-CB 3.93Å; V494-F553 HydrophobicContact CG1-CZ 4.43Å; V494-T580 WeakPolarHBondContact CG2-OXT 3.27Å
495	H	73.4	Confident	87.7	Confident	101 Å²	101	63.8 Å²	63.8	47%	0.468	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	103.6	171.3	-70.1	-63.3	0	0	0	109	E499	H495-E499 PolarHBondContact N-O 2.79Å
496	G	69.2	Low	87.7	Confident	64 Å²	64	64.2 Å²	64.2	66%	0.66	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	-154.9	-177.9	0	0	0	0	0	113.5	V494	V494-G496 VanDerWaalsContact CG1-O 3.26Å; V494-G496 WeakPolarHBondContact CG1-O 3.46Å
497	A	65.6	Low	87.8	Confident	89 Å²	89	62.5 Å²	62.5	74%	0.736	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-5.9	-177.6	0	0	0	0	0	114.1
498	S	70.3	Confident	87.7	Confident	97 Å²	97	60.3 Å²	60.3	68%	0.678	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.7	-14.5	-167.4	56.1	0	0	0	0	115.6
499	E	83.1	Confident	87.8	Confident	112 Å²	112	59.3 Å²	59.3	52%	0.523	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125.7	-177.7	-64.2	-176	-171.8	0	0	111.5	V494 H495	V494-E499 WeakPolarHBondContact CA-O 3.18Å; V494-E499 WeakPolarHBondContact CG1-O 3.45Å; H495-E499 PolarHBondContact N-O 2.79Å
500	A	88.1	Confident	87.7	Confident	4 Å²	4	59.1 Å²	59.1	3%	0.033	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	147.7	172.2	0	0	0	0	0	110.5	I550 P552 T580	A500-I550 HydrophobicContact CB-CG2 3.87Å; A500-P552 HydrophobicContact CB-CB 4.12Å; A500-T580 HydrophobicContact CB-CG2 4.23Å
501	R	92	Very high	87.6	Confident	103 Å²	103	58.6 Å²	58.6	39%	0.389	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.6	175.8	-50.2	-172.1	176.7	164.9	0.6	108.9	A492 S493 T545 F546 T547	A492-R501 CarbonylContact C-O 3.57Å; A492-R501 VanDerWaalsContact CA-O 3.23Å; A492-R501 WeakPolarHBondContact CA-O 3.23Å; S493-R501 PolarHBondContact N-O 2.89Å; S493-R501 PolarHBondContact O-N 2.93Å; R501-T545 HydrophobicContact CB-CG2 3.94Å; R501-F546 WeakPolarHBondContact CA-O 3.15Å; R501-T547 HydrophobicContact CB-CG2 4.47Å; R501-T547 HydrophobicContact CG-CG2 3.95Å
502	L	93.4	Very high	87.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	111	175.8	177.8	60.7	0	0	0	109	C490 A492 V504 L526 T545 F546 I550 Y556 V558 C578 T580	C490-L502 HydrophobicContact CB-CD1 3.98Å; A492-L502 HydrophobicContact CB-CD1 4.24Å; L502-V504 HydrophobicContact CD2-CG2 4.41Å; L502-V504 HydrophobicContact CG-CG2 4.06Å; L502-L526 HydrophobicContact CD2-CD2 3.92Å; L502-T545 WeakPolarHBondContact O-CA 3.3Å; L502-F546 PolarHBondContact N-O 3.06Å; L502-F546 WeakPolarHBondContact O-CD2 3.27Å; L502-F546 PolarHBondContact O-N 3.36Å; L502-I550 HydrophobicContact CB-CD1 4.33Å; L502-I550 HydrophobicContact CB-CG1 4.37Å; L502-I550 HydrophobicContact CB-CG2 4.15Å; L502-Y556 HydrophobicContact CD2-CD2 4.35Å; L502-Y556 HydrophobicContact CD2-CG 4.29Å; L502-V558 HydrophobicContact CD2-CG2 4.2Å; L502-C578 HydrophobicContact CD1-CB 3.59Å; L502-C578 HydrophobicContact CD2-CB 4.26Å; L502-T580 HydrophobicContact CB-CG2 4.24Å
503	T	94.6	Very high	87.5	Confident	28 Å²	28	58 Å²	58	17%	0.172	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.1	174.3	-56.9	0	0	0	0	109.4	C490 Q491 N543 H544 T545	C490-T503 CarbonylContact C-O 3.53Å; C490-T503 WeakPolarHBondContact CA-O 3.35Å; Q491-T503 PolarHBondContact N-O 2.71Å; Q491-T503 WeakPolarHBondContact O-CA 3.28Å; Q491-T503 PolarHBondContact O-N 2.93Å; T503-N543 WeakPolarHBondContact CG2-OD1 3.42Å; T503-H544 WeakPolarHBondContact CA-O 3.25Å; T503-T545 WeakPolarHBondContact OG1-CG2 3.46Å; T503-T545 PolarHBondContact OG1-OG1 3.36Å
504	V	95.8	Very high	87.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.6	177.8	-172.1	0	0	0	0	108.4	R489 C490 L502 W506 N543 H544 F546 V558 V560 L576	R489-V504 WeakPolarHBondContact O-CA 3.22Å; C490-V504 HydrophobicContact CB-CG2 4.27Å; L502-V504 HydrophobicContact CD2-CG2 4.41Å; L502-V504 HydrophobicContact CG-CG2 4.06Å; V504-W506 HydrophobicContact CB-CZ3 4.25Å; V504-W506 HydrophobicContact CG1-CE3 4.01Å; V504-W506 HydrophobicContact CG1-CZ3 3.9Å; V504-N543 WeakPolarHBondContact O-CA 3.2Å; V504-N543 PolarHBondContact O-OD1 2.79Å; V504-H544 PolarHBondContact N-O 2.96Å; V504-H544 PolarHBondContact O-N 2.99Å; V504-F546 HydrophobicContact CB-CE2 4.25Å; V504-F546 HydrophobicContact CG2-CD2 4.16Å; V504-F546 HydrophobicContact CG2-CE2 3.86Å; V504-V558 HydrophobicContact CG1-CG1 4.14Å; V504-V558 HydrophobicContact CG2-CG1 4.21Å; V504-V560 HydrophobicContact CG1-CG2 4.24Å; V504-L576 HydrophobicContact CG1-CD1 4.04Å
505	S	96.7	Very high	87.9	Confident	39 Å²	39	62.9 Å²	62.9	27%	0.273	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.9	-179.7	63.6	0	0	0	0	112.2	A488 R489 Q542	A488-S505 CarbonylContact C-O 3.55Å; A488-S505 VanDerWaalsContact CA-O 3.28Å; A488-S505 WeakPolarHBondContact CA-O 3.42Å; R489-S505 PolarHBondContact N-O 2.71Å; R489-S505 PolarHBondContact O-N 3.4Å; S505-Q542 CarbonylContact C-O 3.56Å; S505-Q542 WeakPolarHBondContact CA-O 3.37Å
506	W	96.9	Very high	88.3	Confident	15 Å²	15	68.5 Å²	68.5	6%	0.057	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	171	178.8	55.2	92.4	0	0	0	111.6	V485 A488 V504 Y522 V524 L539 L541 Q542 V560	V485-W506 HydrophobicContact CB-CB 4.18Å; V485-W506 HydrophobicContact CB-CG 4.1Å; V485-W506 HydrophobicContact CG1-CG 4.37Å; V485-W506 HydrophobicContact CG2-CB 4.11Å; V485-W506 HydrophobicContact CG2-CG 4.18Å; A488-W506 HydrophobicContact CB-CB 4.04Å; V504-W506 HydrophobicContact CB-CZ3 4.25Å; V504-W506 HydrophobicContact CG1-CE3 4.01Å; V504-W506 HydrophobicContact CG1-CZ3 3.9Å; W506-Y522 AromaticContact CD1-CD1 3.99Å; W506-Y522 AromaticContact CD1-CE1 3.91Å; W506-Y522 AromaticContact CE2-CD1 3.82Å; W506-Y522 AromaticContact CE2-CG 3.68Å; W506-Y522 VanDerWaalsContact CZ2-CB 3.47Å; W506-Y522 HydrophobicContact CZ2-CD1 4.13Å; W506-Y522 AromaticContact CZ2-CD2 3.79Å; W506-Y522 HydrophobicContact CZ2-CD2 3.79Å; W506-Y522 AromaticContact CZ2-CG 3.5Å; W506-Y522 HydrophobicContact CZ2-CG 3.5Å; W506-Y522 AromaticContact NE1-CD1 3.05Å; W506-Y522 AromaticContact NE1-CD2 3.74Å; W506-Y522 AromaticContact NE1-CE1 3.24Å; W506-Y522 AromaticContact NE1-CE2 3.92Å; W506-Y522 AromaticContact NE1-CG 3.33Å; W506-Y522 VanDerWaalsContact NE1-CG 3.33Å; W506-Y522 AromaticContact NE1-CZ 3.69Å; W506-V524 HydrophobicContact CH2-CG2 3.68Å; W506-V524 HydrophobicContact CZ2-CG2 4.36Å; W506-V524 HydrophobicContact CZ3-CG2 3.99Å; W506-L539 HydrophobicContact CH2-CD1 3.79Å; W506-L541 VanDerWaalsContact CZ2-O 3.25Å; W506-L541 WeakPolarHBondContact CZ2-O 3.44Å; W506-Q542 HydrophobicContact CD2-CB 4.49Å; W506-Q542 HydrophobicContact CG-CB 4.41Å; W506-Q542 PolarHBondContact N-O 3.05Å; W506-Q542 VanDerWaalsContact O-CB 3.24Å; W506-Q542 WeakPolarHBondContact O-CB 3.46Å; W506-V560 HydrophobicContact CD2-CG1 3.68Å; W506-V560 HydrophobicContact CE3-CG1 3.92Å; W506-V560 HydrophobicContact CE3-CG2 4.06Å; W506-V560 HydrophobicContact CG-CG1 4.15Å; W506-V560 HydrophobicContact CH2-CG1 4.38Å; W506-V560 HydrophobicContact CZ2-CG1 4.12Å; W506-V560 HydrophobicContact CZ3-CG1 4.27Å; W506-V560 HydrophobicContact CZ3-CG2 4.31Å
507	Q	96.1	Very high	88.9	Confident	71 Å²	71	67.1 Å²	67.1	33%	0.332	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	155.2	167.1	-65.3	-178.1	12.1	0	0	111.2	V485 R486 E487	V485-Q507 WeakPolarHBondContact CB-O 3.43Å; R486-Q507 HydrophobicContact CB-CB 4.1Å; R486-Q507 PolarHBondContact N-O 2.73Å; R486-Q507 WeakPolarHBondContact O-CA 3.39Å; R486-Q507 WeakPolarHBondContact O-CB 3.34Å; R486-Q507 PolarHBondContact O-N 2.64Å; E487-Q507 HydrophobicContact CB-CG 4.3Å; E487-Q507 PolarHBondContact OE1-NE2 3.16Å; E487-Q507 PolarHBondContact OE2-NE2 2.77Å; E487-Q507 VanDerWaalsContact OE2-NE2 3.09Å
508	I	94.3	Very high	89.7	Confident	58 Å²	58	74.5 Å²	74.5	30%	0.297	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-63.1	154.3	177.6	65.7	174.4	0	0	0	112.6	R486 L512 Y522 Q542	R486-I508 PolarHBondContact NE-O 2.82Å; I508-L512 HydrophobicContact CB-CD2 3.98Å; I508-L512 HydrophobicContact CD1-CB 4.48Å; I508-L512 HydrophobicContact CD1-CD2 3.92Å; I508-L512 HydrophobicContact CD1-CG 4.45Å; I508-L512 HydrophobicContact CG1-CD2 4.46Å; I508-L512 HydrophobicContact CG2-CD2 4.25Å; I508-Y522 VanDerWaalsContact CG2-OH 3.26Å; I508-Y522 WeakPolarHBondContact CG2-OH 3.08Å; I508-Q542 HydrophobicContact CG2-CG 3.99Å
509	P	95.3	Very high	90.5	Very high	1 Å²	1	72.6 Å²	72.6	1%	0.006	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-56.7	139.2	171.4	-25.7	35.8	0	0	0	112.4	P482 G483 K484 V485 N511 L512 C562	P482-P509 HydrophobicContact CB-CG 4.23Å; G483-P509 WeakPolarHBondContact O-CB 3.45Å; G483-P509 WeakPolarHBondContact O-CG 3.27Å; K484-P509 WeakPolarHBondContact O-CA 3.34Å; V485-P509 HydrophobicContact CG1-CG 4.44Å; P509-N511 VanDerWaalsContact CB-OD1 3.32Å; P509-N511 WeakPolarHBondContact CB-OD1 3.04Å; P509-N511 PolarHBondContact O-N 2.92Å; P509-N511 VanDerWaalsContact O-N 3.16Å; P509-L512 WeakPolarHBondContact O-CB 3.44Å; P509-L512 PolarHBondContact O-N 2.91Å; P509-L512 VanDerWaalsContact O-N 3.12Å; P509-C562 HydrophobicContact CG-CB 3.56Å
510	W	93.3	Very high	91	Very high	147 Å²	147	69 Å²	69	56%	0.557	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-60.8	-28.8	-175.9	72.2	-90.4	0	0	0	113.4	L512 K513 Y514	W510-L512 VanDerWaalsContact C-N 3.35Å; W510-K513 WeakPolarHBondContact O-CE 3.26Å; W510-K513 WeakPolarHBondContact O-CG 3.09Å; W510-Y514 HydrophobicContact CE3-CD2 4.21Å; W510-Y514 AromaticContact CE3-CE2 3.79Å; W510-Y514 HydrophobicContact CE3-CE2 3.79Å; W510-Y514 AromaticContact CZ3-CD2 3.96Å; W510-Y514 HydrophobicContact CZ3-CD2 3.96Å; W510-Y514 AromaticContact CZ3-CE2 3.63Å; W510-Y514 HydrophobicContact CZ3-CE2 3.63Å
511	N	93.1	Very high	91.3	Very high	26 Å²	26	72 Å²	72	14%	0.139	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-80.1	-16.6	-177.5	67.6	-32.1	0	0	0	112.9	Y481 G483 P509 K513 Y514 L515	Y481-N511 PolarHBondContact O-ND2 2.94Å; G483-N511 PolarHBondContact N-ND2 3.21Å; G483-N511 PolarHBondContact N-OD1 3.01Å; P509-N511 VanDerWaalsContact CB-OD1 3.32Å; P509-N511 WeakPolarHBondContact CB-OD1 3.04Å; P509-N511 PolarHBondContact O-N 2.92Å; P509-N511 VanDerWaalsContact O-N 3.16Å; N511-K513 PolarHBondContact O-N 2.71Å; N511-Y514 PolarHBondContact O-N 2.69Å; N511-L515 HydrophobicContact CB-CD1 4.49Å; N511-L515 WeakPolarHBondContact O-CG 3.32Å
512	L	89.8	Confident	91.5	Very high	25 Å²	25	67.2 Å²	67.2	13%	0.131	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-57.1	-34.6	179.6	178.7	57.3	0	0	0	112	I508 P509 W510 Y514 L515 V517 V520 F564	I508-L512 HydrophobicContact CB-CD2 3.98Å; I508-L512 HydrophobicContact CD1-CB 4.48Å; I508-L512 HydrophobicContact CD1-CD2 3.92Å; I508-L512 HydrophobicContact CD1-CG 4.45Å; I508-L512 HydrophobicContact CG1-CD2 4.46Å; I508-L512 HydrophobicContact CG2-CD2 4.25Å; P509-L512 WeakPolarHBondContact O-CB 3.44Å; P509-L512 PolarHBondContact O-N 2.91Å; P509-L512 VanDerWaalsContact O-N 3.12Å; W510-L512 VanDerWaalsContact C-N 3.35Å; L512-Y514 PolarHBondContact O-N 3.2Å; L512-L515 PolarHBondContact O-N 3.32Å; L512-L515 VanDerWaalsContact O-N 3.08Å; L512-V517 HydrophobicContact CD1-CB 3.94Å; L512-V517 HydrophobicContact CD1-CG2 3.67Å; L512-V520 HydrophobicContact CD1-CG2 3.84Å; L512-V520 HydrophobicContact CD2-CG1 4.3Å; L512-V520 HydrophobicContact CD2-CG2 4Å; L512-F564 HydrophobicContact CB-CZ 4.19Å; L512-F564 HydrophobicContact CD1-CD1 4.43Å; L512-F564 HydrophobicContact CD1-CE1 3.61Å; L512-F564 HydrophobicContact CD1-CZ 3.74Å; L512-F564 HydrophobicContact CG-CE1 4.44Å; L512-F564 HydrophobicContact CG-CZ 4.49Å
513	K	89.4	Confident	91.7	Very high	146 Å²	146	68.3 Å²	68.3	64%	0.635	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-64.5	-19.9	178.4	72.1	-172.5	168.4	160.3	0	114.3	W510 N511	W510-K513 WeakPolarHBondContact O-CE 3.26Å; W510-K513 WeakPolarHBondContact O-CG 3.09Å; N511-K513 PolarHBondContact O-N 2.71Å
514	Y	89.2	Confident	91.7	Very high	159 Å²	159	67 Å²	67	62%	0.624	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-97.8	-2.7	178	-57	-66.8	0	0	0	112.7	W510 N511 L512	W510-Y514 HydrophobicContact CE3-CD2 4.21Å; W510-Y514 AromaticContact CE3-CE2 3.79Å; W510-Y514 HydrophobicContact CE3-CE2 3.79Å; W510-Y514 AromaticContact CZ3-CD2 3.96Å; W510-Y514 HydrophobicContact CZ3-CD2 3.96Å; W510-Y514 AromaticContact CZ3-CE2 3.63Å; W510-Y514 HydrophobicContact CZ3-CE2 3.63Å; N511-Y514 PolarHBondContact O-N 2.69Å; L512-Y514 PolarHBondContact O-N 3.2Å
515	L	85.9	Confident	91.7	Very high	36 Å²	36	69.5 Å²	69.5	19%	0.188	31%	0.306	C	S	.	.	S	Bend	trans	-115.9	130.9	-171.3	-61.9	175.6	0	0	0	110.6	L480 N511 L512 V517 F564	L480-L515 HydrophobicContact CB-CD1 4.44Å; L480-L515 HydrophobicContact CB-CD2 3.9Å; L480-L515 HydrophobicContact CD1-CD2 3.45Å; L480-L515 VanDerWaalsContact CD1-CD2 3.45Å; L480-L515 HydrophobicContact CG-CD2 4.2Å; N511-L515 HydrophobicContact CB-CD1 4.49Å; N511-L515 WeakPolarHBondContact O-CG 3.32Å; L512-L515 PolarHBondContact O-N 3.32Å; L512-L515 VanDerWaalsContact O-N 3.08Å; L515-V517 VanDerWaalsContact C-N 3.31Å; L515-V517 HydrophobicContact CB-CG2 3.73Å; L515-V517 PolarHBondContact O-N 3.49Å; L515-F564 HydrophobicContact CD1-CD2 4.32Å; L515-F564 HydrophobicContact CD1-CE2 3.41Å; L515-F564 VanDerWaalsContact CD1-CE2 3.41Å; L515-F564 HydrophobicContact CD1-CZ 4.09Å
516	K	82.4	Confident	91.6	Very high	218 Å²	218	68 Å²	68	95%	0.948	30%	0.295	S	S	*	.			trans	-81.8	77.5	172.8	-66.5	-175.1	179.6	-178	0	109.9
517	V	81.9	Confident	91.5	Very high	35 Å²	35	69 Å²	69	21%	0.212	30%	0.3	C	S	.	.			trans	-93.5	134.5	-179.9	-172.8	0	0	0	0	110.1	L512 L515 E519 V520 F564	L512-V517 HydrophobicContact CD1-CB 3.94Å; L512-V517 HydrophobicContact CD1-CG2 3.67Å; L515-V517 VanDerWaalsContact C-N 3.31Å; L515-V517 HydrophobicContact CB-CG2 3.73Å; L515-V517 PolarHBondContact O-N 3.49Å; V517-E519 WeakPolarHBondContact CG1-O 3.48Å; V517-V520 HydrophobicContact CB-CG2 4.25Å; V517-V520 HydrophobicContact CG1-CG2 3.82Å; V517-F564 HydrophobicContact CB-CD1 4.48Å; V517-F564 HydrophobicContact CB-CG 4.46Å; V517-F564 HydrophobicContact CG1-CB 3.75Å; V517-F564 HydrophobicContact CG1-CD1 3.81Å; V517-F564 HydrophobicContact CG1-CD2 4.48Å; V517-F564 HydrophobicContact CG1-CG 3.76Å; V517-F564 HydrophobicContact CG2-CB 4.46Å; V517-F564 HydrophobicContact CG2-CD1 4.07Å; V517-F564 HydrophobicContact CG2-CD2 3.74Å; V517-F564 HydrophobicContact CG2-CE1 4.23Å; V517-F564 HydrophobicContact CG2-CE2 3.92Å; V517-F564 HydrophobicContact CG2-CG 3.83Å; V517-F564 HydrophobicContact CG2-CZ 4.13Å
518	R	82.7	Confident	91.4	Very high	244 Å²	244	68 Å²	68	92%	0.921	30%	0.295	S	S	*	.	S	Bend	trans	-84.1	-36.5	180	-67.9	-176.4	178.2	-172	-2.3	112.5	N565	R518-N565 PolarHBondContact N-OD1 2.69Å; R518-N565 VanDerWaalsContact N-OD1 3.17Å
519	E	87.4	Confident	91.1	Very high	57 Å²	57	70.9 Å²	70.9	27%	0.266	31%	0.307	S	S	.	.			trans	-138.4	129.6	-176.6	-173.4	-179.8	176.3	0	0	109.9	V517 K521 N565 K566	V517-E519 WeakPolarHBondContact CG1-O 3.48Å; E519-K521 WeakPolarHBondContact OE1-CE 3.37Å; E519-K521 IonicContact OE1-NZ 3.48Å; E519-K521 PolarHBondContact OE1-NZ 2.94Å; E519-N565 PolarHBondContact N-OD1 3.21Å; E519-N565 PolarHBondContact O-N 3.39Å; E519-K566 WeakPolarHBondContact OE2-CE 3.44Å; E519-K566 VanDerWaalsContact OE2-CG 3.24Å; E519-K566 WeakPolarHBondContact OE2-CG 3.36Å
520	V	92.4	Very high	90.8	Very high	38 Å²	38	74.5 Å²	74.5	23%	0.23	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.9	176.7	-177.7	0	0	0	0	108.2	L512 V517 Y522 C562 I563 F564	L512-V520 HydrophobicContact CD1-CG2 3.84Å; L512-V520 HydrophobicContact CD2-CG1 4.3Å; L512-V520 HydrophobicContact CD2-CG2 4Å; V517-V520 HydrophobicContact CB-CG2 4.25Å; V517-V520 HydrophobicContact CG1-CG2 3.82Å; V520-Y522 HydrophobicContact CG1-CE1 4.34Å; V520-Y522 HydrophobicContact CG1-CE2 4.16Å; V520-Y522 WeakPolarHBondContact CG1-OH 3.41Å; V520-C562 VanDerWaalsContact CG1-SG 3.55Å; V520-I563 WeakPolarHBondContact CA-O 3.49Å; V520-F564 HydrophobicContact CG1-CE1 4.49Å; V520-F564 HydrophobicContact CG2-CD1 4.16Å; V520-F564 HydrophobicContact CG2-CE1 4.3Å
521	K	95.6	Very high	90.6	Very high	67 Å²	67	72.1 Å²	72.1	29%	0.291	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	167.9	174.3	-76.7	175.5	165	160.5	0	109.8	E519 I538 L539 C562 I563	E519-K521 WeakPolarHBondContact OE1-CE 3.37Å; E519-K521 IonicContact OE1-NZ 3.48Å; E519-K521 PolarHBondContact OE1-NZ 2.94Å; K521-I538 HydrophobicContact CB-CG2 4.3Å; K521-I538 HydrophobicContact CD-CG2 3.93Å; K521-I538 HydrophobicContact CG-CG2 4.45Å; K521-L539 CarbonylContact C-O 3.5Å; K521-L539 WeakPolarHBondContact CA-O 3.49Å; K521-C562 CarbonylContact O-C 3.43Å; K521-I563 HydrophobicContact CB-CB 4.3Å; K521-I563 PolarHBondContact N-O 3.08Å; K521-I563 PolarHBondContact O-N 3.17Å
522	Y	95.9	Very high	90.3	Very high	2 Å²	2	78.2 Å²	78.2	1%	0.008	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.3	176.3	-55.1	-82.9	0	0	0	109.4	V485 W506 I508 V520 I538 L539 Q542 R561 C562	V485-Y522 HydrophobicContact CG1-CD1 3.81Å; V485-Y522 HydrophobicContact CG1-CE1 3.87Å; W506-Y522 AromaticContact CD1-CD1 3.99Å; W506-Y522 AromaticContact CD1-CE1 3.91Å; W506-Y522 AromaticContact CE2-CD1 3.82Å; W506-Y522 AromaticContact CE2-CG 3.68Å; W506-Y522 VanDerWaalsContact CZ2-CB 3.47Å; W506-Y522 HydrophobicContact CZ2-CD1 4.13Å; W506-Y522 AromaticContact CZ2-CD2 3.79Å; W506-Y522 HydrophobicContact CZ2-CD2 3.79Å; W506-Y522 AromaticContact CZ2-CG 3.5Å; W506-Y522 HydrophobicContact CZ2-CG 3.5Å; W506-Y522 AromaticContact NE1-CD1 3.05Å; W506-Y522 AromaticContact NE1-CD2 3.74Å; W506-Y522 AromaticContact NE1-CE1 3.24Å; W506-Y522 AromaticContact NE1-CE2 3.92Å; W506-Y522 AromaticContact NE1-CG 3.33Å; W506-Y522 VanDerWaalsContact NE1-CG 3.33Å; W506-Y522 AromaticContact NE1-CZ 3.69Å; I508-Y522 VanDerWaalsContact CG2-OH 3.26Å; I508-Y522 WeakPolarHBondContact CG2-OH 3.08Å; V520-Y522 HydrophobicContact CG1-CE1 4.34Å; V520-Y522 HydrophobicContact CG1-CE2 4.16Å; V520-Y522 WeakPolarHBondContact CG1-OH 3.41Å; Y522-I538 CarbonylContact O-C 3.57Å; Y522-I538 WeakPolarHBondContact O-CA 3.31Å; Y522-L539 PolarHBondContact N-O 2.92Å; Y522-L539 PolarHBondContact O-N 2.83Å; Y522-Q542 HydrophobicContact CE2-CG 3.91Å; Y522-R561 CarbonylContact C-O 3.49Å; Y522-R561 WeakPolarHBondContact CA-O 3.34Å; Y522-C562 HydrophobicContact CD1-CB 3.99Å; Y522-C562 HydrophobicContact CE1-CB 3.9Å
523	E	96.4	Very high	90.2	Very high	23 Å²	23	82 Å²	82	11%	0.107	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.6	171.5	-179.5	176	-176.5	0	0	108.6	W525 Y537 I538 V560 R561 I563	E523-W525 PolarHBondContact OE1-NE1 2.84Å; E523-Y537 CarbonylContact C-O 3.6Å; E523-Y537 VanDerWaalsContact CA-O 3.28Å; E523-Y537 WeakPolarHBondContact CA-O 3.45Å; E523-I538 HydrophobicContact CB-CD1 3.73Å; E523-I538 HydrophobicContact CG-CD1 3.8Å; E523-V560 WeakPolarHBondContact O-CA 3.22Å; E523-R561 HydrophobicContact CB-CG 3.92Å; E523-R561 VanDerWaalsContact CD-NH2 3.34Å; E523-R561 PolarHBondContact N-O 3.23Å; E523-R561 PolarHBondContact O-N 3.07Å; E523-R561 IonicContact OE1-NH2 2.72Å; E523-R561 PolarHBondContact OE1-NH2 2.87Å; E523-R561 IonicContact OE2-CZ 2.75Å; E523-R561 IonicContact OE2-NE 3.85Å; E523-R561 PolarHBondContact OE2-NE 3.12Å; E523-R561 IonicContact OE2-NH2 3.73Å; E523-R561 PolarHBondContact OE2-NH2 3.34Å; E523-I563 HydrophobicContact CB-CD1 3.97Å
524	V	96.1	Very high	90.3	Very high	0 Å²	0	80.3 Å²	80.3	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.4	-178.3	-174.3	0	0	0	0	108.8	W506 L526 P536 Y537 L539 F546 V558 W559 V560	W506-V524 HydrophobicContact CH2-CG2 3.68Å; W506-V524 HydrophobicContact CZ2-CG2 4.36Å; W506-V524 HydrophobicContact CZ3-CG2 3.99Å; V524-L526 HydrophobicContact CG1-CD1 3.66Å; V524-P536 CarbonylContact O-C 3.47Å; V524-P536 WeakPolarHBondContact O-CA 3.23Å; V524-Y537 PolarHBondContact N-O 3.41Å; V524-Y537 PolarHBondContact O-N 2.87Å; V524-L539 HydrophobicContact CB-CD1 4.32Å; V524-L539 HydrophobicContact CG2-CD1 3.67Å; V524-L539 HydrophobicContact CG2-CG 4.46Å; V524-F546 HydrophobicContact CB-CZ 4.32Å; V524-F546 HydrophobicContact CG1-CE2 4.35Å; V524-F546 HydrophobicContact CG1-CZ 4.04Å; V524-V558 HydrophobicContact CG1-CG1 3.55Å; V524-W559 CarbonylContact C-O 3.57Å; V524-W559 VanDerWaalsContact CA-O 3.23Å; V524-W559 WeakPolarHBondContact CA-O 3.32Å; V524-V560 HydrophobicContact CG1-CG2 4.16Å; V524-V560 HydrophobicContact CG2-CG1 4.09Å; V524-V560 HydrophobicContact CG2-CG2 4.06Å
525	W	95.7	Very high	90.4	Very high	52 Å²	52	76.2 Å²	76.2	20%	0.197	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.5	174.8	-65.5	-0.1	0	0	0	109	E523 Y534 V535 V558 W559 F572	E523-W525 PolarHBondContact OE1-NE1 2.84Å; W525-Y534 HydrophobicContact CB-CD2 4.06Å; W525-Y534 AromaticContact CD2-CD2 3.72Å; W525-Y534 HydrophobicContact CD2-CD2 3.72Å; W525-Y534 AromaticContact CD2-CE2 3.59Å; W525-Y534 HydrophobicContact CD2-CE2 3.59Å; W525-Y534 AromaticContact CE2-CE2 3.6Å; W525-Y534 HydrophobicContact CE3-CD2 4.02Å; W525-Y534 AromaticContact CE3-CE2 3.9Å; W525-Y534 HydrophobicContact CE3-CE2 3.9Å; W525-Y534 HydrophobicContact CE3-CG 4.41Å; W525-Y534 AromaticContact CG-CD2 3.76Å; W525-Y534 HydrophobicContact CG-CD2 3.76Å; W525-Y534 HydrophobicContact CG-CE2 4.01Å; W525-Y534 HydrophobicContact CH2-CE2 4.22Å; W525-Y534 AromaticContact CZ2-CE2 3.94Å; W525-Y534 HydrophobicContact CZ2-CE2 3.94Å; W525-Y534 HydrophobicContact CZ3-CE1 4.44Å; W525-Y534 HydrophobicContact CZ3-CE2 4.2Å; W525-V535 WeakPolarHBondContact CA-O 3.26Å; W525-V558 VanDerWaalsContact O-CA 3.28Å; W525-V558 WeakPolarHBondContact O-CA 3.43Å; W525-W559 HydrophobicContact CB-CB 4.35Å; W525-W559 HydrophobicContact CB-CE3 4.08Å; W525-W559 PolarHBondContact N-O 3.25Å; W525-W559 PolarHBondContact O-N 3.3Å; W525-F572 HydrophobicContact CD2-CE1 4.1Å; W525-F572 HydrophobicContact CD2-CE2 4.49Å; W525-F572 AromaticContact CD2-CZ 3.66Å; W525-F572 HydrophobicContact CD2-CZ 3.66Å; W525-F572 AromaticContact CE2-CZ 3.48Å; W525-F572 VanDerWaalsContact CE2-CZ 3.48Å; W525-F572 HydrophobicContact CE3-CE1 4.46Å; W525-F572 HydrophobicContact CE3-CE2 4.29Å; W525-F572 AromaticContact CE3-CZ 3.88Å; W525-F572 HydrophobicContact CE3-CZ 3.88Å; W525-F572 HydrophobicContact CG-CE1 4.34Å; W525-F572 HydrophobicContact CG-CZ 4.33Å; W525-F572 AromaticContact CH2-CE2 3.86Å; W525-F572 HydrophobicContact CH2-CE2 3.86Å; W525-F572 AromaticContact CH2-CZ 3.82Å; W525-F572 HydrophobicContact CH2-CZ 3.82Å; W525-F572 HydrophobicContact CZ2-CE2 4.06Å; W525-F572 AromaticContact CZ2-CZ 3.58Å; W525-F572 HydrophobicContact CZ2-CZ 3.58Å; W525-F572 AromaticContact CZ3-CE2 3.98Å; W525-F572 HydrophobicContact CZ3-CE2 3.98Å; W525-F572 AromaticContact CZ3-CZ 3.95Å; W525-F572 HydrophobicContact CZ3-CZ 3.95Å; W525-F572 AromaticContact NE1-CZ 3.99Å
526	L	94.4	Very high	90.7	Very high	8 Å²	8	77.9 Å²	77.9	4%	0.042	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.8	173.2	-78.5	79.1	0	0	0	108.8	L502 V524 Y534 V535 Y537 F546 I550 V558	L502-L526 HydrophobicContact CD2-CD2 3.92Å; V524-L526 HydrophobicContact CG1-CD1 3.66Å; L526-Y534 CarbonylContact O-C 3.5Å; L526-Y534 VanDerWaalsContact O-CA 3.31Å; L526-Y534 WeakPolarHBondContact O-CA 3.42Å; L526-V535 PolarHBondContact N-O 2.69Å; L526-V535 PolarHBondContact O-N 2.82Å; L526-Y537 HydrophobicContact CB-CE2 4.44Å; L526-Y537 HydrophobicContact CD1-CD2 3.71Å; L526-Y537 HydrophobicContact CD1-CE2 3.78Å; L526-Y537 HydrophobicContact CG-CE2 4.49Å; L526-F546 HydrophobicContact CD1-CD1 4.38Å; L526-F546 HydrophobicContact CD1-CD2 4.33Å; L526-F546 HydrophobicContact CD1-CE1 3.91Å; L526-F546 HydrophobicContact CD1-CE2 3.87Å; L526-F546 HydrophobicContact CD1-CZ 3.63Å; L526-F546 HydrophobicContact CD2-CB 4.44Å; L526-F546 HydrophobicContact CD2-CD1 4.33Å; L526-F546 HydrophobicContact CD2-CD2 4.05Å; L526-F546 HydrophobicContact CD2-CE2 4.39Å; L526-F546 HydrophobicContact CD2-CG 4.02Å; L526-I550 HydrophobicContact CD2-CD1 3.67Å; L526-V558 HydrophobicContact CG-CG2 4.35Å
527	Q	94.5	Very high	91.2	Very high	35 Å²	35	70.3 Å²	70.3	16%	0.164	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.3	175.3	178.7	170.7	29.4	0	0	109.5	E531 T533 Y556 L557 W559	Q527-E531 PolarHBondContact NE2-O 2.84Å; Q527-T533 WeakPolarHBondContact CG-O 3.39Å; Q527-Y556 CarbonylContact O-C 3.52Å; Q527-Y556 VanDerWaalsContact O-CA 3.26Å; Q527-Y556 WeakPolarHBondContact O-CA 3.29Å; Q527-L557 HydrophobicContact CB-CB 4.39Å; Q527-L557 PolarHBondContact N-O 2.96Å; Q527-L557 PolarHBondContact O-N 2.83Å; Q527-W559 HydrophobicContact CB-CH2 4.28Å; Q527-W559 HydrophobicContact CB-CZ3 3.73Å
528	E	93	Very high	91.8	Very high	50 Å²	50	73.3 Å²	73.3	23%	0.234	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	134.1	170.3	179.2	168.2	173.9	0	0	109.9	G530 E531 K551 T554 Y556	E528-G530 PolarHBondContact O-N 3.25Å; E528-G530 VanDerWaalsContact O-N 3.16Å; E528-E531 HydrophobicContact CB-CB 4.24Å; E528-E531 HydrophobicContact CB-CG 3.96Å; E528-E531 HydrophobicContact CG-CG 4.13Å; E528-E531 PolarHBondContact O-N 3.03Å; E528-K551 VanDerWaalsContact CD-NZ 3.32Å; E528-K551 IonicContact OE1-NZ 2.76Å; E528-K551 PolarHBondContact OE1-NZ 3.49Å; E528-K551 VanDerWaalsContact OE1-NZ 3.1Å; E528-K551 IonicContact OE2-NZ 3.91Å; E528-K551 PolarHBondContact OE2-NZ 2.95Å; E528-T554 HydrophobicContact CG-CG2 3.62Å; E528-Y556 HydrophobicContact CB-CE1 4.31Å
529	Q	89.9	Confident	92.4	Very high	119 Å²	119	62.7 Å²	62.7	56%	0.556	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	117.5	-177.3	-172.7	177.5	22.2	0	0	110.2	T555	Q529-T555 HydrophobicContact CB-CG2 4.19Å; Q529-T555 VanDerWaalsContact CB-O 3.29Å; Q529-T555 WeakPolarHBondContact CB-O 3.24Å; Q529-T555 PolarHBondContact N-O 3.44Å; Q529-T555 VanDerWaalsContact OE1-CB 3.22Å
530	G	87.3	Confident	92.6	Very high	77 Å²	77	63.3 Å²	63.3	79%	0.794	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.9	-15.1	-176.5	0	0	0	0	0	113.8	E528	E528-G530 PolarHBondContact O-N 3.25Å; E528-G530 VanDerWaalsContact O-N 3.16Å
531	E	89.2	Confident	92.6	Very high	97 Å²	97	67.1 Å²	67.1	45%	0.453	37%	0.366	S	S	.	.			trans	-89.4	153.2	172.7	-68.7	-64.6	163.9	0	0	111.4	Q527 E528	Q527-E531 PolarHBondContact NE2-O 2.84Å; E528-E531 HydrophobicContact CB-CB 4.24Å; E528-E531 HydrophobicContact CB-CG 3.96Å; E528-E531 HydrophobicContact CG-CG 4.13Å; E528-E531 PolarHBondContact O-N 3.03Å
532	N	87.1	Confident	92.5	Very high	155 Å²	155	67.4 Å²	67.4	83%	0.829	37%	0.368	S	S	*	.	S	Bend	trans	-96	-5.8	176.7	-73.2	-32.7	0	0	0	113.5
533	T	89.1	Confident	92.4	Very high	104 Å²	104	71.6 Å²	71.6	64%	0.638	39%	0.391	S	S	*	.			trans	-102.3	145	-178.1	52	0	0	0	0	110.6	Q527	Q527-T533 WeakPolarHBondContact CG-O 3.39Å
534	Y	90.8	Very high	92.3	Very high	110 Å²	110	74 Å²	74	43%	0.431	40%	0.402	S	S	.	.			trans	-128.7	155.7	175.7	64.4	-89.7	0	0	0	110	W525 L526 P536	W525-Y534 HydrophobicContact CB-CD2 4.06Å; W525-Y534 AromaticContact CD2-CD2 3.72Å; W525-Y534 HydrophobicContact CD2-CD2 3.72Å; W525-Y534 AromaticContact CD2-CE2 3.59Å; W525-Y534 HydrophobicContact CD2-CE2 3.59Å; W525-Y534 AromaticContact CE2-CE2 3.6Å; W525-Y534 HydrophobicContact CE3-CD2 4.02Å; W525-Y534 AromaticContact CE3-CE2 3.9Å; W525-Y534 HydrophobicContact CE3-CE2 3.9Å; W525-Y534 HydrophobicContact CE3-CG 4.41Å; W525-Y534 AromaticContact CG-CD2 3.76Å; W525-Y534 HydrophobicContact CG-CD2 3.76Å; W525-Y534 HydrophobicContact CG-CE2 4.01Å; W525-Y534 HydrophobicContact CH2-CE2 4.22Å; W525-Y534 AromaticContact CZ2-CE2 3.94Å; W525-Y534 HydrophobicContact CZ2-CE2 3.94Å; W525-Y534 HydrophobicContact CZ3-CE1 4.44Å; W525-Y534 HydrophobicContact CZ3-CE2 4.2Å; L526-Y534 CarbonylContact O-C 3.5Å; L526-Y534 VanDerWaalsContact O-CA 3.31Å; L526-Y534 WeakPolarHBondContact O-CA 3.42Å; Y534-P536 HydrophobicContact CE2-CB 4.35Å; Y534-P536 HydrophobicContact CE2-CG 4.38Å
535	V	90.3	Very high	92.2	Very high	73 Å²	73	76.8 Å²	76.8	44%	0.442	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.6	176.2	-171.8	0	0	0	0	109.2	W525 L526 Y537	W525-V535 WeakPolarHBondContact CA-O 3.26Å; L526-V535 PolarHBondContact N-O 2.69Å; L526-V535 PolarHBondContact O-N 2.82Å; V535-Y537 HydrophobicContact CB-CE2 3.8Å; V535-Y537 HydrophobicContact CG1-CD2 4.26Å; V535-Y537 HydrophobicContact CG1-CE1 4.33Å; V535-Y537 HydrophobicContact CG1-CE2 3.48Å; V535-Y537 VanDerWaalsContact CG1-CE2 3.48Å; V535-Y537 WeakPolarHBondContact O-CD2 3.37Å
536	P	92.8	Very high	92	Very high	72 Å²	72	74.6 Å²	74.6	47%	0.468	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	135.8	177.2	33.4	-33.2	0	0	0	112.2	V524 Y534	V524-P536 CarbonylContact O-C 3.47Å; V524-P536 WeakPolarHBondContact O-CA 3.23Å; Y534-P536 HydrophobicContact CE2-CB 4.35Å; Y534-P536 HydrophobicContact CE2-CG 4.38Å
537	Y	93.9	Very high	91.8	Very high	58 Å²	58	78 Å²	78	23%	0.227	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.1	176.8	-62.1	-93.6	0	0	0	110.8	E523 V524 L526 V535 F546	E523-Y537 CarbonylContact C-O 3.6Å; E523-Y537 VanDerWaalsContact CA-O 3.28Å; E523-Y537 WeakPolarHBondContact CA-O 3.45Å; V524-Y537 PolarHBondContact N-O 3.41Å; V524-Y537 PolarHBondContact O-N 2.87Å; L526-Y537 HydrophobicContact CB-CE2 4.44Å; L526-Y537 HydrophobicContact CD1-CD2 3.71Å; L526-Y537 HydrophobicContact CD1-CE2 3.78Å; L526-Y537 HydrophobicContact CG-CE2 4.49Å; V535-Y537 HydrophobicContact CB-CE2 3.8Å; V535-Y537 HydrophobicContact CG1-CD2 4.26Å; V535-Y537 HydrophobicContact CG1-CE1 4.33Å; V535-Y537 HydrophobicContact CG1-CE2 3.48Å; V535-Y537 VanDerWaalsContact CG1-CE2 3.48Å; V535-Y537 WeakPolarHBondContact O-CD2 3.37Å; Y537-F546 HydrophobicContact CD1-CD1 4.38Å; Y537-F546 AromaticContact CD1-CE1 3.85Å; Y537-F546 HydrophobicContact CD1-CE1 3.85Å; Y537-F546 HydrophobicContact CD2-CD1 4.35Å; Y537-F546 AromaticContact CD2-CE1 3.62Å; Y537-F546 HydrophobicContact CD2-CE1 3.62Å; Y537-F546 HydrophobicContact CD2-CZ 4.28Å; Y537-F546 HydrophobicContact CE1-CD1 4.22Å; Y537-F546 HydrophobicContact CE1-CE1 4.12Å; Y537-F546 HydrophobicContact CE2-CD1 4.19Å; Y537-F546 AromaticContact CE2-CE1 3.91Å; Y537-F546 HydrophobicContact CE2-CE1 3.91Å; Y537-F546 HydrophobicContact CG-CD1 4.44Å; Y537-F546 AromaticContact CG-CE1 3.58Å; Y537-F546 HydrophobicContact CG-CE1 3.58Å; Y537-F546 HydrophobicContact CG-CZ 4.37Å
538	I	94.2	Very high	91.2	Very high	99 Å²	99	83.3 Å²	83.3	51%	0.508	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	116.5	173.4	-57.5	-61.2	0	0	0	109.6	K521 Y522 E523 I563	K521-I538 HydrophobicContact CB-CG2 4.3Å; K521-I538 HydrophobicContact CD-CG2 3.93Å; K521-I538 HydrophobicContact CG-CG2 4.45Å; Y522-I538 CarbonylContact O-C 3.57Å; Y522-I538 WeakPolarHBondContact O-CA 3.31Å; E523-I538 HydrophobicContact CB-CD1 3.73Å; E523-I538 HydrophobicContact CG-CD1 3.8Å; I538-I563 HydrophobicContact CD1-CD1 4.14Å
539	L	94	Very high	90.7	Very high	21 Å²	21	87.4 Å²	87.4	11%	0.11	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.4	-174.4	-57.8	177.2	0	0	0	111.1	W506 K521 Y522 V524 H544 F546	W506-L539 HydrophobicContact CH2-CD1 3.79Å; K521-L539 CarbonylContact C-O 3.5Å; K521-L539 WeakPolarHBondContact CA-O 3.49Å; Y522-L539 PolarHBondContact N-O 2.92Å; Y522-L539 PolarHBondContact O-N 2.83Å; V524-L539 HydrophobicContact CB-CD1 4.32Å; V524-L539 HydrophobicContact CG2-CD1 3.67Å; V524-L539 HydrophobicContact CG2-CG 4.46Å; L539-H544 HydrophobicContact CD1-CB 3.57Å; L539-H544 HydrophobicContact CD2-CB 4.26Å; L539-F546 HydrophobicContact CD1-CZ 4.03Å
540	A	91.8	Very high	90.7	Very high	69 Å²	69	82.4 Å²	82.4	57%	0.57	46%	0.458	S	S	*	.	S	Bend	trans	-93.1	-23.9	176.2	0	0	0	0	0	112.9
541	L	91.9	Very high	90.8	Very high	119 Å²	119	83.5 Å²	83.5	62%	0.623	44%	0.441	S	S	*	.	S	Bend	trans	-110.1	156	-175.3	-59.2	177.8	0	0	0	110.6	W506 N543	W506-L541 VanDerWaalsContact CZ2-O 3.25Å; W506-L541 WeakPolarHBondContact CZ2-O 3.44Å; L541-N543 PolarHBondContact O-N 2.91Å
542	Q	93.7	Very high	90.7	Very high	72 Å²	72	80.4 Å²	80.4	34%	0.336	43%	0.429	S	S	.	.	S	Bend	trans	-81.8	7.8	-178.1	-52.2	81.5	-9.6	0	0	113.6	S505 W506 I508 Y522	S505-Q542 CarbonylContact C-O 3.56Å; S505-Q542 WeakPolarHBondContact CA-O 3.37Å; W506-Q542 HydrophobicContact CD2-CB 4.49Å; W506-Q542 HydrophobicContact CG-CB 4.41Å; W506-Q542 PolarHBondContact N-O 3.05Å; W506-Q542 VanDerWaalsContact O-CB 3.24Å; W506-Q542 WeakPolarHBondContact O-CB 3.46Å; I508-Q542 HydrophobicContact CG2-CG 3.99Å; Y522-Q542 HydrophobicContact CE2-CG 3.91Å
543	N	94.3	Very high	90.8	Very high	91 Å²	91	80.8 Å²	80.8	49%	0.487	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	131.3	179.2	-175.2	12.8	0	0	0	108.9	T503 V504 L541	T503-N543 WeakPolarHBondContact CG2-OD1 3.42Å; V504-N543 WeakPolarHBondContact O-CA 3.2Å; V504-N543 PolarHBondContact O-OD1 2.79Å; L541-N543 PolarHBondContact O-N 2.91Å
544	H	94.6	Very high	90.9	Very high	73 Å²	73	76.7 Å²	76.7	34%	0.338	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	141.4	177.1	-171.9	74.5	0	0	0	111.3	T503 V504 L539 F546	T503-H544 WeakPolarHBondContact CA-O 3.25Å; V504-H544 PolarHBondContact N-O 2.96Å; V504-H544 PolarHBondContact O-N 2.99Å; L539-H544 HydrophobicContact CD1-CB 3.57Å; L539-H544 HydrophobicContact CD2-CB 4.26Å; H544-F546 AromaticContact CD2-CD1 3.67Å; H544-F546 AromaticContact CD2-CE1 3.51Å; H544-F546 AromaticContact CD2-CE2 3.94Å; H544-F546 AromaticContact CD2-CG 3.97Å; H544-F546 AromaticContact CD2-CZ 3.66Å; H544-F546 AromaticContact NE2-CD1 3.99Å
545	T	93.6	Very high	91	Very high	58 Å²	58	73 Å²	73	36%	0.356	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	113.1	175.9	-56.9	0	0	0	0	109.5	R501 L502 T503 T547	R501-T545 HydrophobicContact CB-CG2 3.94Å; L502-T545 WeakPolarHBondContact O-CA 3.3Å; T503-T545 WeakPolarHBondContact OG1-CG2 3.46Å; T503-T545 PolarHBondContact OG1-OG1 3.36Å; T545-T547 HydrophobicContact CG2-CG2 4.26Å
546	F	92.4	Very high	91.2	Very high	6 Å²	6	70.1 Å²	70.1	3%	0.026	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	122.6	173.2	-57.7	-85	0	0	0	109.2	R501 L502 V504 V524 L526 Y537 L539 H544 I550	R501-F546 WeakPolarHBondContact CA-O 3.15Å; L502-F546 PolarHBondContact N-O 3.06Å; L502-F546 WeakPolarHBondContact O-CD2 3.27Å; L502-F546 PolarHBondContact O-N 3.36Å; V504-F546 HydrophobicContact CB-CE2 4.25Å; V504-F546 HydrophobicContact CG2-CD2 4.16Å; V504-F546 HydrophobicContact CG2-CE2 3.86Å; V524-F546 HydrophobicContact CB-CZ 4.32Å; V524-F546 HydrophobicContact CG1-CE2 4.35Å; V524-F546 HydrophobicContact CG1-CZ 4.04Å; L526-F546 HydrophobicContact CD1-CD1 4.38Å; L526-F546 HydrophobicContact CD1-CD2 4.33Å; L526-F546 HydrophobicContact CD1-CE1 3.91Å; L526-F546 HydrophobicContact CD1-CE2 3.87Å; L526-F546 HydrophobicContact CD1-CZ 3.63Å; L526-F546 HydrophobicContact CD2-CB 4.44Å; L526-F546 HydrophobicContact CD2-CD1 4.33Å; L526-F546 HydrophobicContact CD2-CD2 4.05Å; L526-F546 HydrophobicContact CD2-CE2 4.39Å; L526-F546 HydrophobicContact CD2-CG 4.02Å; Y537-F546 HydrophobicContact CD1-CD1 4.38Å; Y537-F546 AromaticContact CD1-CE1 3.85Å; Y537-F546 HydrophobicContact CD1-CE1 3.85Å; Y537-F546 HydrophobicContact CD2-CD1 4.35Å; Y537-F546 AromaticContact CD2-CE1 3.62Å; Y537-F546 HydrophobicContact CD2-CE1 3.62Å; Y537-F546 HydrophobicContact CD2-CZ 4.28Å; Y537-F546 HydrophobicContact CE1-CD1 4.22Å; Y537-F546 HydrophobicContact CE1-CE1 4.12Å; Y537-F546 HydrophobicContact CE2-CD1 4.19Å; Y537-F546 AromaticContact CE2-CE1 3.91Å; Y537-F546 HydrophobicContact CE2-CE1 3.91Å; Y537-F546 HydrophobicContact CG-CD1 4.44Å; Y537-F546 AromaticContact CG-CE1 3.58Å; Y537-F546 HydrophobicContact CG-CE1 3.58Å; Y537-F546 HydrophobicContact CG-CZ 4.37Å; L539-F546 HydrophobicContact CD1-CZ 4.03Å; H544-F546 AromaticContact CD2-CD1 3.67Å; H544-F546 AromaticContact CD2-CE1 3.51Å; H544-F546 AromaticContact CD2-CE2 3.94Å; H544-F546 AromaticContact CD2-CG 3.97Å; H544-F546 AromaticContact CD2-CZ 3.66Å; H544-F546 AromaticContact NE2-CD1 3.99Å; F546-I550 HydrophobicContact CB-CD1 3.88Å; F546-I550 HydrophobicContact CB-CG1 3.72Å
547	T	88.6	Confident	91.4	Very high	79 Å²	79	68.5 Å²	68.5	49%	0.485	36%	0.356	S	S	.	.			trans	-115.9	-27.1	176.7	52.7	0	0	0	0	112.1	R501 T545	R501-T547 HydrophobicContact CB-CG2 4.47Å; R501-T547 HydrophobicContact CG-CG2 3.95Å; T545-T547 HydrophobicContact CG2-CG2 4.26Å
548	E	83.2	Confident	91.4	Very high	147 Å²	147	65.8 Å²	65.8	69%	0.687	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	135.8	179.8	-63.9	179.5	-176.3	0	0	110.3	I550	E548-I550 PolarHBondContact O-N 3.4Å
549	N	82	Confident	91.5	Very high	137 Å²	137	63.7 Å²	63.7	73%	0.733	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	21.5	178.8	-53.4	-47.1	0	0	0	115.2	Y556	N549-Y556 PolarHBondContact O-OH 2.88Å
550	I	89.8	Confident	91.7	Very high	14 Å²	14	62.8 Å²	62.8	7%	0.072	33%	0.326	C	S	.	.			trans	-97.5	115.1	171.3	-57.1	-55.5	0	0	0	108.9	A500 L502 L526 F546 E548 Y556 T580	A500-I550 HydrophobicContact CB-CG2 3.87Å; L502-I550 HydrophobicContact CB-CD1 4.33Å; L502-I550 HydrophobicContact CB-CG1 4.37Å; L502-I550 HydrophobicContact CB-CG2 4.15Å; L526-I550 HydrophobicContact CD2-CD1 3.67Å; F546-I550 HydrophobicContact CB-CD1 3.88Å; F546-I550 HydrophobicContact CB-CG1 3.72Å; E548-I550 PolarHBondContact O-N 3.4Å; I550-Y556 HydrophobicContact CD1-CE1 4.43Å; I550-Y556 HydrophobicContact CG2-CE2 4.13Å; I550-T580 HydrophobicContact CG2-CG2 3.49Å; I550-T580 VanDerWaalsContact CG2-CG2 3.49Å
551	K	88.9	Confident	91.9	Very high	100 Å²	100	61.5 Å²	61.5	44%	0.435	31%	0.307	S	S	.	.			trans	-84	145.1	177.9	-65.1	174.1	-174.9	164.7	0	109.8	E528 T554 Y556 T580	E528-K551 VanDerWaalsContact CD-NZ 3.32Å; E528-K551 IonicContact OE1-NZ 2.76Å; E528-K551 PolarHBondContact OE1-NZ 3.49Å; E528-K551 VanDerWaalsContact OE1-NZ 3.1Å; E528-K551 IonicContact OE2-NZ 3.91Å; E528-K551 PolarHBondContact OE2-NZ 2.95Å; K551-T554 HydrophobicContact CB-CG2 4.44Å; K551-T554 VanDerWaalsContact CB-OG1 3.24Å; K551-T554 WeakPolarHBondContact CB-OG1 3.26Å; K551-Y556 PolarHBondContact N-OH 3.24Å; K551-T580 WeakPolarHBondContact O-CB 3.48Å; K551-T580 PolarHBondContact O-OG1 3Å
552	P	87.8	Confident	92.1	Very high	31 Å²	31	55.9 Å²	55.9	20%	0.201	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	153.9	169.9	30.4	-34.4	0	0	0	111.3	V494 A500 T554	V494-P552 HydrophobicContact CG1-CB 3.93Å; A500-P552 HydrophobicContact CB-CB 4.12Å; P552-T554 PolarHBondContact O-N 3.19Å; P552-T554 PolarHBondContact O-OG1 3.12Å
553	F	89.2	Confident	92	Very high	163 Å²	163	53 Å²	53	72%	0.715	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	32.3	175.7	-46.4	-64.9	0	0	0	114	V494 T580	V494-F553 HydrophobicContact CG1-CZ 4.43Å; F553-T580 WeakPolarHBondContact CA-O 3.22Å; F553-T580 PolarHBondContact N-O 3.04Å
554	T	90.6	Very high	91.8	Very high	18 Å²	18	48.8 Å²	48.8	11%	0.11	24%	0.241	C	C	.	.			trans	-121.7	133	-172.7	-59.8	0	0	0	0	109.9	E528 K551 P552 Y556 S579 T580	E528-T554 HydrophobicContact CG-CG2 3.62Å; K551-T554 HydrophobicContact CB-CG2 4.44Å; K551-T554 VanDerWaalsContact CB-OG1 3.24Å; K551-T554 WeakPolarHBondContact CB-OG1 3.26Å; P552-T554 PolarHBondContact O-N 3.19Å; P552-T554 PolarHBondContact O-OG1 3.12Å; T554-Y556 HydrophobicContact CG2-CD2 4.22Å; T554-Y556 HydrophobicContact CG2-CE2 3.65Å; T554-Y556 WeakPolarHBondContact O-CD2 3.2Å; T554-S579 WeakPolarHBondContact O-CA 3.34Å; T554-T580 PolarHBondContact N-OG1 3.48Å; T554-T580 VanDerWaalsContact N-OG1 3.08Å; T554-T580 PolarHBondContact O-N 3.09Å; T554-T580 PolarHBondContact O-OG1 3.46Å
555	T	93.4	Very high	91.1	Very high	34 Å²	34	48.6 Å²	48.6	21%	0.209	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	127	175.3	-59.5	0	0	0	0	110.1	Q529 V577 C578 S579	Q529-T555 HydrophobicContact CB-CG2 4.19Å; Q529-T555 VanDerWaalsContact CB-O 3.29Å; Q529-T555 WeakPolarHBondContact CB-O 3.24Å; Q529-T555 PolarHBondContact N-O 3.44Å; Q529-T555 VanDerWaalsContact OE1-CB 3.22Å; T555-V577 HydrophobicContact CG2-CG1 3.44Å; T555-V577 VanDerWaalsContact CG2-CG1 3.44Å; T555-C578 CarbonylContact C-O 3.41Å; T555-S579 PolarHBondContact OG1-OG 3.11Å
556	Y	94.7	Very high	90.3	Very high	11 Å²	11	52.6 Å²	52.6	4%	0.043	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.4	175.8	-69.2	-89	0	0	0	110.9	L502 Q527 E528 N549 I550 K551 T554 C578 T580	L502-Y556 HydrophobicContact CD2-CD2 4.35Å; L502-Y556 HydrophobicContact CD2-CG 4.29Å; Q527-Y556 CarbonylContact O-C 3.52Å; Q527-Y556 VanDerWaalsContact O-CA 3.26Å; Q527-Y556 WeakPolarHBondContact O-CA 3.29Å; E528-Y556 HydrophobicContact CB-CE1 4.31Å; N549-Y556 PolarHBondContact O-OH 2.88Å; I550-Y556 HydrophobicContact CD1-CE1 4.43Å; I550-Y556 HydrophobicContact CG2-CE2 4.13Å; K551-Y556 PolarHBondContact N-OH 3.24Å; T554-Y556 HydrophobicContact CG2-CD2 4.22Å; T554-Y556 HydrophobicContact CG2-CE2 3.65Å; T554-Y556 WeakPolarHBondContact O-CD2 3.2Å; Y556-C578 PolarHBondContact N-O 3.1Å; Y556-C578 PolarHBondContact O-N 3.06Å; Y556-T580 HydrophobicContact CD2-CG2 4.25Å; Y556-T580 HydrophobicContact CE2-CG2 4.17Å
557	L	95.8	Very high	89.6	Confident	39 Å²	39	58.8 Å²	58.8	20%	0.204	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	123.7	163.6	-56.8	-179.5	0	0	0	108.3	Q527 W559 V575 L576 V577	Q527-L557 HydrophobicContact CB-CB 4.39Å; Q527-L557 PolarHBondContact N-O 2.96Å; Q527-L557 PolarHBondContact O-N 2.83Å; L557-W559 HydrophobicContact CB-CE3 4.48Å; L557-W559 HydrophobicContact CB-CH2 3.34Å; L557-W559 HydrophobicContact CB-CZ2 4.08Å; L557-W559 HydrophobicContact CB-CZ3 3.59Å; L557-W559 HydrophobicContact CD1-CH2 3.81Å; L557-W559 HydrophobicContact CD1-CZ2 4.34Å; L557-W559 HydrophobicContact CG-CH2 4.23Å; L557-W559 WeakPolarHBondContact O-CZ3 3.36Å; L557-V575 HydrophobicContact CB-CG2 3.91Å; L557-V575 HydrophobicContact CD2-CG2 4.19Å; L557-L576 CarbonylContact C-O 3.24Å; L557-L576 WeakPolarHBondContact CA-O 3.15Å; L557-V577 HydrophobicContact CD2-CG2 3.93Å
558	V	95.4	Very high	89.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.6	-176.6	-170.7	0	0	0	0	110.7	L502 V504 V524 W525 L526 V560 L576 C578	L502-V558 HydrophobicContact CD2-CG2 4.2Å; V504-V558 HydrophobicContact CG1-CG1 4.14Å; V504-V558 HydrophobicContact CG2-CG1 4.21Å; V524-V558 HydrophobicContact CG1-CG1 3.55Å; W525-V558 VanDerWaalsContact O-CA 3.28Å; W525-V558 WeakPolarHBondContact O-CA 3.43Å; L526-V558 HydrophobicContact CG-CG2 4.35Å; V558-V560 HydrophobicContact CG1-CG2 4.35Å; V558-L576 HydrophobicContact CB-CB 4.19Å; V558-L576 PolarHBondContact N-O 3.48Å; V558-L576 PolarHBondContact O-N 3.14Å; V558-C578 HydrophobicContact CG2-CB 4.4Å
559	W	96.4	Very high	89.9	Confident	56 Å²	56	53.2 Å²	53.2	21%	0.212	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139	172	-62.8	-94.1	0	0	0	110.4	V524 W525 Q527 L557 F572 V575	V524-W559 CarbonylContact C-O 3.57Å; V524-W559 VanDerWaalsContact CA-O 3.23Å; V524-W559 WeakPolarHBondContact CA-O 3.32Å; W525-W559 HydrophobicContact CB-CB 4.35Å; W525-W559 HydrophobicContact CB-CE3 4.08Å; W525-W559 PolarHBondContact N-O 3.25Å; W525-W559 PolarHBondContact O-N 3.3Å; Q527-W559 HydrophobicContact CB-CH2 4.28Å; Q527-W559 HydrophobicContact CB-CZ3 3.73Å; L557-W559 HydrophobicContact CB-CE3 4.48Å; L557-W559 HydrophobicContact CB-CH2 3.34Å; L557-W559 HydrophobicContact CB-CZ2 4.08Å; L557-W559 HydrophobicContact CB-CZ3 3.59Å; L557-W559 HydrophobicContact CD1-CH2 3.81Å; L557-W559 HydrophobicContact CD1-CZ2 4.34Å; L557-W559 HydrophobicContact CG-CH2 4.23Å; L557-W559 WeakPolarHBondContact O-CZ3 3.36Å; W559-F572 HydrophobicContact CB-CB 4.47Å; W559-F572 HydrophobicContact CB-CD1 3.49Å; W559-F572 VanDerWaalsContact CB-CD1 3.49Å; W559-F572 HydrophobicContact CB-CE1 3.87Å; W559-F572 HydrophobicContact CB-CG 4.1Å; W559-F572 HydrophobicContact CG-CD1 4.46Å; W559-V575 HydrophobicContact CD2-CG2 4.16Å; W559-V575 HydrophobicContact CH2-CG2 4.27Å; W559-V575 HydrophobicContact CZ2-CB 4.35Å; W559-V575 HydrophobicContact CZ2-CG2 3.64Å
560	V	96.6	Very high	90.3	Very high	2 Å²	2	47 Å²	47	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130	178.5	-174.3	0	0	0	0	109.8	V485 V504 W506 E523 V524 V558 F572 A573	V485-V560 HydrophobicContact CG1-CG1 4.15Å; V485-V560 HydrophobicContact CG2-CB 3.81Å; V485-V560 HydrophobicContact CG2-CG1 3.71Å; V504-V560 HydrophobicContact CG1-CG2 4.24Å; W506-V560 HydrophobicContact CD2-CG1 3.68Å; W506-V560 HydrophobicContact CE3-CG1 3.92Å; W506-V560 HydrophobicContact CE3-CG2 4.06Å; W506-V560 HydrophobicContact CG-CG1 4.15Å; W506-V560 HydrophobicContact CH2-CG1 4.38Å; W506-V560 HydrophobicContact CZ2-CG1 4.12Å; W506-V560 HydrophobicContact CZ3-CG1 4.27Å; W506-V560 HydrophobicContact CZ3-CG2 4.31Å; E523-V560 WeakPolarHBondContact O-CA 3.22Å; V524-V560 HydrophobicContact CG1-CG2 4.16Å; V524-V560 HydrophobicContact CG2-CG1 4.09Å; V524-V560 HydrophobicContact CG2-CG2 4.06Å; V558-V560 HydrophobicContact CG1-CG2 4.35Å; V560-F572 WeakPolarHBondContact O-CA 3.27Å; V560-A573 PolarHBondContact O-N 3.27Å
561	R	96.3	Very high	90.6	Very high	42 Å²	42	49.4 Å²	49.4	16%	0.158	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	156	168.9	66.8	178.6	177.8	-166.3	-1.9	111.8	Y522 E523 G570 F572	Y522-R561 CarbonylContact C-O 3.49Å; Y522-R561 WeakPolarHBondContact CA-O 3.34Å; E523-R561 HydrophobicContact CB-CG 3.92Å; E523-R561 VanDerWaalsContact CD-NH2 3.34Å; E523-R561 PolarHBondContact N-O 3.23Å; E523-R561 PolarHBondContact O-N 3.07Å; E523-R561 IonicContact OE1-NH2 2.72Å; E523-R561 PolarHBondContact OE1-NH2 2.87Å; E523-R561 IonicContact OE2-CZ 2.75Å; E523-R561 IonicContact OE2-NE 3.85Å; E523-R561 PolarHBondContact OE2-NE 3.12Å; E523-R561 IonicContact OE2-NH2 3.73Å; E523-R561 PolarHBondContact OE2-NH2 3.34Å; R561-G570 WeakPolarHBondContact CD-O 3.46Å; R561-F572 HydrophobicContact CB-CD1 3.66Å; R561-F572 HydrophobicContact CB-CE1 3.93Å; R561-F572 HydrophobicContact CB-CG 4.13Å; R561-F572 HydrophobicContact CG-CD1 3.87Å; R561-F572 HydrophobicContact CG-CE1 3.57Å; R561-F572 HydrophobicContact CG-CZ 3.97Å
562	C	95.8	Very high	90.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	150.4	175.1	-173.9	0	0	0	0	110.9	P482 V485 P509 V520 K521 Y522 G570	P482-C562 HydrophobicContact CB-CB 3.77Å; P482-C562 HydrophobicContact CG-CB 4.27Å; P482-C562 WeakPolarHBondContact CG-O 3.09Å; V485-C562 HydrophobicContact CG1-CB 4.01Å; P509-C562 HydrophobicContact CG-CB 3.56Å; V520-C562 VanDerWaalsContact CG1-SG 3.55Å; K521-C562 CarbonylContact O-C 3.43Å; Y522-C562 HydrophobicContact CD1-CB 3.99Å; Y522-C562 HydrophobicContact CE1-CB 3.9Å; C562-G570 PolarHBondContact O-N 3.41Å
563	I	92.3	Very high	91.2	Very high	11 Å²	11	45.9 Å²	45.9	6%	0.056	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125.2	178.8	-51	-175.4	0	0	0	108.9	V520 K521 E523 I538 L568 L569	V520-I563 WeakPolarHBondContact CA-O 3.49Å; K521-I563 HydrophobicContact CB-CB 4.3Å; K521-I563 PolarHBondContact N-O 3.08Å; K521-I563 PolarHBondContact O-N 3.17Å; E523-I563 HydrophobicContact CB-CD1 3.97Å; I538-I563 HydrophobicContact CD1-CD1 4.14Å; I563-L568 CarbonylContact C-O 3.59Å; I563-L568 WeakPolarHBondContact CA-O 3.47Å; I563-L569 HydrophobicContact CB-CD2 4.44Å; I563-L569 HydrophobicContact CD1-CD2 3.64Å; I563-L569 HydrophobicContact CG1-CD2 3.66Å; I563-L569 HydrophobicContact CG2-CD2 4.14Å
564	F	89.5	Confident	91.3	Very high	3 Å²	3	43.8 Å²	43.8	1%	0.013	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	139.8	170.8	-63.5	-16.7	0	0	0	111.6	P482 L512 L515 V517 V520 K566 I567 L568	P482-F564 VanDerWaalsContact CA-CZ 3.48Å; P482-F564 HydrophobicContact CB-CD1 4.07Å; P482-F564 HydrophobicContact CB-CD2 4.17Å; P482-F564 HydrophobicContact CB-CE1 3.61Å; P482-F564 HydrophobicContact CB-CE2 3.72Å; P482-F564 HydrophobicContact CB-CG 4.33Å; P482-F564 HydrophobicContact CB-CZ 3.45Å; P482-F564 VanDerWaalsContact CB-CZ 3.45Å; P482-F564 HydrophobicContact CG-CB 4.36Å; P482-F564 HydrophobicContact CG-CD1 3.7Å; P482-F564 HydrophobicContact CG-CD2 3.72Å; P482-F564 HydrophobicContact CG-CE1 3.81Å; P482-F564 HydrophobicContact CG-CE2 3.82Å; P482-F564 HydrophobicContact CG-CG 3.66Å; P482-F564 HydrophobicContact CG-CZ 3.88Å; P482-F564 VanDerWaalsContact N-CE2 3.35Å; L512-F564 HydrophobicContact CB-CZ 4.19Å; L512-F564 HydrophobicContact CD1-CD1 4.43Å; L512-F564 HydrophobicContact CD1-CE1 3.61Å; L512-F564 HydrophobicContact CD1-CZ 3.74Å; L512-F564 HydrophobicContact CG-CE1 4.44Å; L512-F564 HydrophobicContact CG-CZ 4.49Å; L515-F564 HydrophobicContact CD1-CD2 4.32Å; L515-F564 HydrophobicContact CD1-CE2 3.41Å; L515-F564 VanDerWaalsContact CD1-CE2 3.41Å; L515-F564 HydrophobicContact CD1-CZ 4.09Å; V517-F564 HydrophobicContact CB-CD1 4.48Å; V517-F564 HydrophobicContact CB-CG 4.46Å; V517-F564 HydrophobicContact CG1-CB 3.75Å; V517-F564 HydrophobicContact CG1-CD1 3.81Å; V517-F564 HydrophobicContact CG1-CD2 4.48Å; V517-F564 HydrophobicContact CG1-CG 3.76Å; V517-F564 HydrophobicContact CG2-CB 4.46Å; V517-F564 HydrophobicContact CG2-CD1 4.07Å; V517-F564 HydrophobicContact CG2-CD2 3.74Å; V517-F564 HydrophobicContact CG2-CE1 4.23Å; V517-F564 HydrophobicContact CG2-CE2 3.92Å; V517-F564 HydrophobicContact CG2-CG 3.83Å; V517-F564 HydrophobicContact CG2-CZ 4.13Å; V520-F564 HydrophobicContact CG1-CE1 4.49Å; V520-F564 HydrophobicContact CG2-CD1 4.16Å; V520-F564 HydrophobicContact CG2-CE1 4.3Å; F564-K566 PolarHBondContact O-N 2.81Å; F564-I567 PolarHBondContact O-N 2.79Å; F564-L568 HydrophobicContact CB-CB 4.1Å; F564-L568 HydrophobicContact CB-CD1 4.49Å; F564-L568 PolarHBondContact N-O 2.69Å; F564-L568 PolarHBondContact O-N 2.99Å
565	N	80.3	Confident	91.5	Very high	69 Å²	69	46.1 Å²	46.1	37%	0.369	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	38.1	171.5	-58.3	-31.2	0	0	0	113.1	R518 E519 I567	R518-N565 PolarHBondContact N-OD1 2.69Å; R518-N565 VanDerWaalsContact N-OD1 3.17Å; E519-N565 PolarHBondContact N-OD1 3.21Å; E519-N565 PolarHBondContact O-N 3.39Å; N565-I567 PolarHBondContact O-N 2.84Å; N565-I567 VanDerWaalsContact O-N 3.08Å
566	K	77.3	Confident	91.6	Very high	142 Å²	142	45.8 Å²	45.8	62%	0.617	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.1	-23.1	179.3	-49	-178.3	-177.6	-177.4	0	117.8	E519 F564	E519-K566 WeakPolarHBondContact OE2-CE 3.44Å; E519-K566 VanDerWaalsContact OE2-CG 3.24Å; E519-K566 WeakPolarHBondContact OE2-CG 3.36Å; F564-K566 PolarHBondContact O-N 2.81Å
567	I	78.6	Confident	91.6	Very high	137 Å²	137	49.6 Å²	49.6	70%	0.703	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	-17.7	-169.7	61.5	173	0	0	0	114.7	F564 N565 L569	F564-I567 PolarHBondContact O-N 2.79Å; N565-I567 PolarHBondContact O-N 2.84Å; N565-I567 VanDerWaalsContact O-N 3.08Å; I567-L569 PolarHBondContact O-N 3.29Å
568	L	85.5	Confident	91.5	Very high	34 Å²	34	47.9 Å²	47.9	18%	0.178	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	99.5	-175.1	-58.1	178.5	0	0	0	110	L480 Y481 P482 I563 F564	L480-L568 WeakPolarHBondContact O-CD1 3.16Å; Y481-L568 HydrophobicContact CD1-CB 4.09Å; Y481-L568 HydrophobicContact CD1-CD2 4.29Å; Y481-L568 HydrophobicContact CE1-CB 4.32Å; Y481-L568 HydrophobicContact CE1-CD2 3.74Å; P482-L568 WeakPolarHBondContact CD-O 3.49Å; P482-L568 WeakPolarHBondContact CG-O 3.3Å; I563-L568 CarbonylContact C-O 3.59Å; I563-L568 WeakPolarHBondContact CA-O 3.47Å; F564-L568 HydrophobicContact CB-CB 4.1Å; F564-L568 HydrophobicContact CB-CD1 4.49Å; F564-L568 PolarHBondContact N-O 2.69Å; F564-L568 PolarHBondContact O-N 2.99Å
569	L	90.7	Very high	91.2	Very high	75 Å²	75	51.5 Å²	51.5	39%	0.393	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	130.5	-177.8	-57	172.9	0	0	0	111	I563 I567	I563-L569 HydrophobicContact CB-CD2 4.44Å; I563-L569 HydrophobicContact CD1-CD2 3.64Å; I563-L569 HydrophobicContact CG1-CD2 3.66Å; I563-L569 HydrophobicContact CG2-CD2 4.14Å; I567-L569 PolarHBondContact O-N 3.29Å
570	G	92.3	Very high	90.7	Very high	7 Å²	7	50 Å²	50	7%	0.072	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-85.2	169.5	166.3	0	0	0	0	0	111.6	P482 R561 C562	P482-G570 VanDerWaalsContact O-CA 3.3Å; P482-G570 WeakPolarHBondContact O-CA 3.09Å; R561-G570 WeakPolarHBondContact CD-O 3.46Å; C562-G570 PolarHBondContact O-N 3.41Å
571	P	94.4	Very high	90.4	Very high	64 Å²	64	52.4 Å²	52.4	42%	0.416	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-65.9	151.4	172.2	29.1	-34.3	0	0	0	111.1	P482 K484	P482-P571 VanDerWaalsContact O-CD 3.23Å; P482-P571 WeakPolarHBondContact O-CD 3.48Å; K484-P571 HydrophobicContact CB-CG 4.35Å; K484-P571 HydrophobicContact CG-CB 3.99Å; K484-P571 HydrophobicContact CG-CG 3.51Å
572	F	95.4	Very high	90.1	Very high	47 Å²	47	52.9 Å²	52.9	21%	0.206	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-63.4	141	166.1	-73.5	-72.8	0	0	0	110.5	K484 W525 W559 V560 R561	K484-F572 VanDerWaalsContact CE-O 3.29Å; K484-F572 WeakPolarHBondContact CE-O 3.4Å; W525-F572 HydrophobicContact CD2-CE1 4.1Å; W525-F572 HydrophobicContact CD2-CE2 4.49Å; W525-F572 AromaticContact CD2-CZ 3.66Å; W525-F572 HydrophobicContact CD2-CZ 3.66Å; W525-F572 AromaticContact CE2-CZ 3.48Å; W525-F572 VanDerWaalsContact CE2-CZ 3.48Å; W525-F572 HydrophobicContact CE3-CE1 4.46Å; W525-F572 HydrophobicContact CE3-CE2 4.29Å; W525-F572 AromaticContact CE3-CZ 3.88Å; W525-F572 HydrophobicContact CE3-CZ 3.88Å; W525-F572 HydrophobicContact CG-CE1 4.34Å; W525-F572 HydrophobicContact CG-CZ 4.33Å; W525-F572 AromaticContact CH2-CE2 3.86Å; W525-F572 HydrophobicContact CH2-CE2 3.86Å; W525-F572 AromaticContact CH2-CZ 3.82Å; W525-F572 HydrophobicContact CH2-CZ 3.82Å; W525-F572 HydrophobicContact CZ2-CE2 4.06Å; W525-F572 AromaticContact CZ2-CZ 3.58Å; W525-F572 HydrophobicContact CZ2-CZ 3.58Å; W525-F572 AromaticContact CZ3-CE2 3.98Å; W525-F572 HydrophobicContact CZ3-CE2 3.98Å; W525-F572 AromaticContact CZ3-CZ 3.95Å; W525-F572 HydrophobicContact CZ3-CZ 3.95Å; W525-F572 AromaticContact NE1-CZ 3.99Å; W559-F572 HydrophobicContact CB-CB 4.47Å; W559-F572 HydrophobicContact CB-CD1 3.49Å; W559-F572 VanDerWaalsContact CB-CD1 3.49Å; W559-F572 HydrophobicContact CB-CE1 3.87Å; W559-F572 HydrophobicContact CB-CG 4.1Å; W559-F572 HydrophobicContact CG-CD1 4.46Å; V560-F572 WeakPolarHBondContact O-CA 3.27Å; R561-F572 HydrophobicContact CB-CD1 3.66Å; R561-F572 HydrophobicContact CB-CE1 3.93Å; R561-F572 HydrophobicContact CB-CG 4.13Å; R561-F572 HydrophobicContact CG-CD1 3.87Å; R561-F572 HydrophobicContact CG-CE1 3.57Å; R561-F572 HydrophobicContact CG-CZ 3.97Å
573	A	93.7	Very high	89.8	Confident	9 Å²	9	55.8 Å²	55.8	7%	0.074	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-66.7	170.5	162.9	0	0	0	0	0	110.7	V485 V560	V485-A573 HydrophobicContact CG2-CB 3.46Å; V485-A573 VanDerWaalsContact CG2-CB 3.46Å; V560-A573 PolarHBondContact O-N 3.27Å
574	D	92.8	Very high	89.7	Confident	120 Å²	120	58.5 Å²	58.5	64%	0.642	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-63.3	143.9	177.8	-52.2	-29.1	0	0	0	109.4	K484 L576	K484-D574 IonicContact NZ-OD1 2.7Å; K484-D574 PolarHBondContact NZ-OD1 2.82Å; D574-L576 PolarHBondContact O-N 3.18Å
575	V	94.7	Very high	89.7	Confident	66 Å²	66	61.9 Å²	61.9	40%	0.4	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-61.4	131.3	-174.2	64	0	0	0	0	110.2	L557 W559	L557-V575 HydrophobicContact CB-CG2 3.91Å; L557-V575 HydrophobicContact CD2-CG2 4.19Å; W559-V575 HydrophobicContact CD2-CG2 4.16Å; W559-V575 HydrophobicContact CH2-CG2 4.27Å; W559-V575 HydrophobicContact CZ2-CB 4.35Å; W559-V575 HydrophobicContact CZ2-CG2 3.64Å
576	L	94.6	Very high	90.3	Very high	27 Å²	27	61.5 Å²	61.5	14%	0.141	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.5	169.3	-56.5	176.2	0	0	0	109.2	A488 C490 V504 L557 V558 D574	A488-L576 HydrophobicContact CB-CD1 3.81Å; A488-L576 HydrophobicContact CB-CD2 4.07Å; A488-L576 HydrophobicContact CB-CG 4.18Å; A488-L576 VanDerWaalsContact O-CD2 3.24Å; A488-L576 WeakPolarHBondContact O-CD2 3.39Å; C490-L576 HydrophobicContact CB-CD1 4.5Å; V504-L576 HydrophobicContact CG1-CD1 4.04Å; L557-L576 CarbonylContact C-O 3.24Å; L557-L576 WeakPolarHBondContact CA-O 3.15Å; V558-L576 HydrophobicContact CB-CB 4.19Å; V558-L576 PolarHBondContact N-O 3.48Å; V558-L576 PolarHBondContact O-N 3.14Å; D574-L576 PolarHBondContact O-N 3.18Å
577	V	95.1	Very high	91.2	Very high	91 Å²	91	55.7 Å²	55.7	55%	0.552	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	114.2	171.3	-175.1	0	0	0	0	107.1	T555 L557	T555-V577 HydrophobicContact CG2-CG1 3.44Å; T555-V577 VanDerWaalsContact CG2-CG1 3.44Å; L557-V577 HydrophobicContact CD2-CG2 3.93Å
578	C	93	Very high	92.2	Very high	4 Å²	4	49.5 Å²	49.5	3%	0.027	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	111.6	-170.6	-52.7	0	0	0	0	109.7	C490 L502 T555 Y556 V558	C490-C578 HydrophobicContact CB-CB 3.84Å; C490-C578 WeakPolarHBondContact CB-SG 3.4Å; C490-C578 VanDerWaalsContact SG-CA 3.57Å; C490-C578 WeakPolarHBondContact SG-CB 3.32Å; C490-C578 CovalentContact SG-SG 2.02Å; C490-C578 PolarHBondContact SG-SG 3.12Å; L502-C578 HydrophobicContact CD1-CB 3.59Å; L502-C578 HydrophobicContact CD2-CB 4.26Å; T555-C578 CarbonylContact C-O 3.41Å; Y556-C578 PolarHBondContact N-O 3.1Å; Y556-C578 PolarHBondContact O-N 3.06Å; V558-C578 HydrophobicContact CG2-CB 4.4Å
579	S	90.9	Very high	92.8	Very high	75 Å²	75	50.8 Å²	50.8	52%	0.524	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.9	177.8	-57.4	0	0	0	0	109.8	A492 T554 T555	A492-S579 VanDerWaalsContact CB-O 3.28Å; A492-S579 WeakPolarHBondContact CB-O 3.46Å; T554-S579 WeakPolarHBondContact O-CA 3.34Å; T555-S579 PolarHBondContact OG1-OG 3.11Å
580	T	85.5	Confident	92.9	Very high	24 Å²	24	48.5 Å²	48.5	15%	0.147	29%	0.291	C	S	.	.			trans	-82.7	0	176.5	46.1	0	0	0	0	112.9	A492 V494 A500 L502 I550 K551 F553 T554 Y556	A492-T580 HydrophobicContact CB-CG2 3.85Å; V494-T580 WeakPolarHBondContact CG2-OXT 3.27Å; A500-T580 HydrophobicContact CB-CG2 4.23Å; L502-T580 HydrophobicContact CB-CG2 4.24Å; I550-T580 HydrophobicContact CG2-CG2 3.49Å; I550-T580 VanDerWaalsContact CG2-CG2 3.49Å; K551-T580 WeakPolarHBondContact O-CB 3.48Å; K551-T580 PolarHBondContact O-OG1 3Å; F553-T580 WeakPolarHBondContact CA-O 3.22Å; F553-T580 PolarHBondContact N-O 3.04Å; T554-T580 PolarHBondContact N-OG1 3.48Å; T554-T580 VanDerWaalsContact N-OG1 3.08Å; T554-T580 PolarHBondContact O-N 3.09Å; T554-T580 PolarHBondContact O-OG1 3.46Å; Y556-T580 HydrophobicContact CD2-CG2 4.25Å; Y556-T580 HydrophobicContact CE2-CG2 4.17Å

Retrieved 580 of 580 residues in 270 ms (Link to these results)

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