A0A087X6U9_POEFO Loading...

Leucine-rich repeat-containing protein 41

AlphaFold DB , UniProt , Accession A0A087X6U9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 651 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	36.7	Very low	33.1	Very low	242 Å²	242	163.1 Å²	163.1	100%	1.192	84%	0.837	S	S	*	*				0	137.2	0	-134.7	168.8	175.2	0	0	106.3
2	E	29.8	Very low	34.1	Very low	187 Å²	187	163.8 Å²	163.8	87%	0.874	84%	0.844	S	S	*	*			trans	77.3	88.3	-177.4	-57.7	-166.5	159	0	0	117
3	G	32.9	Very low	36.2	Very low	72 Å²	72	158.8 Å²	158.8	74%	0.742	82%	0.818	S	S	*	*			trans	-78.8	148	151.2	0	0	0	0	0	111.3
4	K	29.1	Very low	39.5	Very low	194 Å²	194	151.6 Å²	151.6	84%	0.843	79%	0.788	S	S	*	*			trans	-140.8	88.4	157.7	-91.8	175.9	176.9	168	0	105.5
5	I	31	Very low	42.5	Very low	143 Å²	143	150.1 Å²	150.1	73%	0.733	78%	0.781	S	S	*	*				55.2	84.7	105.6	-57.1	172.1	0	0	0	110.3	L7	I5-L7 PolarHBondContact O-N 3.44Å; I5-L7 VanDerWaalsContact O-N 3.15Å
6	E	27.9	Very low	45.1	Very low	185 Å²	185	146.3 Å²	146.3	86%	0.864	76%	0.758	S	S	*	*			trans	-61.1	107.4	154	-77.8	-177.5	149.7	0	0	107.8	R8	E6-R8 VanDerWaalsContact C-N 3.28Å; E6-R8 PolarHBondContact O-N 3.35Å
7	L	30.2	Very low	47.4	Very low	154 Å²	154	144.6 Å²	144.6	81%	0.806	74%	0.744	S	S	*	*			trans	-63.8	92.1	165.9	-96.8	113.5	0	0	0	108.8	I5 K9	I5-L7 PolarHBondContact O-N 3.44Å; I5-L7 VanDerWaalsContact O-N 3.15Å; L7-K9 PolarHBondContact O-N 3.2Å
8	R	33	Very low	49.7	Very low	226 Å²	226	142.8 Å²	142.8	85%	0.853	73%	0.731	S	S	*	*			trans	-56.7	106.1	154.2	-79	-178.5	174	-179.8	-1.9	107.4	E6 S10	E6-R8 VanDerWaalsContact C-N 3.28Å; E6-R8 PolarHBondContact O-N 3.35Å; R8-S10 PolarHBondContact O-N 3.09Å
9	K	32.3	Very low	51.8	Low	204 Å²	204	138.7 Å²	138.7	89%	0.887	72%	0.716	S	S	*	*			trans	-65.3	85.6	161.3	-80.6	-179.7	175	177.3	0	108.2	L7 A11	L7-K9 PolarHBondContact O-N 3.2Å; K9-A11 PolarHBondContact O-N 2.98Å
10	S	37.8	Very low	53.8	Low	103 Å²	103	132.6 Å²	132.6	72%	0.72	68%	0.684	S	S	*	*			trans	-70.8	106.8	160.1	56	0	0	0	0	107.2	R8 D12	R8-S10 PolarHBondContact O-N 3.09Å; S10-D12 PolarHBondContact O-N 3.36Å
11	A	43.7	Very low	55.4	Low	84 Å²	84	130.5 Å²	130.5	69%	0.694	67%	0.671	S	S	*	*			trans	-58.3	128.3	165.1	0	0	0	0	0	108.1	K9 I13	K9-A11 PolarHBondContact O-N 2.98Å; A11-I13 PolarHBondContact O-N 3.47Å
12	D	44.8	Very low	57.9	Low	172 Å²	172	121.3 Å²	121.3	92%	0.92	63%	0.633	S	S	*	*			trans	-57.5	100	174.5	-104.9	-33.7	0	0	0	109.6	S10 S14	S10-D12 PolarHBondContact O-N 3.36Å; D12-S14 PolarHBondContact O-N 3.14Å
13	I	61.2	Low	60.8	Low	99 Å²	99	113.7 Å²	113.7	51%	0.508	60%	0.6	S	S	.	*			trans	-82.7	113.8	172.5	-59.1	175.1	0	0	0	106.3	A11 K17 Q18	A11-I13 PolarHBondContact O-N 3.47Å; I13-K17 HydrophobicContact CG2-CB 3.45Å; I13-K17 VanDerWaalsContact CG2-CB 3.45Å; I13-K17 HydrophobicContact CG2-CD 4.2Å; I13-K17 HydrophobicContact CG2-CG 4.48Å; I13-Q18 HydrophobicContact CB-CG 4.4Å; I13-Q18 HydrophobicContact CG2-CG 3.9Å; I13-Q18 PolarHBondContact O-NE2 3.22Å; I13-Q18 VanDerWaalsContact O-NE2 3.12Å
14	S	82.5	Confident	63.4	Low	57 Å²	57	111.9 Å²	111.9	40%	0.399	57%	0.571	S	S	.	*			trans	-51.7	146.7	178.2	65.5	0	0	0	0	111.9	D12 Q16 K17 Q18	D12-S14 PolarHBondContact O-N 3.14Å; S14-Q16 PolarHBondContact O-N 3.07Å; S14-Q16 VanDerWaalsContact O-N 3.1Å; S14-K17 WeakPolarHBondContact O-CB 3.48Å; S14-K17 PolarHBondContact O-N 3.44Å; S14-K17 PolarHBondContact OG-N 2.99Å; S14-Q18 PolarHBondContact O-N 3.46Å; S14-Q18 VanDerWaalsContact O-N 3.15Å
15	L	85.3	Confident	66.2	Low	130 Å²	130	106.8 Å²	106.8	68%	0.681	56%	0.556	S	S	*	*	H	α-helix	trans	-49.9	-39.6	177.3	-180	64.7	0	0	0	111.7	K17 Q18 C19	L15-K17 PolarHBondContact O-N 2.95Å; L15-Q18 WeakPolarHBondContact O-CB 3.3Å; L15-Q18 PolarHBondContact O-N 3.33Å; L15-C19 PolarHBondContact O-N 3.36Å; L15-C19 PolarHBondContact O-SG 2.96Å
16	Q	84.1	Confident	68.9	Low	89 Å²	89	105.1 Å²	105.1	42%	0.416	55%	0.545	S	S	.	.	H	α-helix	trans	-56.3	-47.5	175.8	-171	-175.7	23.3	0	0	112.5	S14 Q18 C19 F20 D45	S14-Q16 PolarHBondContact O-N 3.07Å; S14-Q16 VanDerWaalsContact O-N 3.1Å; Q16-Q18 VanDerWaalsContact C-N 3.33Å; Q16-Q18 PolarHBondContact O-N 3.43Å; Q16-C19 PolarHBondContact O-N 3.24Å; Q16-F20 HydrophobicContact CG-CD2 4.18Å; Q16-F20 HydrophobicContact CG-CE1 4.3Å; Q16-F20 HydrophobicContact CG-CE2 3.57Å; Q16-F20 HydrophobicContact CG-CZ 3.64Å; Q16-F20 VanDerWaalsContact O-CG 3.32Å; Q16-F20 WeakPolarHBondContact O-CG 3.25Å; Q16-F20 PolarHBondContact O-N 2.99Å; Q16-D45 PolarHBondContact NE2-OD2 2.97Å
17	K	84.4	Confident	71.8	Confident	117 Å²	117	96.5 Å²	96.5	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-65.9	-35.5	177.7	-77.6	-179.4	178.4	-179.2	0	112.2	I13 S14 L15 F20 Q21	I13-K17 HydrophobicContact CG2-CB 3.45Å; I13-K17 VanDerWaalsContact CG2-CB 3.45Å; I13-K17 HydrophobicContact CG2-CD 4.2Å; I13-K17 HydrophobicContact CG2-CG 4.48Å; S14-K17 WeakPolarHBondContact O-CB 3.48Å; S14-K17 PolarHBondContact O-N 3.44Å; S14-K17 PolarHBondContact OG-N 2.99Å; L15-K17 PolarHBondContact O-N 2.95Å; K17-F20 PolarHBondContact O-N 3.27Å; K17-Q21 WeakPolarHBondContact O-CB 3.19Å; K17-Q21 PolarHBondContact O-N 2.83Å
18	Q	87.9	Confident	74.4	Confident	112 Å²	112	95.2 Å²	95.2	52%	0.523	50%	0.503	S	S	.	.	H	α-helix	trans	-65.2	-43.2	174.9	-61.6	-176.2	13.6	0	0	111.2	I13 S14 L15 Q16 Q21 A22	I13-Q18 HydrophobicContact CB-CG 4.4Å; I13-Q18 HydrophobicContact CG2-CG 3.9Å; I13-Q18 PolarHBondContact O-NE2 3.22Å; I13-Q18 VanDerWaalsContact O-NE2 3.12Å; S14-Q18 PolarHBondContact O-N 3.46Å; S14-Q18 VanDerWaalsContact O-N 3.15Å; L15-Q18 WeakPolarHBondContact O-CB 3.3Å; L15-Q18 PolarHBondContact O-N 3.33Å; Q16-Q18 VanDerWaalsContact C-N 3.33Å; Q16-Q18 PolarHBondContact O-N 3.43Å; Q18-Q21 PolarHBondContact O-N 2.71Å; Q18-A22 PolarHBondContact O-N 3.14Å
19	C	89.6	Confident	77	Confident	65 Å²	65	88.6 Å²	88.6	44%	0.439	50%	0.496	S	S	.	.	H	α-helix	trans	-61.4	-45.1	174.7	-67.4	0	0	0	0	111.9	L15 Q16 Q21 A22 V23	L15-C19 PolarHBondContact O-N 3.36Å; L15-C19 PolarHBondContact O-SG 2.96Å; Q16-C19 PolarHBondContact O-N 3.24Å; C19-Q21 VanDerWaalsContact C-N 3.31Å; C19-Q21 PolarHBondContact O-N 2.9Å; C19-A22 WeakPolarHBondContact O-CB 3.35Å; C19-A22 PolarHBondContact O-N 3.46Å; C19-A22 VanDerWaalsContact O-N 3.15Å; C19-V23 WeakPolarHBondContact O-CG2 3.42Å; C19-V23 PolarHBondContact O-N 3.25Å
20	F	91.6	Very high	79.7	Confident	17 Å²	17	82.8 Å²	82.8	8%	0.075	48%	0.475	C	S	.	.	H	α-helix	trans	-63.2	-37.8	176.9	-65.3	-20.4	0	0	0	112.7	Q16 K17 A22 V23 R24 D45 L46 H49	Q16-F20 HydrophobicContact CG-CD2 4.18Å; Q16-F20 HydrophobicContact CG-CE1 4.3Å; Q16-F20 HydrophobicContact CG-CE2 3.57Å; Q16-F20 HydrophobicContact CG-CZ 3.64Å; Q16-F20 VanDerWaalsContact O-CG 3.32Å; Q16-F20 WeakPolarHBondContact O-CG 3.25Å; Q16-F20 PolarHBondContact O-N 2.99Å; K17-F20 PolarHBondContact O-N 3.27Å; F20-A22 VanDerWaalsContact C-N 3.34Å; F20-V23 PolarHBondContact O-N 3.16Å; F20-R24 WeakPolarHBondContact O-CB 3.48Å; F20-R24 PolarHBondContact O-N 3.21Å; F20-D45 HydrophobicContact CE2-CB 3.78Å; F20-D45 WeakPolarHBondContact CE2-O 3.47Å; F20-D45 HydrophobicContact CZ-CB 3.61Å; F20-L46 HydrophobicContact CB-CD1 3.86Å; F20-L46 HydrophobicContact CD1-CB 4.13Å; F20-L46 HydrophobicContact CD1-CD1 3.57Å; F20-L46 HydrophobicContact CD1-CG 4.42Å; F20-L46 HydrophobicContact CE1-CB 3.99Å; F20-L46 HydrophobicContact CE1-CD1 4.29Å; F20-L46 HydrophobicContact CG-CD1 3.86Å; F20-L46 HydrophobicContact CZ-CB 4.39Å; F20-H49 HydrophobicContact CB-CB 4.12Å; F20-H49 AromaticContact CD2-CD2 3.35Å; F20-H49 WeakPolarHBondContact CD2-CD2 3.32Å; F20-H49 AromaticContact CD2-NE2 3.65Å
21	Q	88.1	Confident	82	Confident	89 Å²	89	79.3 Å²	79.3	42%	0.416	46%	0.455	S	S	.	.	H	α-helix	trans	-64.9	-39.3	173.6	-171.1	64.7	21.4	0	0	111.7	K17 Q18 C19 R24 T25	K17-Q21 WeakPolarHBondContact O-CB 3.19Å; K17-Q21 PolarHBondContact O-N 2.83Å; Q18-Q21 PolarHBondContact O-N 2.71Å; C19-Q21 VanDerWaalsContact C-N 3.31Å; C19-Q21 PolarHBondContact O-N 2.9Å; Q21-R24 PolarHBondContact O-N 3.39Å; Q21-T25 PolarHBondContact O-N 2.79Å; Q21-T25 PolarHBondContact O-OG1 2.93Å; Q21-T25 VanDerWaalsContact O-OG1 3.13Å
22	A	89	Confident	84.1	Confident	48 Å²	48	78.3 Å²	78.3	40%	0.397	44%	0.437	S	S	.	.	H	α-helix	trans	-64	-43.7	174.7	0	0	0	0	0	111.6	Q18 C19 F20 R24 T25 H26	Q18-A22 PolarHBondContact O-N 3.14Å; C19-A22 WeakPolarHBondContact O-CB 3.35Å; C19-A22 PolarHBondContact O-N 3.46Å; C19-A22 VanDerWaalsContact O-N 3.15Å; F20-A22 VanDerWaalsContact C-N 3.34Å; A22-R24 VanDerWaalsContact C-N 3.34Å; A22-R24 PolarHBondContact O-N 2.62Å; A22-T25 PolarHBondContact O-N 3.13Å; A22-H26 WeakPolarHBondContact O-CB 3.48Å; A22-H26 PolarHBondContact O-CD2 3.45Å; A22-H26 PolarHBondContact O-N 3Å
23	V	89.8	Confident	86.2	Confident	28 Å²	28	76.5 Å²	76.5	17%	0.17	42%	0.423	C	S	.	.	H	α-helix	trans	-59.2	-45.6	174.5	173.4	0	0	0	0	110.9	C19 F20 T25 F27 L30 V35 L46	C19-V23 WeakPolarHBondContact O-CG2 3.42Å; C19-V23 PolarHBondContact O-N 3.25Å; F20-V23 PolarHBondContact O-N 3.16Å; V23-T25 PolarHBondContact O-N 2.87Å; V23-F27 VanDerWaalsContact O-CA 3.25Å; V23-F27 WeakPolarHBondContact O-CA 3.47Å; V23-F27 WeakPolarHBondContact O-CB 3.27Å; V23-F27 PolarHBondContact O-N 3.21Å; V23-L30 HydrophobicContact CB-CD1 4.27Å; V23-L30 HydrophobicContact CG1-CD1 4.11Å; V23-L30 HydrophobicContact CG2-CD1 4.2Å; V23-V35 HydrophobicContact CG1-CG2 4.35Å; V23-L46 HydrophobicContact CB-CD1 4.09Å; V23-L46 HydrophobicContact CG1-CD1 3.95Å; V23-L46 HydrophobicContact CG1-CD2 3.86Å
24	R	89	Confident	87.5	Confident	34 Å²	34	74.2 Å²	74.2	13%	0.128	42%	0.419	C	S	.	.	H	α-helix	trans	-58.6	-45.7	175.9	-178.5	-161.7	177.5	117.9	-7.4	112	F20 Q21 A22 H49 T51 Q54 N119	F20-R24 WeakPolarHBondContact O-CB 3.48Å; F20-R24 PolarHBondContact O-N 3.21Å; Q21-R24 PolarHBondContact O-N 3.39Å; A22-R24 VanDerWaalsContact C-N 3.34Å; A22-R24 PolarHBondContact O-N 2.62Å; R24-H49 VanDerWaalsContact CD-O 3.32Å; R24-H49 WeakPolarHBondContact CD-O 3.46Å; R24-H49 PolarHBondContact NH1-O 3.4Å; R24-T51 HydrophobicContact CG-CG2 4.32Å; R24-Q54 PolarHBondContact O-NE2 2.89Å; R24-N119 PolarHBondContact NH2-OD1 3.41Å
25	T	87.2	Confident	87.8	Confident	87 Å²	87	71.7 Å²	71.7	53%	0.534	40%	0.401	S	S	.	.	H	α-helix	trans	-71.7	-38.5	-176.9	-63.4	0	0	0	0	112.4	Q21 A22 V23	Q21-T25 PolarHBondContact O-N 2.79Å; Q21-T25 PolarHBondContact O-OG1 2.93Å; Q21-T25 VanDerWaalsContact O-OG1 3.13Å; A22-T25 PolarHBondContact O-N 3.13Å; V23-T25 PolarHBondContact O-N 2.87Å
26	H	88.2	Confident	88	Confident	108 Å²	108	66.1 Å²	66.1	50%	0.5	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	18.1	-175.2	-61.3	-68.2	0	0	0	113.6	A22 T28 A29 L30	A22-H26 WeakPolarHBondContact O-CB 3.48Å; A22-H26 PolarHBondContact O-CD2 3.45Å; A22-H26 PolarHBondContact O-N 3Å; H26-T28 VanDerWaalsContact C-N 3.33Å; H26-T28 PolarHBondContact O-N 2.96Å; H26-A29 WeakPolarHBondContact O-CB 3.36Å; H26-A29 PolarHBondContact O-N 3.37Å; H26-L30 WeakPolarHBondContact O-CG 3.39Å; H26-L30 PolarHBondContact O-N 2.99Å
27	F	88.2	Confident	88.3	Confident	4 Å²	4	68 Å²	68	2%	0.018	39%	0.385	C	S	.	.	H	α-helix	trans	-52.8	-45.8	-173.4	-170.3	-86.9	0	0	0	113.7	V23 A29 L30 G31 I32 V35 L50 Q54 I58	V23-F27 VanDerWaalsContact O-CA 3.25Å; V23-F27 WeakPolarHBondContact O-CA 3.47Å; V23-F27 WeakPolarHBondContact O-CB 3.27Å; V23-F27 PolarHBondContact O-N 3.21Å; F27-A29 VanDerWaalsContact C-N 3.31Å; F27-A29 PolarHBondContact O-N 3.18Å; F27-L30 PolarHBondContact O-N 3.18Å; F27-G31 PolarHBondContact O-N 3.11Å; F27-I32 HydrophobicContact CE1-CG1 4.31Å; F27-V35 HydrophobicContact CD2-CG2 4.18Å; F27-V35 HydrophobicContact CE2-CB 4.42Å; F27-V35 HydrophobicContact CE2-CG1 4.18Å; F27-V35 HydrophobicContact CE2-CG2 3.91Å; F27-L50 HydrophobicContact CD2-CD2 4.18Å; F27-L50 HydrophobicContact CE2-CD1 4.48Å; F27-L50 HydrophobicContact CE2-CD2 4.26Å; F27-Q54 HydrophobicContact CB-CG 4.25Å; F27-Q54 HydrophobicContact CD1-CB 4.4Å; F27-Q54 HydrophobicContact CD1-CG 3.7Å; F27-Q54 HydrophobicContact CD2-CB 4.25Å; F27-Q54 HydrophobicContact CD2-CG 3.94Å; F27-Q54 HydrophobicContact CE1-CB 4.19Å; F27-Q54 HydrophobicContact CE1-CG 3.96Å; F27-Q54 HydrophobicContact CE2-CB 4.03Å; F27-Q54 HydrophobicContact CE2-CG 4.19Å; F27-Q54 HydrophobicContact CG-CB 4.43Å; F27-Q54 HydrophobicContact CG-CG 3.69Å; F27-Q54 HydrophobicContact CZ-CB 4.01Å; F27-Q54 HydrophobicContact CZ-CG 4.21Å; F27-I58 HydrophobicContact CE2-CG2 4.32Å; F27-I58 HydrophobicContact CZ-CG2 3.62Å
28	T	85.2	Confident	88.5	Confident	126 Å²	126	65 Å²	65	77%	0.773	37%	0.374	S	S	*	.	H	α-helix	trans	-66.1	-32.9	178.7	45.3	0	0	0	0	112.9	H26	H26-T28 VanDerWaalsContact C-N 3.33Å; H26-T28 PolarHBondContact O-N 2.96Å
29	A	87.9	Confident	88.6	Confident	87 Å²	87	63.2 Å²	63.2	72%	0.719	37%	0.372	S	S	*	.	H	α-helix	trans	-77.4	-31.7	177.4	0	0	0	0	0	112.4	H26 F27	H26-A29 WeakPolarHBondContact O-CB 3.36Å; H26-A29 PolarHBondContact O-N 3.37Å; F27-A29 VanDerWaalsContact C-N 3.31Å; F27-A29 PolarHBondContact O-N 3.18Å
30	L	87.6	Confident	88.4	Confident	83 Å²	83	62.6 Å²	62.6	44%	0.435	37%	0.366	S	S	.	.	H	α-helix	trans	-70.6	-35.9	175.1	-69.6	169.2	0	0	0	111.8	V23 H26 F27 A34	V23-L30 HydrophobicContact CB-CD1 4.27Å; V23-L30 HydrophobicContact CG1-CD1 4.11Å; V23-L30 HydrophobicContact CG2-CD1 4.2Å; H26-L30 WeakPolarHBondContact O-CG 3.39Å; H26-L30 PolarHBondContact O-N 2.99Å; F27-L30 PolarHBondContact O-N 3.18Å; L30-A34 VanDerWaalsContact O-CB 3.3Å; L30-A34 WeakPolarHBondContact O-CB 3.48Å
31	G	87.1	Confident	88.2	Confident	29 Å²	29	65.9 Å²	65.9	30%	0.299	39%	0.39	S	S	.	.			trans	80.5	152.5	-174.7	0	0	0	0	0	112.6	F27 E33 A34	F27-G31 PolarHBondContact O-N 3.11Å; G31-E33 PolarHBondContact O-N 3.34Å; G31-A34 PolarHBondContact O-N 3.23Å
32	I	88	Confident	88.2	Confident	64 Å²	64	65.2 Å²	65.2	33%	0.328	39%	0.389	S	S	.	.	H	α-helix	trans	-62.2	-43.3	-174.6	-66.9	169.8	0	0	0	111.2	F27 A34 V35 L36 E57 I58	F27-I32 HydrophobicContact CE1-CG1 4.31Å; I32-A34 PolarHBondContact O-N 3.46Å; I32-V35 PolarHBondContact O-N 3.31Å; I32-L36 HydrophobicContact CG2-CD1 3.62Å; I32-L36 HydrophobicContact CG2-CG 4.07Å; I32-L36 WeakPolarHBondContact O-CG 3.38Å; I32-L36 PolarHBondContact O-N 3.24Å; I32-E57 HydrophobicContact CD1-CB 4.16Å; I32-I58 HydrophobicContact CG2-CG2 4.29Å
33	E	88.8	Confident	88.1	Confident	134 Å²	134	63.1 Å²	63.1	63%	0.626	37%	0.371	S	S	*	.	H	α-helix	trans	-59.2	-44.5	-177.8	-60.6	-59.5	159.2	0	0	112.1	G31 V35 L36 D37	G31-E33 PolarHBondContact O-N 3.34Å; E33-V35 VanDerWaalsContact C-N 3.27Å; E33-V35 PolarHBondContact O-N 3.39Å; E33-L36 CarbonylContact O-C 3.58Å; E33-L36 PolarHBondContact O-N 3.01Å; E33-L36 VanDerWaalsContact O-N 3.07Å; E33-D37 PolarHBondContact O-N 3.48Å
34	A	87.9	Confident	87.9	Confident	50 Å²	50	67.5 Å²	67.5	41%	0.413	39%	0.387	S	S	.	.	H	α-helix	trans	-63.8	-32.9	179.8	0	0	0	0	0	112.9	L30 G31 I32	L30-A34 VanDerWaalsContact O-CB 3.3Å; L30-A34 WeakPolarHBondContact O-CB 3.48Å; G31-A34 PolarHBondContact O-N 3.23Å; I32-A34 PolarHBondContact O-N 3.46Å
35	V	89.1	Confident	87.9	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.024	40%	0.401	C	S	.	.	H	α-helix	trans	-72.7	-41.4	174.1	178.6	0	0	0	0	110.1	V23 F27 I32 E33 D37 L38 L43 L46	V23-V35 HydrophobicContact CG1-CG2 4.35Å; F27-V35 HydrophobicContact CD2-CG2 4.18Å; F27-V35 HydrophobicContact CE2-CB 4.42Å; F27-V35 HydrophobicContact CE2-CG1 4.18Å; F27-V35 HydrophobicContact CE2-CG2 3.91Å; I32-V35 PolarHBondContact O-N 3.31Å; E33-V35 VanDerWaalsContact C-N 3.27Å; E33-V35 PolarHBondContact O-N 3.39Å; V35-D37 VanDerWaalsContact C-N 3.29Å; V35-D37 PolarHBondContact O-N 2.79Å; V35-L38 HydrophobicContact CG1-CD1 4.43Å; V35-L38 VanDerWaalsContact O-CB 3.31Å; V35-L38 WeakPolarHBondContact O-CB 3.46Å; V35-L38 VanDerWaalsContact O-CG 3.31Å; V35-L38 WeakPolarHBondContact O-CG 3.23Å; V35-L38 PolarHBondContact O-N 3.28Å; V35-L43 HydrophobicContact CG1-CD2 4.37Å; V35-L43 VanDerWaalsContact O-CD2 3.31Å; V35-L43 WeakPolarHBondContact O-CD2 3.45Å; V35-L46 HydrophobicContact CG1-CD2 3.98Å
36	L	89.6	Confident	88.1	Confident	13 Å²	13	65.4 Å²	65.4	7%	0.068	38%	0.376	C	S	.	.	H	α-helix	trans	-65.8	-30.8	178.1	-67	174.6	0	0	0	112.2	I32 E33 L38 I58 A61 L62 R65	I32-L36 HydrophobicContact CG2-CD1 3.62Å; I32-L36 HydrophobicContact CG2-CG 4.07Å; I32-L36 WeakPolarHBondContact O-CG 3.38Å; I32-L36 PolarHBondContact O-N 3.24Å; E33-L36 CarbonylContact O-C 3.58Å; E33-L36 PolarHBondContact O-N 3.01Å; E33-L36 VanDerWaalsContact O-N 3.07Å; L36-L38 PolarHBondContact O-N 3.01Å; L36-L38 VanDerWaalsContact O-N 3.16Å; L36-I58 HydrophobicContact CD2-CB 4.32Å; L36-A61 HydrophobicContact CD1-CB 3.48Å; L36-A61 VanDerWaalsContact CD1-CB 3.48Å; L36-A61 HydrophobicContact CD2-CB 3.95Å; L36-A61 HydrophobicContact CG-CB 4.39Å; L36-L62 HydrophobicContact CD2-CD2 3.7Å; L36-L62 HydrophobicContact CD2-CG 3.91Å; L36-R65 PolarHBondContact O-NH1 3.31Å
37	D	89.6	Confident	88.3	Confident	129 Å²	129	60.5 Å²	60.5	69%	0.69	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-9.5	177.7	-73.9	-22.9	0	0	0	114	E33 V35	E33-D37 PolarHBondContact O-N 3.48Å; V35-D37 VanDerWaalsContact C-N 3.29Å; V35-D37 PolarHBondContact O-N 2.79Å
38	L	88.4	Confident	88.4	Confident	54 Å²	54	62 Å²	62	28%	0.283	36%	0.363	S	S	.	.	S	Bend	trans	-62.4	144.9	176.9	-68.4	174.9	0	0	0	112.1	V35 L36 L43 L46	V35-L38 HydrophobicContact CG1-CD1 4.43Å; V35-L38 VanDerWaalsContact O-CB 3.31Å; V35-L38 WeakPolarHBondContact O-CB 3.46Å; V35-L38 VanDerWaalsContact O-CG 3.31Å; V35-L38 WeakPolarHBondContact O-CG 3.23Å; V35-L38 PolarHBondContact O-N 3.28Å; L36-L38 PolarHBondContact O-N 3.01Å; L36-L38 VanDerWaalsContact O-N 3.16Å; L38-L43 HydrophobicContact CB-CD1 4.48Å; L38-L43 HydrophobicContact CB-CD2 4.09Å; L38-L43 HydrophobicContact CB-CG 3.82Å; L38-L43 HydrophobicContact CD1-CD2 4.45Å; L38-L43 WeakPolarHBondContact O-CD1 3.31Å; L38-L46 HydrophobicContact CD1-CD2 3.91Å
39	P	89.9	Confident	88.7	Confident	75 Å²	75	58.7 Å²	58.7	49%	0.487	34%	0.338	S	S	.	.			trans	-55.3	141.6	172.2	-26.5	33.8	0	0	0	112.6	P41 L42 L43	P39-P41 VanDerWaalsContact C-CD 3.44Å; P39-P41 VanDerWaalsContact C-N 3.35Å; P39-P41 VanDerWaalsContact O-N 3.17Å; P39-L42 HydrophobicContact CB-CD1 4.49Å; P39-L42 HydrophobicContact CG-CD1 4.18Å; P39-L42 PolarHBondContact O-N 3.24Å; P39-L43 PolarHBondContact O-N 3.46Å
40	T	86.4	Confident	88.8	Confident	51 Å²	51	54.6 Å²	54.6	31%	0.313	31%	0.305	S	S	.	.	H	α-helix	trans	-49.9	-42.2	-177.2	-58.3	0	0	0	0	115.1	L43 K44 L67	T40-L43 PolarHBondContact O-N 2.73Å; T40-K44 HydrophobicContact CG2-CD 4.42Å; T40-K44 WeakPolarHBondContact O-CG 3.33Å; T40-K44 PolarHBondContact O-N 3.23Å; T40-L67 HydrophobicContact CG2-CD1 4.02Å; T40-L67 HydrophobicContact CG2-CD2 3.49Å; T40-L67 VanDerWaalsContact CG2-CD2 3.49Å; T40-L67 HydrophobicContact CG2-CG 4.41Å
41	P	86.4	Confident	88.9	Confident	87 Å²	87	50.9 Å²	50.9	57%	0.565	29%	0.285	S	S	*	.	H	α-helix	trans	-62.7	-42.8	176.6	-22.9	35.1	0	0	0	112.7	P39 K44 D45	P39-P41 VanDerWaalsContact C-CD 3.44Å; P39-P41 VanDerWaalsContact C-N 3.35Å; P39-P41 VanDerWaalsContact O-N 3.17Å; P41-K44 PolarHBondContact O-N 3.4Å; P41-D45 PolarHBondContact O-N 3.43Å; P41-D45 VanDerWaalsContact O-N 3.11Å
42	L	88.2	Confident	89.1	Confident	75 Å²	75	49.5 Å²	49.5	39%	0.393	27%	0.271	S	S	.	.	H	α-helix	trans	-68.5	-36.7	178.6	-69.9	175.6	0	0	0	112	P39 D45 L46	P39-L42 HydrophobicContact CB-CD1 4.49Å; P39-L42 HydrophobicContact CG-CD1 4.18Å; P39-L42 PolarHBondContact O-N 3.24Å; L42-D45 PolarHBondContact O-N 3.45Å; L42-L46 VanDerWaalsContact O-CB 3.27Å; L42-L46 WeakPolarHBondContact O-CB 3.38Å; L42-L46 PolarHBondContact O-N 3.09Å
43	L	87.8	Confident	89.2	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-49	171.6	-83.5	170.8	0	0	0	111.2	V35 L38 P39 T40 D45 L46 L47 L62 L67	V35-L43 HydrophobicContact CG1-CD2 4.37Å; V35-L43 VanDerWaalsContact O-CD2 3.31Å; V35-L43 WeakPolarHBondContact O-CD2 3.45Å; L38-L43 HydrophobicContact CB-CD1 4.48Å; L38-L43 HydrophobicContact CB-CD2 4.09Å; L38-L43 HydrophobicContact CB-CG 3.82Å; L38-L43 HydrophobicContact CD1-CD2 4.45Å; L38-L43 WeakPolarHBondContact O-CD1 3.31Å; P39-L43 PolarHBondContact O-N 3.46Å; T40-L43 PolarHBondContact O-N 2.73Å; L43-D45 VanDerWaalsContact C-N 3.27Å; L43-D45 PolarHBondContact O-N 3.07Å; L43-L46 PolarHBondContact O-N 2.87Å; L43-L46 VanDerWaalsContact O-N 3.12Å; L43-L47 WeakPolarHBondContact O-CG 3.4Å; L43-L47 PolarHBondContact O-N 3.42Å; L43-L62 HydrophobicContact CD1-CD2 4.1Å; L43-L67 HydrophobicContact CD1-CD1 4.23Å
44	K	86.4	Confident	89.3	Confident	120 Å²	120	41.6 Å²	41.6	52%	0.522	24%	0.235	S	C	.	.	H	α-helix	trans	-58.8	-39.9	179.4	-75.2	179.5	177.1	-176.7	0	112.4	T40 P41 P48	T40-K44 HydrophobicContact CG2-CD 4.42Å; T40-K44 WeakPolarHBondContact O-CG 3.33Å; T40-K44 PolarHBondContact O-N 3.23Å; P41-K44 PolarHBondContact O-N 3.4Å; K44-P48 WeakPolarHBondContact O-CD 3.44Å
45	D	88.4	Confident	89.6	Confident	78 Å²	78	39.2 Å²	39.2	42%	0.417	22%	0.215	S	C	.	.	H	α-helix	trans	-73.9	-29	178	-68.9	-9.4	0	0	0	112.8	Q16 F20 P41 L42 L43 P48 H49	Q16-D45 PolarHBondContact NE2-OD2 2.97Å; F20-D45 HydrophobicContact CE2-CB 3.78Å; F20-D45 WeakPolarHBondContact CE2-O 3.47Å; F20-D45 HydrophobicContact CZ-CB 3.61Å; P41-D45 PolarHBondContact O-N 3.43Å; P41-D45 VanDerWaalsContact O-N 3.11Å; L42-D45 PolarHBondContact O-N 3.45Å; L43-D45 VanDerWaalsContact C-N 3.27Å; L43-D45 PolarHBondContact O-N 3.07Å; D45-P48 WeakPolarHBondContact O-CD 3.26Å; D45-H49 PolarHBondContact O-CD2 3.35Å; D45-H49 VanDerWaalsContact O-CD2 3.27Å
46	L	92.1	Very high	89.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-75.6	-37.4	178.7	175	65.8	0	0	0	112.7	F20 V23 V35 L38 L42 L43 P48 H49 L50	F20-L46 HydrophobicContact CB-CD1 3.86Å; F20-L46 HydrophobicContact CD1-CB 4.13Å; F20-L46 HydrophobicContact CD1-CD1 3.57Å; F20-L46 HydrophobicContact CD1-CG 4.42Å; F20-L46 HydrophobicContact CE1-CB 3.99Å; F20-L46 HydrophobicContact CE1-CD1 4.29Å; F20-L46 HydrophobicContact CG-CD1 3.86Å; F20-L46 HydrophobicContact CZ-CB 4.39Å; V23-L46 HydrophobicContact CB-CD1 4.09Å; V23-L46 HydrophobicContact CG1-CD1 3.95Å; V23-L46 HydrophobicContact CG1-CD2 3.86Å; V35-L46 HydrophobicContact CG1-CD2 3.98Å; L38-L46 HydrophobicContact CD1-CD2 3.91Å; L42-L46 VanDerWaalsContact O-CB 3.27Å; L42-L46 WeakPolarHBondContact O-CB 3.38Å; L42-L46 PolarHBondContact O-N 3.09Å; L43-L46 PolarHBondContact O-N 2.87Å; L43-L46 VanDerWaalsContact O-N 3.12Å; L46-P48 VanDerWaalsContact C-CD 3.44Å; L46-H49 WeakPolarHBondContact O-CB 3.35Å; L46-H49 PolarHBondContact O-N 3.28Å; L46-L50 HydrophobicContact CD1-CD2 4.13Å; L46-L50 HydrophobicContact CG-CD1 4.44Å; L46-L50 HydrophobicContact CG-CD2 4.16Å; L46-L50 HydrophobicContact CG-CG 4.26Å
47	L	91.5	Very high	89.8	Confident	5 Å²	5	44.4 Å²	44.4	3%	0.026	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-48.4	-45.3	-172.8	-74.6	169.6	0	0	0	114.8	L43 H49 L50 L55 I58 L62 S68 T69	L43-L47 WeakPolarHBondContact O-CG 3.4Å; L43-L47 PolarHBondContact O-N 3.42Å; L47-H49 PolarHBondContact O-N 3.18Å; L47-H49 VanDerWaalsContact O-N 3.14Å; L47-L50 HydrophobicContact CD2-CD1 4.37Å; L47-L50 PolarHBondContact O-N 3.2Å; L47-L55 HydrophobicContact CD2-CD2 3.73Å; L47-I58 HydrophobicContact CD2-CD1 3.82Å; L47-L62 HydrophobicContact CD2-CD1 3.86Å; L47-S68 WeakPolarHBondContact CD1-O 3.47Å; L47-T69 HydrophobicContact CD2-CG2 4.04Å
48	P	90.6	Very high	89.9	Confident	34 Å²	34	38.3 Å²	38.3	22%	0.221	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-61	-21.1	177.5	-23.7	36.4	0	0	0	114.2	K44 D45 L46 E75	K44-P48 WeakPolarHBondContact O-CD 3.44Å; D45-P48 WeakPolarHBondContact O-CD 3.26Å; L46-P48 VanDerWaalsContact C-CD 3.44Å; P48-E75 HydrophobicContact CB-CB 4.01Å; P48-E75 HydrophobicContact CB-CG 3.88Å; P48-E75 VanDerWaalsContact O-CG 3.24Å; P48-E75 WeakPolarHBondContact O-CG 3.42Å
49	H	90.1	Very high	90.1	Very high	57 Å²	57	36.4 Å²	36.4	26%	0.264	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-90.3	-10.2	-177.1	-61.4	-72.5	0	0	0	113.7	F20 R24 D45 L46 L47	F20-H49 HydrophobicContact CB-CB 4.12Å; F20-H49 AromaticContact CD2-CD2 3.35Å; F20-H49 WeakPolarHBondContact CD2-CD2 3.32Å; F20-H49 AromaticContact CD2-NE2 3.65Å; R24-H49 VanDerWaalsContact CD-O 3.32Å; R24-H49 WeakPolarHBondContact CD-O 3.46Å; R24-H49 PolarHBondContact NH1-O 3.4Å; D45-H49 PolarHBondContact O-CD2 3.35Å; D45-H49 VanDerWaalsContact O-CD2 3.27Å; L46-H49 WeakPolarHBondContact O-CB 3.35Å; L46-H49 PolarHBondContact O-N 3.28Å; L47-H49 PolarHBondContact O-N 3.18Å; L47-H49 VanDerWaalsContact O-N 3.14Å
50	L	91.2	Very high	90.2	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	20%	0.197	C	C	.	.	S	Bend	trans	-79.9	159.6	-178	-61.7	-177.7	0	0	0	112.4	F27 L46 L47 Q54 L55 I58	F27-L50 HydrophobicContact CD2-CD2 4.18Å; F27-L50 HydrophobicContact CE2-CD1 4.48Å; F27-L50 HydrophobicContact CE2-CD2 4.26Å; L46-L50 HydrophobicContact CD1-CD2 4.13Å; L46-L50 HydrophobicContact CG-CD1 4.44Å; L46-L50 HydrophobicContact CG-CD2 4.16Å; L46-L50 HydrophobicContact CG-CG 4.26Å; L47-L50 HydrophobicContact CD2-CD1 4.37Å; L47-L50 PolarHBondContact O-N 3.2Å; L50-Q54 HydrophobicContact CB-CB 4.19Å; L50-L55 HydrophobicContact CB-CD2 3.97Å; L50-L55 HydrophobicContact CB-CG 3.95Å; L50-L55 HydrophobicContact CD1-CD2 4.12Å; L50-I58 HydrophobicContact CD1-CD1 3.42Å; L50-I58 VanDerWaalsContact CD1-CD1 3.42Å
51	T	90.5	Very high	90.4	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.025	20%	0.195	C	C	.	.			trans	-84.5	162.4	173.6	64.1	0	0	0	0	111.4	R24 C53 Q54 L55 N119	R24-T51 HydrophobicContact CG-CG2 4.32Å; T51-C53 VanDerWaalsContact C-N 3.28Å; T51-C53 PolarHBondContact O-N 3.31Å; T51-Q54 PolarHBondContact O-N 3.42Å; T51-Q54 VanDerWaalsContact O-N 3.14Å; T51-Q54 VanDerWaalsContact OG1-CG 3.26Å; T51-Q54 WeakPolarHBondContact OG1-CG 3.35Å; T51-Q54 PolarHBondContact OG1-N 3.15Å; T51-Q54 PolarHBondContact OG1-OE1 3.29Å; T51-L55 WeakPolarHBondContact O-CG 3.35Å; T51-L55 PolarHBondContact O-N 2.92Å; T51-N119 WeakPolarHBondContact CG2-OD1 3.2Å
52	A	90.6	Very high	90.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-53.9	-41.5	176.3	0	0	0	0	0	113.1	L55 D56 W73 I76 V99 L103 Y115	A52-L55 PolarHBondContact O-N 2.92Å; A52-D56 WeakPolarHBondContact O-CB 3.44Å; A52-D56 PolarHBondContact O-N 3.38Å; A52-W73 HydrophobicContact CB-CZ3 4.02Å; A52-W73 WeakPolarHBondContact O-CH2 3.41Å; A52-I76 HydrophobicContact CB-CD1 4.12Å; A52-V99 HydrophobicContact CB-CG1 4.28Å; A52-L103 HydrophobicContact CB-CD1 3.49Å; A52-L103 VanDerWaalsContact CB-CD1 3.49Å; A52-Y115 PolarHBondContact N-OH 3.37Å
53	C	89.5	Confident	90.6	Very high	20 Å²	20	31.2 Å²	31.2	14%	0.135	17%	0.167	C	C	.	.	H	α-helix	trans	-64.1	-44.7	177.8	-52.3	0	0	0	0	111.8	T51 D56 E57 F128	T51-C53 VanDerWaalsContact C-N 3.28Å; T51-C53 PolarHBondContact O-N 3.31Å; C53-D56 PolarHBondContact O-N 3.45Å; C53-E57 WeakPolarHBondContact O-CG 3.32Å; C53-E57 PolarHBondContact O-N 3.03Å; C53-F128 WeakPolarHBondContact SG-CD2 3.33Å
54	Q	91.4	Very high	90.6	Very high	12 Å²	12	40 Å²	40	6%	0.056	21%	0.205	C	C	.	.	H	α-helix	trans	-66.2	-40.3	-179.8	-68.3	164.1	-23.5	0	0	111.6	R24 F27 L50 T51 E57 I58	R24-Q54 PolarHBondContact O-NE2 2.89Å; F27-Q54 HydrophobicContact CB-CG 4.25Å; F27-Q54 HydrophobicContact CD1-CB 4.4Å; F27-Q54 HydrophobicContact CD1-CG 3.7Å; F27-Q54 HydrophobicContact CD2-CB 4.25Å; F27-Q54 HydrophobicContact CD2-CG 3.94Å; F27-Q54 HydrophobicContact CE1-CB 4.19Å; F27-Q54 HydrophobicContact CE1-CG 3.96Å; F27-Q54 HydrophobicContact CE2-CB 4.03Å; F27-Q54 HydrophobicContact CE2-CG 4.19Å; F27-Q54 HydrophobicContact CG-CB 4.43Å; F27-Q54 HydrophobicContact CG-CG 3.69Å; F27-Q54 HydrophobicContact CZ-CB 4.01Å; F27-Q54 HydrophobicContact CZ-CG 4.21Å; L50-Q54 HydrophobicContact CB-CB 4.19Å; T51-Q54 PolarHBondContact O-N 3.42Å; T51-Q54 VanDerWaalsContact O-N 3.14Å; T51-Q54 VanDerWaalsContact OG1-CG 3.26Å; T51-Q54 WeakPolarHBondContact OG1-CG 3.35Å; T51-Q54 PolarHBondContact OG1-N 3.15Å; T51-Q54 PolarHBondContact OG1-OE1 3.29Å; Q54-E57 PolarHBondContact O-N 2.86Å; Q54-I58 WeakPolarHBondContact O-CG1 3.48Å; Q54-I58 PolarHBondContact O-N 3.47Å
55	L	92.9	Very high	90.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.4	-44.2	174.1	-71.8	173.4	0	0	0	111.4	L47 L50 T51 A52 E57 I58 Q59 W73 I76	L47-L55 HydrophobicContact CD2-CD2 3.73Å; L50-L55 HydrophobicContact CB-CD2 3.97Å; L50-L55 HydrophobicContact CB-CG 3.95Å; L50-L55 HydrophobicContact CD1-CD2 4.12Å; T51-L55 WeakPolarHBondContact O-CG 3.35Å; T51-L55 PolarHBondContact O-N 2.92Å; A52-L55 PolarHBondContact O-N 2.92Å; L55-E57 VanDerWaalsContact C-N 3.3Å; L55-E57 PolarHBondContact O-N 3.14Å; L55-I58 HydrophobicContact CD2-CD1 4.48Å; L55-I58 PolarHBondContact O-N 3.16Å; L55-Q59 WeakPolarHBondContact O-CB 3.49Å; L55-Q59 PolarHBondContact O-N 2.83Å; L55-W73 HydrophobicContact CB-CH2 3.85Å; L55-W73 HydrophobicContact CB-CZ2 3.63Å; L55-W73 HydrophobicContact CB-CZ3 4.46Å; L55-W73 HydrophobicContact CD1-CD2 4.2Å; L55-W73 HydrophobicContact CD1-CE3 4.25Å; L55-W73 HydrophobicContact CD1-CZ3 4.47Å; L55-I76 HydrophobicContact CD1-CD1 3.57Å
56	D	91.8	Very high	90.4	Very high	28 Å²	28	39.9 Å²	39.9	15%	0.15	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-39.2	177.5	-168.6	52.6	0	0	0	112.2	A52 C53 P60 W73 K96 M100 S131	A52-D56 WeakPolarHBondContact O-CB 3.44Å; A52-D56 PolarHBondContact O-N 3.38Å; C53-D56 PolarHBondContact O-N 3.45Å; D56-P60 WeakPolarHBondContact O-CD 3.39Å; D56-W73 HydrophobicContact CB-CH2 4.4Å; D56-K96 WeakPolarHBondContact OD1-CE 3.42Å; D56-K96 IonicContact OD1-NZ 3.24Å; D56-K96 PolarHBondContact OD1-NZ 3.37Å; D56-M100 HydrophobicContact CB-CE 3.73Å; D56-M100 VanDerWaalsContact CG-CE 3.48Å; D56-S131 WeakPolarHBondContact OD2-CB 3.36Å
57	E	91.3	Very high	90.2	Very high	99 Å²	99	41 Å²	41	46%	0.463	22%	0.222	S	C	.	.	H	α-helix	trans	-67.2	-43	178.3	-75.5	174.6	-158.1	0	0	113.3	I32 C53 Q54 L55	I32-E57 HydrophobicContact CD1-CB 4.16Å; C53-E57 WeakPolarHBondContact O-CG 3.32Å; C53-E57 PolarHBondContact O-N 3.03Å; Q54-E57 PolarHBondContact O-N 2.86Å; L55-E57 VanDerWaalsContact C-N 3.3Å; L55-E57 PolarHBondContact O-N 3.14Å
58	I	92.9	Very high	90	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-87.2	-23.8	-175.1	66.8	-177.1	0	0	0	113.8	F27 I32 L36 L47 L50 Q54 L55 P60 A61 L62	F27-I58 HydrophobicContact CE2-CG2 4.32Å; F27-I58 HydrophobicContact CZ-CG2 3.62Å; I32-I58 HydrophobicContact CG2-CG2 4.29Å; L36-I58 HydrophobicContact CD2-CB 4.32Å; L47-I58 HydrophobicContact CD2-CD1 3.82Å; L50-I58 HydrophobicContact CD1-CD1 3.42Å; L50-I58 VanDerWaalsContact CD1-CD1 3.42Å; Q54-I58 WeakPolarHBondContact O-CG1 3.48Å; Q54-I58 PolarHBondContact O-N 3.47Å; L55-I58 HydrophobicContact CD2-CD1 4.48Å; L55-I58 PolarHBondContact O-N 3.16Å; I58-P60 VanDerWaalsContact C-CD 3.49Å; I58-A61 PolarHBondContact O-N 3.13Å; I58-A61 VanDerWaalsContact O-N 3.11Å; I58-L62 HydrophobicContact CB-CD1 4.3Å; I58-L62 HydrophobicContact CD1-CD1 3.79Å; I58-L62 HydrophobicContact CG1-CD1 3.82Å; I58-L62 PolarHBondContact O-N 2.93Å
59	Q	91.9	Very high	90.1	Very high	14 Å²	14	42 Å²	42	7%	0.065	23%	0.231	C	C	.	.	H	α-helix	trans	-54.2	-44.8	-173.5	178.3	-179.8	2.5	0	0	113.5	L55 A61 L62 N63 T69 E92 K96	L55-Q59 WeakPolarHBondContact O-CB 3.49Å; L55-Q59 PolarHBondContact O-N 2.83Å; Q59-A61 VanDerWaalsContact C-N 3.28Å; Q59-A61 PolarHBondContact O-N 3.19Å; Q59-L62 PolarHBondContact O-N 3.29Å; Q59-N63 WeakPolarHBondContact O-CB 3.33Å; Q59-N63 VanDerWaalsContact O-CG 3.29Å; Q59-N63 PolarHBondContact O-N 3.16Å; Q59-N63 PolarHBondContact O-OD1 3.28Å; Q59-T69 HydrophobicContact CB-CG2 3.82Å; Q59-T69 HydrophobicContact CG-CG2 4.01Å; Q59-T69 WeakPolarHBondContact CG-OG1 3.39Å; Q59-E92 PolarHBondContact NE2-OE2 3.26Å; Q59-K96 VanDerWaalsContact OE1-CD 3.31Å
60	P	91.9	Very high	90	Very high	77 Å²	77	42.8 Å²	42.8	50%	0.5	23%	0.232	S	C	.	.	H	α-helix	trans	-59.3	-37.9	179.3	-24.5	34.9	0	0	0	113.2	D56 I58 K64	D56-P60 WeakPolarHBondContact O-CD 3.39Å; I58-P60 VanDerWaalsContact C-CD 3.49Å; P60-K64 WeakPolarHBondContact O-CG 3.16Å; P60-K64 PolarHBondContact O-N 3.48Å
61	A	91.4	Very high	89.8	Confident	31 Å²	31	45 Å²	45	26%	0.256	25%	0.248	S	C	.	.	H	α-helix	trans	-75.5	-39.3	179.2	0	0	0	0	0	112.1	L36 I58 Q59 K64 R65	L36-A61 HydrophobicContact CD1-CB 3.48Å; L36-A61 VanDerWaalsContact CD1-CB 3.48Å; L36-A61 HydrophobicContact CD2-CB 3.95Å; L36-A61 HydrophobicContact CG-CB 4.39Å; I58-A61 PolarHBondContact O-N 3.13Å; I58-A61 VanDerWaalsContact O-N 3.11Å; Q59-A61 VanDerWaalsContact C-N 3.28Å; Q59-A61 PolarHBondContact O-N 3.19Å; A61-K64 PolarHBondContact O-N 2.94Å; A61-R65 PolarHBondContact O-N 2.85Å
62	L	89.6	Confident	89.8	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-40.1	175.5	-69.5	179.8	0	0	0	112.2	L36 L43 L47 I58 Q59 K64 R65 G66 L67 T69	L36-L62 HydrophobicContact CD2-CD2 3.7Å; L36-L62 HydrophobicContact CD2-CG 3.91Å; L43-L62 HydrophobicContact CD1-CD2 4.1Å; L47-L62 HydrophobicContact CD2-CD1 3.86Å; I58-L62 HydrophobicContact CB-CD1 4.3Å; I58-L62 HydrophobicContact CD1-CD1 3.79Å; I58-L62 HydrophobicContact CG1-CD1 3.82Å; I58-L62 PolarHBondContact O-N 2.93Å; Q59-L62 PolarHBondContact O-N 3.29Å; L62-K64 VanDerWaalsContact C-N 3.32Å; L62-K64 PolarHBondContact O-N 3.26Å; L62-R65 CarbonylContact O-C 3.58Å; L62-R65 WeakPolarHBondContact O-CA 3.42Å; L62-R65 WeakPolarHBondContact O-CB 3.3Å; L62-R65 PolarHBondContact O-N 2.71Å; L62-G66 PolarHBondContact O-N 3.33Å; L62-L67 CarbonylContact C-O 3.44Å; L62-L67 VanDerWaalsContact C-O 3.26Å; L62-L67 HydrophobicContact CB-CB 4.21Å; L62-L67 HydrophobicContact CD2-CB 4.41Å; L62-L67 HydrophobicContact CD2-CD1 4.1Å; L62-L67 PolarHBondContact O-N 2.89Å; L62-T69 HydrophobicContact CB-CG2 4.47Å; L62-T69 HydrophobicContact CD1-CG2 3.74Å
63	N	88.9	Confident	89.8	Confident	70 Å²	70	44.8 Å²	44.8	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-63.8	-38.1	177.2	-74.8	4.2	0	0	0	111.6	Q59 R65 G66 L67 E92	Q59-N63 WeakPolarHBondContact O-CB 3.33Å; Q59-N63 VanDerWaalsContact O-CG 3.29Å; Q59-N63 PolarHBondContact O-N 3.16Å; Q59-N63 PolarHBondContact O-OD1 3.28Å; N63-R65 PolarHBondContact O-N 3.07Å; N63-G66 PolarHBondContact O-N 3.13Å; N63-L67 PolarHBondContact OD1-O 3.1Å; N63-L67 VanDerWaalsContact OD1-O 3.14Å; N63-E92 PolarHBondContact ND2-OE2 3.36Å; N63-E92 PolarHBondContact OD1-OE2 2.96Å
64	K	88.6	Confident	89.7	Confident	188 Å²	188	45 Å²	45	82%	0.817	25%	0.247	S	C	*	.	H	α-helix	trans	-61	-26.3	171.4	-74.3	175.9	-178.3	-179.3	0	113.1	P60 A61 L62	P60-K64 WeakPolarHBondContact O-CG 3.16Å; P60-K64 PolarHBondContact O-N 3.48Å; A61-K64 PolarHBondContact O-N 2.94Å; L62-K64 VanDerWaalsContact C-N 3.32Å; L62-K64 PolarHBondContact O-N 3.26Å
65	R	85.6	Confident	89.5	Confident	126 Å²	126	46.5 Å²	46.5	48%	0.475	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	4.3	175.8	-65.3	176.7	67.1	-170.3	4.5	113.4	L36 A61 L62 N63 L67	L36-R65 PolarHBondContact O-NH1 3.31Å; A61-R65 PolarHBondContact O-N 2.85Å; L62-R65 CarbonylContact O-C 3.58Å; L62-R65 WeakPolarHBondContact O-CA 3.42Å; L62-R65 WeakPolarHBondContact O-CB 3.3Å; L62-R65 PolarHBondContact O-N 2.71Å; N63-R65 PolarHBondContact O-N 3.07Å; R65-L67 VanDerWaalsContact C-N 3.31Å; R65-L67 PolarHBondContact O-N 2.75Å
66	G	84.1	Confident	89.4	Confident	68 Å²	68	46.6 Å²	46.6	70%	0.701	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	19.4	-177.7	0	0	0	0	0	114.4	L62 N63	L62-G66 PolarHBondContact O-N 3.33Å; N63-G66 PolarHBondContact O-N 3.13Å
67	L	87.4	Confident	89.1	Confident	23 Å²	23	45.3 Å²	45.3	12%	0.12	25%	0.248	C	C	.	.			trans	-104.6	128.6	177.8	-63.2	178	0	0	0	110.5	T40 L43 L62 N63 R65	T40-L67 HydrophobicContact CG2-CD1 4.02Å; T40-L67 HydrophobicContact CG2-CD2 3.49Å; T40-L67 VanDerWaalsContact CG2-CD2 3.49Å; T40-L67 HydrophobicContact CG2-CG 4.41Å; L43-L67 HydrophobicContact CD1-CD1 4.23Å; L62-L67 CarbonylContact C-O 3.44Å; L62-L67 VanDerWaalsContact C-O 3.26Å; L62-L67 HydrophobicContact CB-CB 4.21Å; L62-L67 HydrophobicContact CD2-CB 4.41Å; L62-L67 HydrophobicContact CD2-CD1 4.1Å; L62-L67 PolarHBondContact O-N 2.89Å; N63-L67 PolarHBondContact OD1-O 3.1Å; N63-L67 VanDerWaalsContact OD1-O 3.14Å; R65-L67 VanDerWaalsContact C-N 3.31Å; R65-L67 PolarHBondContact O-N 2.75Å
68	S	88.6	Confident	88.8	Confident	62 Å²	62	45.8 Å²	45.8	43%	0.434	25%	0.245	S	C	.	.			trans	-92	139	176.6	-178	0	0	0	0	112.3	L47 Y70 E92	L47-S68 WeakPolarHBondContact CD1-O 3.47Å; S68-Y70 VanDerWaalsContact C-N 3.32Å; S68-Y70 VanDerWaalsContact OG-CB 3.27Å; S68-Y70 WeakPolarHBondContact OG-CB 3.34Å; S68-Y70 PolarHBondContact OG-N 3.3Å; S68-Y70 VanDerWaalsContact OG-N 3.07Å; S68-E92 WeakPolarHBondContact CA-OE1 3.36Å; S68-E92 PolarHBondContact OG-OE1 3.02Å
69	T	91.5	Very high	88.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.27	C	S	.	.			trans	-83.6	2.9	168.8	61	0	0	0	0	114.4	L47 Q59 L62 S71 G72 W73 E92	L47-T69 HydrophobicContact CD2-CG2 4.04Å; Q59-T69 HydrophobicContact CB-CG2 3.82Å; Q59-T69 HydrophobicContact CG-CG2 4.01Å; Q59-T69 WeakPolarHBondContact CG-OG1 3.39Å; L62-T69 HydrophobicContact CB-CG2 4.47Å; L62-T69 HydrophobicContact CD1-CG2 3.74Å; T69-S71 VanDerWaalsContact C-N 3.25Å; T69-S71 PolarHBondContact O-N 2.98Å; T69-S71 VanDerWaalsContact O-N 3.14Å; T69-G72 PolarHBondContact O-N 3.49Å; T69-W73 VanDerWaalsContact O-CD1 3.23Å; T69-W73 PolarHBondContact O-N 3.32Å; T69-W73 PolarHBondContact OG1-NE1 3.49Å; T69-E92 WeakPolarHBondContact CA-OE1 3.28Å; T69-E92 WeakPolarHBondContact CB-OE1 3.25Å; T69-E92 PolarHBondContact N-OE1 2.96Å; T69-E92 VanDerWaalsContact OG1-CD 3.25Å; T69-E92 PolarHBondContact OG1-OE1 2.93Å
70	Y	88.6	Confident	87.9	Confident	72 Å²	72	51.5 Å²	51.5	28%	0.282	28%	0.276	S	S	.	.	H	α-helix	trans	-50.1	-41.4	-177.5	174.8	-103.5	0	0	0	113.5	S68 G72 W73 V74 F89 A95	S68-Y70 VanDerWaalsContact C-N 3.32Å; S68-Y70 VanDerWaalsContact OG-CB 3.27Å; S68-Y70 WeakPolarHBondContact OG-CB 3.34Å; S68-Y70 PolarHBondContact OG-N 3.3Å; S68-Y70 VanDerWaalsContact OG-N 3.07Å; Y70-G72 VanDerWaalsContact C-N 3.3Å; Y70-G72 PolarHBondContact O-N 3.36Å; Y70-W73 PolarHBondContact O-N 3.03Å; Y70-V74 HydrophobicContact CD1-CG2 4.14Å; Y70-V74 HydrophobicContact CD2-CG2 4.07Å; Y70-V74 HydrophobicContact CE1-CG2 3.7Å; Y70-V74 HydrophobicContact CE2-CG2 3.63Å; Y70-V74 HydrophobicContact CG-CG2 4.32Å; Y70-V74 VanDerWaalsContact CZ-CG2 3.42Å; Y70-V74 WeakPolarHBondContact O-CG2 3.4Å; Y70-V74 PolarHBondContact O-N 3.22Å; Y70-F89 PolarHBondContact OH-O 3.17Å; Y70-A95 HydrophobicContact CD2-CB 4.13Å; Y70-A95 HydrophobicContact CE2-CB 4.17Å
71	S	87.8	Confident	87	Confident	48 Å²	48	49.3 Å²	49.3	34%	0.336	26%	0.261	S	S	.	.	H	α-helix	trans	-61.6	-35.6	178.6	56.7	0	0	0	0	113.2	T69 E75	T69-S71 VanDerWaalsContact C-N 3.25Å; T69-S71 PolarHBondContact O-N 2.98Å; T69-S71 VanDerWaalsContact O-N 3.14Å; S71-E75 WeakPolarHBondContact O-CB 3.32Å; S71-E75 PolarHBondContact O-N 3.16Å
72	G	89.6	Confident	86.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.9	-45	174.1	0	0	0	0	0	112.3	T69 Y70 E75 I76	T69-G72 PolarHBondContact O-N 3.49Å; Y70-G72 VanDerWaalsContact C-N 3.3Å; Y70-G72 PolarHBondContact O-N 3.36Å; G72-E75 PolarHBondContact O-N 3.02Å; G72-I76 WeakPolarHBondContact O-CG1 3.5Å; G72-I76 PolarHBondContact O-N 3.28Å
73	W	91.4	Very high	84.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.8	-43.2	179.5	-62.6	114	0	0	0	112.5	A52 L55 D56 T69 Y70 E75 I76 L77 A95 K96 V99 M100	A52-W73 HydrophobicContact CB-CZ3 4.02Å; A52-W73 WeakPolarHBondContact O-CH2 3.41Å; L55-W73 HydrophobicContact CB-CH2 3.85Å; L55-W73 HydrophobicContact CB-CZ2 3.63Å; L55-W73 HydrophobicContact CB-CZ3 4.46Å; L55-W73 HydrophobicContact CD1-CD2 4.2Å; L55-W73 HydrophobicContact CD1-CE3 4.25Å; L55-W73 HydrophobicContact CD1-CZ3 4.47Å; D56-W73 HydrophobicContact CB-CH2 4.4Å; T69-W73 VanDerWaalsContact O-CD1 3.23Å; T69-W73 PolarHBondContact O-N 3.32Å; T69-W73 PolarHBondContact OG1-NE1 3.49Å; Y70-W73 PolarHBondContact O-N 3.03Å; W73-E75 VanDerWaalsContact C-N 3.3Å; W73-E75 PolarHBondContact O-N 3.12Å; W73-I76 HydrophobicContact CE3-CD1 4.4Å; W73-I76 PolarHBondContact O-N 3.48Å; W73-L77 WeakPolarHBondContact O-CG 3.27Å; W73-L77 PolarHBondContact O-N 2.99Å; W73-A95 HydrophobicContact CB-CB 3.72Å; W73-K96 HydrophobicContact CD2-CB 4.01Å; W73-K96 HydrophobicContact CD2-CG 4.35Å; W73-K96 HydrophobicContact CE3-CB 4.5Å; W73-K96 HydrophobicContact CG-CB 4.31Å; W73-K96 HydrophobicContact CH2-CG 4.05Å; W73-K96 HydrophobicContact CZ2-CB 4.25Å; W73-K96 HydrophobicContact CZ2-CD 4.07Å; W73-K96 HydrophobicContact CZ2-CG 3.78Å; W73-K96 HydrophobicContact CZ3-CG 4.43Å; W73-V99 HydrophobicContact CE3-CB 3.83Å; W73-V99 HydrophobicContact CE3-CG1 3.81Å; W73-V99 HydrophobicContact CE3-CG2 4.05Å; W73-V99 HydrophobicContact CZ3-CB 4.17Å; W73-V99 HydrophobicContact CZ3-CG1 3.81Å; W73-M100 HydrophobicContact CH2-CE 4.22Å
74	V	87.2	Confident	83	Confident	25 Å²	25	54.7 Å²	54.7	15%	0.152	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-37.9	177.5	172.6	0	0	0	0	111.7	Y70 I76 L77 R78 A86	Y70-V74 HydrophobicContact CD1-CG2 4.14Å; Y70-V74 HydrophobicContact CD2-CG2 4.07Å; Y70-V74 HydrophobicContact CE1-CG2 3.7Å; Y70-V74 HydrophobicContact CE2-CG2 3.63Å; Y70-V74 HydrophobicContact CG-CG2 4.32Å; Y70-V74 VanDerWaalsContact CZ-CG2 3.42Å; Y70-V74 WeakPolarHBondContact O-CG2 3.4Å; Y70-V74 PolarHBondContact O-N 3.22Å; V74-I76 VanDerWaalsContact C-N 3.34Å; V74-I76 PolarHBondContact O-N 3.28Å; V74-L77 PolarHBondContact O-N 3.47Å; V74-R78 WeakPolarHBondContact O-CB 3.46Å; V74-R78 PolarHBondContact O-N 3.08Å; V74-A86 HydrophobicContact CG1-CB 4.43Å
75	E	87.8	Confident	81.8	Confident	43 Å²	43	53 Å²	53	20%	0.201	29%	0.289	C	S	.	.	H	α-helix	trans	-62.3	-42.1	175.9	-175.7	58.3	-146.2	0	0	111.8	P48 S71 G72 W73 R78 D79	P48-E75 HydrophobicContact CB-CB 4.01Å; P48-E75 HydrophobicContact CB-CG 3.88Å; P48-E75 VanDerWaalsContact O-CG 3.24Å; P48-E75 WeakPolarHBondContact O-CG 3.42Å; S71-E75 WeakPolarHBondContact O-CB 3.32Å; S71-E75 PolarHBondContact O-N 3.16Å; G72-E75 PolarHBondContact O-N 3.02Å; W73-E75 VanDerWaalsContact C-N 3.3Å; W73-E75 PolarHBondContact O-N 3.12Å; E75-R78 WeakPolarHBondContact O-CB 3.31Å; E75-R78 PolarHBondContact O-N 3.48Å; E75-R78 IonicContact OE1-CZ 3.68Å; E75-R78 IonicContact OE1-NE 3.88Å; E75-R78 PolarHBondContact OE1-NE 2.97Å; E75-R78 IonicContact OE1-NH2 3.9Å; E75-R78 PolarHBondContact OE1-NH2 3.47Å; E75-R78 IonicContact OE2-CZ 2.77Å; E75-R78 IonicContact OE2-NE 2.76Å; E75-R78 PolarHBondContact OE2-NE 3.32Å; E75-R78 IonicContact OE2-NH1 3.09Å; E75-R78 PolarHBondContact OE2-NH1 3.1Å; E75-R78 IonicContact OE2-NH2 3.71Å; E75-R78 PolarHBondContact OE2-NH2 3.29Å; E75-D79 PolarHBondContact O-N 3.12Å
76	I	88.8	Confident	80.6	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.015	27%	0.267	C	S	.	.	H	α-helix	trans	-67.7	-39.8	174.9	-61.6	169	0	0	0	111.1	A52 L55 G72 W73 V74 R78 D79 L80 V99 Y115	A52-I76 HydrophobicContact CB-CD1 4.12Å; L55-I76 HydrophobicContact CD1-CD1 3.57Å; G72-I76 WeakPolarHBondContact O-CG1 3.5Å; G72-I76 PolarHBondContact O-N 3.28Å; W73-I76 HydrophobicContact CE3-CD1 4.4Å; W73-I76 PolarHBondContact O-N 3.48Å; V74-I76 VanDerWaalsContact C-N 3.34Å; V74-I76 PolarHBondContact O-N 3.28Å; I76-R78 VanDerWaalsContact C-N 3.3Å; I76-R78 PolarHBondContact O-N 2.79Å; I76-D79 WeakPolarHBondContact O-CB 3.49Å; I76-D79 PolarHBondContact O-N 2.83Å; I76-L80 HydrophobicContact CG2-CD1 3.83Å; I76-L80 HydrophobicContact CG2-CG 4.27Å; I76-L80 WeakPolarHBondContact O-CG 3.41Å; I76-L80 PolarHBondContact O-N 3.45Å; I76-V99 HydrophobicContact CB-CG1 4.26Å; I76-V99 HydrophobicContact CB-CG2 4.19Å; I76-V99 HydrophobicContact CG2-CG1 3.56Å; I76-V99 HydrophobicContact CG2-CG2 4.08Å; I76-Y115 HydrophobicContact CB-CE2 4.4Å; I76-Y115 WeakPolarHBondContact CD1-OH 3.42Å; I76-Y115 HydrophobicContact CG1-CE2 4.1Å; I76-Y115 HydrophobicContact CG2-CD2 4.44Å; I76-Y115 HydrophobicContact CG2-CE1 4.29Å; I76-Y115 HydrophobicContact CG2-CE2 3.81Å
77	L	86.9	Confident	79.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-41.9	174.3	-73.4	172.8	0	0	0	111.4	W73 V74 D79 L80 V81 A86 F89 A95 E98 V99	W73-L77 WeakPolarHBondContact O-CG 3.27Å; W73-L77 PolarHBondContact O-N 2.99Å; V74-L77 PolarHBondContact O-N 3.47Å; L77-D79 VanDerWaalsContact C-N 3.25Å; L77-D79 PolarHBondContact O-N 3.46Å; L77-L80 PolarHBondContact O-N 3.05Å; L77-V81 HydrophobicContact CB-CG2 4.38Å; L77-V81 WeakPolarHBondContact O-CG2 3.3Å; L77-V81 PolarHBondContact O-N 3.31Å; L77-A86 HydrophobicContact CB-CB 3.72Å; L77-F89 HydrophobicContact CD1-CB 4.49Å; L77-F89 HydrophobicContact CD1-CD2 3.6Å; L77-F89 HydrophobicContact CD1-CE2 4.13Å; L77-F89 HydrophobicContact CD1-CG 4.18Å; L77-A95 HydrophobicContact CD1-CB 4.02Å; L77-E98 HydrophobicContact CD2-CB 4.04Å; L77-E98 HydrophobicContact CD2-CG 3.65Å; L77-V99 HydrophobicContact CD1-CG2 4.32Å; L77-V99 HydrophobicContact CD2-CG2 3.46Å; L77-V99 VanDerWaalsContact CD2-CG2 3.46Å; L77-V99 HydrophobicContact CG-CG2 3.43Å; L77-V99 VanDerWaalsContact CG-CG2 3.43Å
78	R	83.9	Confident	78.6	Confident	109 Å²	109	52.9 Å²	52.9	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-56.3	-43.2	175.7	-179.6	174.8	73.1	-175.1	11.6	111.4	V74 E75 I76 L80 G82 L83 A86	V74-R78 WeakPolarHBondContact O-CB 3.46Å; V74-R78 PolarHBondContact O-N 3.08Å; E75-R78 WeakPolarHBondContact O-CB 3.31Å; E75-R78 PolarHBondContact O-N 3.48Å; E75-R78 IonicContact OE1-CZ 3.68Å; E75-R78 IonicContact OE1-NE 3.88Å; E75-R78 PolarHBondContact OE1-NE 2.97Å; E75-R78 IonicContact OE1-NH2 3.9Å; E75-R78 PolarHBondContact OE1-NH2 3.47Å; E75-R78 IonicContact OE2-CZ 2.77Å; E75-R78 IonicContact OE2-NE 2.76Å; E75-R78 PolarHBondContact OE2-NE 3.32Å; E75-R78 IonicContact OE2-NH1 3.09Å; E75-R78 PolarHBondContact OE2-NH1 3.1Å; E75-R78 IonicContact OE2-NH2 3.71Å; E75-R78 PolarHBondContact OE2-NH2 3.29Å; I76-R78 VanDerWaalsContact C-N 3.3Å; I76-R78 PolarHBondContact O-N 2.79Å; R78-L80 VanDerWaalsContact C-N 3.34Å; R78-G82 VanDerWaalsContact O-CA 3.26Å; R78-G82 WeakPolarHBondContact O-CA 3.06Å; R78-G82 PolarHBondContact O-N 2.87Å; R78-L83 HydrophobicContact CG-CB 4.42Å; R78-L83 HydrophobicContact CG-CD1 3.98Å; R78-A86 HydrophobicContact CB-CB 4.44Å
79	D	83	Confident	78	Confident	96 Å²	96	52 Å²	52	51%	0.513	27%	0.27	S	S	.	.	H	α-helix	trans	-67.2	-31.9	176.4	-79.3	-2.6	0	0	0	113.1	E75 I76 L77 Y115	E75-D79 PolarHBondContact O-N 3.12Å; I76-D79 WeakPolarHBondContact O-CB 3.49Å; I76-D79 PolarHBondContact O-N 2.83Å; L77-D79 VanDerWaalsContact C-N 3.25Å; L77-D79 PolarHBondContact O-N 3.46Å; D79-Y115 HydrophobicContact CB-CD2 4.06Å
80	L	82.6	Confident	77.1	Confident	40 Å²	40	61.9 Å²	61.9	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-88.4	-37.5	-175.8	-69.9	175	0	0	0	114.5	I76 L77 R78 V99 R102 L103 Y115	I76-L80 HydrophobicContact CG2-CD1 3.83Å; I76-L80 HydrophobicContact CG2-CG 4.27Å; I76-L80 WeakPolarHBondContact O-CG 3.41Å; I76-L80 PolarHBondContact O-N 3.45Å; L77-L80 PolarHBondContact O-N 3.05Å; R78-L80 VanDerWaalsContact C-N 3.34Å; L80-V99 HydrophobicContact CD1-CG1 4.49Å; L80-R102 HydrophobicContact CD1-CB 4.24Å; L80-L103 HydrophobicContact CD1-CD2 4.15Å; L80-L103 HydrophobicContact CD1-CG 4.22Å; L80-L103 HydrophobicContact CD2-CD2 4.16Å; L80-Y115 HydrophobicContact CD2-CD1 4.43Å; L80-Y115 HydrophobicContact CD2-CG 4.18Å
81	V	74.9	Confident	76.9	Confident	30 Å²	30	61.3 Å²	61.3	18%	0.182	31%	0.311	C	S	.	.	H	α-helix	trans	-128.9	-2.8	-171.2	-65.8	0	0	0	0	115	L77 R85 R102	L77-V81 HydrophobicContact CB-CG2 4.38Å; L77-V81 WeakPolarHBondContact O-CG2 3.3Å; L77-V81 PolarHBondContact O-N 3.31Å; V81-R85 HydrophobicContact CB-CB 4.11Å; V81-R85 HydrophobicContact CG2-CB 3.82Å; V81-R102 VanDerWaalsContact CG1-NE 3.27Å
82	G	72.1	Confident	76.8	Confident	32 Å²	32	60.5 Å²	60.5	33%	0.33	30%	0.302	S	S	.	.			trans	83.4	159.7	-174.1	0	0	0	0	0	113.5	R78 S84 R85 A86	R78-G82 VanDerWaalsContact O-CA 3.26Å; R78-G82 WeakPolarHBondContact O-CA 3.06Å; R78-G82 PolarHBondContact O-N 2.87Å; G82-S84 VanDerWaalsContact C-N 3.32Å; G82-S84 PolarHBondContact O-N 3.12Å; G82-R85 PolarHBondContact O-N 2.88Å; G82-A86 PolarHBondContact O-N 3.41Å
83	L	59.3	Low	76.8	Confident	88 Å²	88	63.8 Å²	63.8	46%	0.461	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-36.6	-170.9	-166.8	78.5	0	0	0	113.4	R78 R85 A86	R78-L83 HydrophobicContact CG-CB 4.42Å; R78-L83 HydrophobicContact CG-CD1 3.98Å; L83-R85 PolarHBondContact O-N 2.98Å; L83-A86 PolarHBondContact O-N 3.26Å
84	S	52.3	Low	76.6	Confident	95 Å²	95	68 Å²	68	66%	0.664	35%	0.349	S	S	*	.	H	α-helix	trans	-66	-38.3	-174.9	51.8	0	0	0	0	113.2	G82	G82-S84 VanDerWaalsContact C-N 3.32Å; G82-S84 PolarHBondContact O-N 3.12Å
85	R	64.1	Low	76.6	Confident	154 Å²	154	66.9 Å²	66.9	58%	0.581	34%	0.342	S	S	*	.	H	α-helix	trans	-85.5	-24.2	178.7	-70.2	-175.4	175.1	-166.9	-0.9	113.1	V81 G82 L83 L87 D88 F89	V81-R85 HydrophobicContact CB-CB 4.11Å; V81-R85 HydrophobicContact CG2-CB 3.82Å; G82-R85 PolarHBondContact O-N 2.88Å; L83-R85 PolarHBondContact O-N 2.98Å; R85-L87 PolarHBondContact O-N 3.23Å; R85-D88 PolarHBondContact O-N 3.4Å; R85-F89 VanDerWaalsContact O-CE2 3.31Å; R85-F89 WeakPolarHBondContact O-CE2 3.31Å
86	A	60.2	Low	76.9	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.008	34%	0.339	C	S	.	.	H	α-helix	trans	-66	-27.2	178.2	0	0	0	0	0	112.8	V74 L77 R78 G82 L83 D88	V74-A86 HydrophobicContact CG1-CB 4.43Å; L77-A86 HydrophobicContact CB-CB 3.72Å; R78-A86 HydrophobicContact CB-CB 4.44Å; G82-A86 PolarHBondContact O-N 3.41Å; L83-A86 PolarHBondContact O-N 3.26Å; A86-D88 VanDerWaalsContact C-N 3.32Å
87	L	61.6	Low	77.1	Confident	98 Å²	98	67.6 Å²	67.6	51%	0.513	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.3	179.5	-65.6	173.3	0	0	0	114.1	R85 F89	R85-L87 PolarHBondContact O-N 3.23Å; L87-F89 VanDerWaalsContact C-N 3.27Å; L87-F89 PolarHBondContact O-N 3.17Å
88	D	68.9	Low	77.3	Confident	114 Å²	114	68.9 Å²	68.9	61%	0.61	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-22.2	-179.8	-67.2	-30	0	0	0	112.2	R85 A86	R85-D88 PolarHBondContact O-N 3.4Å; A86-D88 VanDerWaalsContact C-N 3.32Å
89	F	75.2	Confident	77.7	Confident	44 Å²	44	63.7 Å²	63.7	19%	0.193	33%	0.331	C	S	.	.			trans	-91.2	117.7	-178.8	-54.1	-81.3	0	0	0	109.9	Y70 L77 R85 L87 E94 A95 E98	Y70-F89 PolarHBondContact OH-O 3.17Å; L77-F89 HydrophobicContact CD1-CB 4.49Å; L77-F89 HydrophobicContact CD1-CD2 3.6Å; L77-F89 HydrophobicContact CD1-CE2 4.13Å; L77-F89 HydrophobicContact CD1-CG 4.18Å; R85-F89 VanDerWaalsContact O-CE2 3.31Å; R85-F89 WeakPolarHBondContact O-CE2 3.31Å; L87-F89 VanDerWaalsContact C-N 3.27Å; L87-F89 PolarHBondContact O-N 3.17Å; F89-E94 HydrophobicContact CB-CB 4.28Å; F89-E94 HydrophobicContact CD1-CB 4.2Å; F89-A95 HydrophobicContact CB-CB 4.27Å; F89-E98 HydrophobicContact CD1-CB 4.24Å; F89-E98 HydrophobicContact CE1-CB 3.75Å; F89-E98 HydrophobicContact CE1-CG 3.81Å; F89-E98 HydrophobicContact CE2-CB 4.41Å; F89-E98 HydrophobicContact CE2-CG 3.93Å; F89-E98 HydrophobicContact CZ-CB 3.86Å; F89-E98 HydrophobicContact CZ-CG 3.39Å
90	R	74.1	Confident	78.2	Confident	207 Å²	207	59.2 Å²	59.2	78%	0.781	31%	0.307	S	S	*	.			trans	-98.5	-13	-169.9	-63	-172.7	-179.2	-159	2	113.5	E94	R90-E94 PolarHBondContact N-OE2 3.26Å
91	T	83.3	Confident	78.7	Confident	61 Å²	61	57.9 Å²	57.9	37%	0.374	30%	0.3	S	S	.	.	S	Bend	trans	-122.4	156.1	-178.2	70.8	0	0	0	0	112.5	A93 E94 A95	T91-A93 VanDerWaalsContact C-N 3.29Å; T91-A93 PolarHBondContact O-N 3.18Å; T91-E94 PolarHBondContact N-OE2 3.11Å; T91-E94 VanDerWaalsContact N-OE2 3.11Å; T91-E94 PolarHBondContact O-N 2.87Å; T91-E94 WeakPolarHBondContact OG1-CB 3.31Å; T91-E94 WeakPolarHBondContact OG1-CG 3.2Å; T91-E94 PolarHBondContact OG1-N 3.04Å; T91-E94 PolarHBondContact OG1-OE2 3.12Å; T91-E94 VanDerWaalsContact OG1-OE2 3.08Å; T91-A95 WeakPolarHBondContact O-CB 3.36Å; T91-A95 PolarHBondContact O-N 3.28Å
92	E	86.4	Confident	79.4	Confident	30 Å²	30	60.5 Å²	60.5	14%	0.14	31%	0.307	C	S	.	.	H	α-helix	trans	-57.3	-42.1	173.8	-178.4	-177.8	-102.9	0	0	112.4	Q59 N63 S68 T69 A95 K96	Q59-E92 PolarHBondContact NE2-OE2 3.26Å; N63-E92 PolarHBondContact ND2-OE2 3.36Å; N63-E92 PolarHBondContact OD1-OE2 2.96Å; S68-E92 WeakPolarHBondContact CA-OE1 3.36Å; S68-E92 PolarHBondContact OG-OE1 3.02Å; T69-E92 WeakPolarHBondContact CA-OE1 3.28Å; T69-E92 WeakPolarHBondContact CB-OE1 3.25Å; T69-E92 PolarHBondContact N-OE1 2.96Å; T69-E92 VanDerWaalsContact OG1-CD 3.25Å; T69-E92 PolarHBondContact OG1-OE1 2.93Å; E92-A95 PolarHBondContact O-N 3.27Å; E92-K96 VanDerWaalsContact O-CB 3.29Å; E92-K96 WeakPolarHBondContact O-CB 3.31Å; E92-K96 PolarHBondContact O-N 3.49Å
93	A	88.2	Confident	80.4	Confident	69 Å²	69	59 Å²	59	57%	0.57	29%	0.291	S	S	*	.	H	α-helix	trans	-66.3	-43.8	-178	0	0	0	0	0	111.9	T91 H97	T91-A93 VanDerWaalsContact C-N 3.29Å; T91-A93 PolarHBondContact O-N 3.18Å; A93-H97 VanDerWaalsContact O-CB 3.27Å; A93-H97 WeakPolarHBondContact O-CB 3.44Å; A93-H97 PolarHBondContact O-N 3.03Å
94	E	87.6	Confident	82	Confident	90 Å²	90	55 Å²	55	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-62.8	-47.4	175.6	-74	164	175.8	0	0	111.6	F89 R90 T91 K96 H97 E98	F89-E94 HydrophobicContact CB-CB 4.28Å; F89-E94 HydrophobicContact CD1-CB 4.2Å; R90-E94 PolarHBondContact N-OE2 3.26Å; T91-E94 PolarHBondContact N-OE2 3.11Å; T91-E94 VanDerWaalsContact N-OE2 3.11Å; T91-E94 PolarHBondContact O-N 2.87Å; T91-E94 WeakPolarHBondContact OG1-CB 3.31Å; T91-E94 WeakPolarHBondContact OG1-CG 3.2Å; T91-E94 PolarHBondContact OG1-N 3.04Å; T91-E94 PolarHBondContact OG1-OE2 3.12Å; T91-E94 VanDerWaalsContact OG1-OE2 3.08Å; E94-K96 PolarHBondContact O-N 3.41Å; E94-H97 PolarHBondContact O-N 2.64Å; E94-E98 PolarHBondContact O-N 3.16Å
95	A	88.5	Confident	83.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-44.4	179.7	0	0	0	0	0	111.4	Y70 W73 L77 F89 T91 E92 E98 V99	Y70-A95 HydrophobicContact CD2-CB 4.13Å; Y70-A95 HydrophobicContact CE2-CB 4.17Å; W73-A95 HydrophobicContact CB-CB 3.72Å; L77-A95 HydrophobicContact CD1-CB 4.02Å; F89-A95 HydrophobicContact CB-CB 4.27Å; T91-A95 WeakPolarHBondContact O-CB 3.36Å; T91-A95 PolarHBondContact O-N 3.28Å; E92-A95 PolarHBondContact O-N 3.27Å; A95-E98 PolarHBondContact O-N 3.01Å; A95-V99 WeakPolarHBondContact O-CG2 3.27Å; A95-V99 PolarHBondContact O-N 2.98Å; A95-V99 VanDerWaalsContact O-N 3.08Å
96	K	92.9	Very high	85	Confident	31 Å²	31	44.8 Å²	44.8	14%	0.135	22%	0.222	C	C	.	.	H	α-helix	trans	-59.1	-50.1	173.8	177.3	-179.2	-170.9	159.3	0	111.6	D56 Q59 W73 E92 E94 E98 V99 M100 S135	D56-K96 WeakPolarHBondContact OD1-CE 3.42Å; D56-K96 IonicContact OD1-NZ 3.24Å; D56-K96 PolarHBondContact OD1-NZ 3.37Å; Q59-K96 VanDerWaalsContact OE1-CD 3.31Å; W73-K96 HydrophobicContact CD2-CB 4.01Å; W73-K96 HydrophobicContact CD2-CG 4.35Å; W73-K96 HydrophobicContact CE3-CB 4.5Å; W73-K96 HydrophobicContact CG-CB 4.31Å; W73-K96 HydrophobicContact CH2-CG 4.05Å; W73-K96 HydrophobicContact CZ2-CB 4.25Å; W73-K96 HydrophobicContact CZ2-CD 4.07Å; W73-K96 HydrophobicContact CZ2-CG 3.78Å; W73-K96 HydrophobicContact CZ3-CG 4.43Å; E92-K96 VanDerWaalsContact O-CB 3.29Å; E92-K96 WeakPolarHBondContact O-CB 3.31Å; E92-K96 PolarHBondContact O-N 3.49Å; E94-K96 PolarHBondContact O-N 3.41Å; K96-E98 VanDerWaalsContact C-N 3.33Å; K96-E98 PolarHBondContact O-N 3.17Å; K96-V99 PolarHBondContact O-N 3.41Å; K96-M100 HydrophobicContact CG-CG 4.14Å; K96-M100 WeakPolarHBondContact O-CB 3.39Å; K96-M100 VanDerWaalsContact O-CG 3.28Å; K96-M100 WeakPolarHBondContact O-CG 3.18Å; K96-M100 PolarHBondContact O-N 3.39Å; K96-S135 WeakPolarHBondContact CE-OG 3.45Å
97	H	92.1	Very high	86.5	Confident	30 Å²	30	46 Å²	46	14%	0.139	23%	0.229	C	C	.	.	H	α-helix	trans	-55.7	-48.7	-179.1	170.3	81.7	0	0	0	111.1	A93 E94 M100 L101 S135 H137 H138	A93-H97 VanDerWaalsContact O-CB 3.27Å; A93-H97 WeakPolarHBondContact O-CB 3.44Å; A93-H97 PolarHBondContact O-N 3.03Å; E94-H97 PolarHBondContact O-N 2.64Å; H97-M100 PolarHBondContact O-N 3.12Å; H97-L101 VanDerWaalsContact O-CB 3.24Å; H97-L101 WeakPolarHBondContact O-CB 3.39Å; H97-L101 PolarHBondContact O-N 3.43Å; H97-S135 PolarHBondContact ND1-O 3.38Å; H97-H137 PolarHBondContact CE1-N 2.98Å; H97-H137 VanDerWaalsContact CE1-N 3.25Å; H97-H138 AromaticContact NE2-CG 3.98Å; H97-H138 AromaticContact NE2-ND1 3.82Å
98	E	91.4	Very high	87.8	Confident	28 Å²	28	42 Å²	42	13%	0.131	21%	0.207	C	C	.	.	H	α-helix	trans	-65.4	-43.8	-178.9	-177.2	69.8	-172.6	0	0	112.3	L77 F89 E94 A95 K96 L101 R102	L77-E98 HydrophobicContact CD2-CB 4.04Å; L77-E98 HydrophobicContact CD2-CG 3.65Å; F89-E98 HydrophobicContact CD1-CB 4.24Å; F89-E98 HydrophobicContact CE1-CB 3.75Å; F89-E98 HydrophobicContact CE1-CG 3.81Å; F89-E98 HydrophobicContact CE2-CB 4.41Å; F89-E98 HydrophobicContact CE2-CG 3.93Å; F89-E98 HydrophobicContact CZ-CB 3.86Å; F89-E98 HydrophobicContact CZ-CG 3.39Å; E94-E98 PolarHBondContact O-N 3.16Å; A95-E98 PolarHBondContact O-N 3.01Å; K96-E98 VanDerWaalsContact C-N 3.33Å; K96-E98 PolarHBondContact O-N 3.17Å; E98-L101 PolarHBondContact O-N 2.81Å; E98-R102 WeakPolarHBondContact O-CG 3.1Å; E98-R102 PolarHBondContact O-N 3.27Å; E98-R102 IonicContact OE1-CZ 3.79Å; E98-R102 IonicContact OE1-NE 3.68Å; E98-R102 PolarHBondContact OE1-NE 3.19Å; E98-R102 IonicContact OE1-NH2 3.99Å; E98-R102 PolarHBondContact OE1-NH2 3.1Å
99	V	92.4	Very high	88.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-50.3	175.4	171.1	0	0	0	0	110.3	A52 W73 I76 L77 L80 A95 K96 L101 R102 L103	A52-V99 HydrophobicContact CB-CG1 4.28Å; W73-V99 HydrophobicContact CE3-CB 3.83Å; W73-V99 HydrophobicContact CE3-CG1 3.81Å; W73-V99 HydrophobicContact CE3-CG2 4.05Å; W73-V99 HydrophobicContact CZ3-CB 4.17Å; W73-V99 HydrophobicContact CZ3-CG1 3.81Å; I76-V99 HydrophobicContact CB-CG1 4.26Å; I76-V99 HydrophobicContact CB-CG2 4.19Å; I76-V99 HydrophobicContact CG2-CG1 3.56Å; I76-V99 HydrophobicContact CG2-CG2 4.08Å; L77-V99 HydrophobicContact CD1-CG2 4.32Å; L77-V99 HydrophobicContact CD2-CG2 3.46Å; L77-V99 VanDerWaalsContact CD2-CG2 3.46Å; L77-V99 HydrophobicContact CG-CG2 3.43Å; L77-V99 VanDerWaalsContact CG-CG2 3.43Å; L80-V99 HydrophobicContact CD1-CG1 4.49Å; A95-V99 WeakPolarHBondContact O-CG2 3.27Å; A95-V99 PolarHBondContact O-N 2.98Å; A95-V99 VanDerWaalsContact O-N 3.08Å; K96-V99 PolarHBondContact O-N 3.41Å; V99-L101 VanDerWaalsContact C-N 3.34Å; V99-L101 PolarHBondContact O-N 2.97Å; V99-R102 PolarHBondContact O-N 3.29Å; V99-L103 HydrophobicContact CG1-CD1 3.7Å; V99-L103 HydrophobicContact CG1-CG 4.28Å; V99-L103 WeakPolarHBondContact O-CB 3.38Å; V99-L103 WeakPolarHBondContact O-CG 3.46Å; V99-L103 PolarHBondContact O-N 2.66Å
100	M	93.8	Very high	89.3	Confident	1 Å²	1	38 Å²	38	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-62.9	-39.9	-179.5	-72.1	-64.4	-145.5	0	0	111.5	D56 W73 K96 H97 F104 F128 A132 I136	D56-M100 HydrophobicContact CB-CE 3.73Å; D56-M100 VanDerWaalsContact CG-CE 3.48Å; W73-M100 HydrophobicContact CH2-CE 4.22Å; K96-M100 HydrophobicContact CG-CG 4.14Å; K96-M100 WeakPolarHBondContact O-CB 3.39Å; K96-M100 VanDerWaalsContact O-CG 3.28Å; K96-M100 WeakPolarHBondContact O-CG 3.18Å; K96-M100 PolarHBondContact O-N 3.39Å; H97-M100 PolarHBondContact O-N 3.12Å; M100-F104 WeakPolarHBondContact O-CA 3.49Å; M100-F104 WeakPolarHBondContact O-CB 3.35Å; M100-F104 PolarHBondContact O-N 3.18Å; M100-F128 HydrophobicContact SD-CE2 4.11Å; M100-A132 HydrophobicContact CB-CB 4.5Å; M100-A132 HydrophobicContact SD-CB 4.02Å; M100-I136 HydrophobicContact CB-CG2 3.95Å
101	L	92.6	Very high	89.8	Confident	12 Å²	12	31.3 Å²	31.3	6%	0.063	18%	0.18	C	C	.	.	H	α-helix	trans	-61.2	-47.7	177	178.1	61.1	0	0	0	111.8	H97 E98 V99 T105 I136 H138	H97-L101 VanDerWaalsContact O-CB 3.24Å; H97-L101 WeakPolarHBondContact O-CB 3.39Å; H97-L101 PolarHBondContact O-N 3.43Å; E98-L101 PolarHBondContact O-N 2.81Å; V99-L101 VanDerWaalsContact C-N 3.34Å; V99-L101 PolarHBondContact O-N 2.97Å; L101-T105 WeakPolarHBondContact O-CB 3.49Å; L101-T105 PolarHBondContact O-N 3.43Å; L101-T105 PolarHBondContact O-OG1 3.08Å; L101-I136 HydrophobicContact CB-CG2 4.04Å; L101-I136 HydrophobicContact CD1-CG2 4.48Å; L101-H138 HydrophobicContact CD1-CB 4.24Å; L101-H138 WeakPolarHBondContact CD1-O 3.44Å; L101-H138 HydrophobicContact CD2-CB 4.09Å
102	R	90.9	Very high	89.7	Confident	86 Å²	86	33 Å²	33	33%	0.325	19%	0.194	S	C	.	.	H	α-helix	trans	-66.2	-45.6	179.8	-72.2	179.1	179.7	-83.5	-13	112.3	L80 V81 E98 V99 S106	L80-R102 HydrophobicContact CD1-CB 4.24Å; V81-R102 VanDerWaalsContact CG1-NE 3.27Å; E98-R102 WeakPolarHBondContact O-CG 3.1Å; E98-R102 PolarHBondContact O-N 3.27Å; E98-R102 IonicContact OE1-CZ 3.79Å; E98-R102 IonicContact OE1-NE 3.68Å; E98-R102 PolarHBondContact OE1-NE 3.19Å; E98-R102 IonicContact OE1-NH2 3.99Å; E98-R102 PolarHBondContact OE1-NH2 3.1Å; V99-R102 PolarHBondContact O-N 3.29Å; R102-S106 WeakPolarHBondContact O-CB 3.43Å; R102-S106 PolarHBondContact O-N 3.46Å; R102-S106 PolarHBondContact O-OG 3.49Å
103	L	92.3	Very high	89.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.7	-42	178.9	-67.4	179.2	0	0	0	111.3	A52 L80 V99 S106 V107 Y115 V116 L123 F128	A52-L103 HydrophobicContact CB-CD1 3.49Å; A52-L103 VanDerWaalsContact CB-CD1 3.49Å; L80-L103 HydrophobicContact CD1-CD2 4.15Å; L80-L103 HydrophobicContact CD1-CG 4.22Å; L80-L103 HydrophobicContact CD2-CD2 4.16Å; V99-L103 HydrophobicContact CG1-CD1 3.7Å; V99-L103 HydrophobicContact CG1-CG 4.28Å; V99-L103 WeakPolarHBondContact O-CB 3.38Å; V99-L103 WeakPolarHBondContact O-CG 3.46Å; V99-L103 PolarHBondContact O-N 2.66Å; L103-S106 PolarHBondContact O-N 3.46Å; L103-V107 WeakPolarHBondContact O-CB 3.47Å; L103-V107 VanDerWaalsContact O-CG2 3.25Å; L103-V107 WeakPolarHBondContact O-CG2 3.21Å; L103-V107 PolarHBondContact O-N 2.92Å; L103-Y115 HydrophobicContact CD1-CE1 4.03Å; L103-Y115 HydrophobicContact CD2-CD1 3.65Å; L103-Y115 HydrophobicContact CD2-CE1 3.86Å; L103-V116 HydrophobicContact CD2-CG2 4.11Å; L103-L123 HydrophobicContact CD1-CD2 4.3Å; L103-L123 HydrophobicContact CD2-CD1 4.37Å; L103-F128 HydrophobicContact CB-CE1 4.29Å; L103-F128 HydrophobicContact CB-CZ 3.6Å; L103-F128 HydrophobicContact CD1-CZ 4.4Å
104	F	92.6	Very high	89	Confident	3 Å²	3	36.9 Å²	36.9	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-56.3	-54.2	173.2	178.5	-93.5	0	0	0	110.5	M100 S106 V107 F108 L129 A132 A133 I136 F139 L159 L163	M100-F104 WeakPolarHBondContact O-CA 3.49Å; M100-F104 WeakPolarHBondContact O-CB 3.35Å; M100-F104 PolarHBondContact O-N 3.18Å; F104-S106 VanDerWaalsContact C-N 3.27Å; F104-S106 PolarHBondContact O-N 3.23Å; F104-V107 PolarHBondContact O-N 3.27Å; F104-F108 HydrophobicContact CD1-CB 4.48Å; F104-F108 HydrophobicContact CE1-CB 4.25Å; F104-F108 HydrophobicContact CE1-CD1 4.49Å; F104-F108 HydrophobicContact CE1-CG 4.3Å; F104-F108 HydrophobicContact CZ-CB 4.38Å; F104-F108 HydrophobicContact CZ-CG 4.31Å; F104-F108 WeakPolarHBondContact O-CB 3.32Å; F104-F108 PolarHBondContact O-N 3.1Å; F104-L129 HydrophobicContact CD2-CD2 3.76Å; F104-L129 HydrophobicContact CE2-CD2 3.88Å; F104-A132 HydrophobicContact CB-CB 4.01Å; F104-A132 HydrophobicContact CD2-CB 3.99Å; F104-A132 HydrophobicContact CG-CB 4.47Å; F104-A133 HydrophobicContact CE2-CB 4.21Å; F104-I136 HydrophobicContact CB-CD1 4.43Å; F104-I136 HydrophobicContact CD1-CD1 3.71Å; F104-I136 HydrophobicContact CD2-CD1 4.31Å; F104-I136 HydrophobicContact CE1-CD1 4.01Å; F104-I136 HydrophobicContact CG-CD1 3.89Å; F104-I136 HydrophobicContact CZ-CD1 4.43Å; F104-F139 HydrophobicContact CE1-CD2 4.21Å; F104-F139 HydrophobicContact CE1-CE2 4.06Å; F104-L159 HydrophobicContact CE2-CD1 4.35Å; F104-L159 HydrophobicContact CE2-CD2 4.35Å; F104-L163 HydrophobicContact CE1-CD2 4.45Å; F104-L163 HydrophobicContact CZ-CD1 4.29Å; F104-L163 HydrophobicContact CZ-CD2 3.98Å
105	T	91	Very high	88.8	Confident	16 Å²	16	33.2 Å²	33.2	10%	0.098	19%	0.191	C	C	.	.	H	α-helix	trans	-56.8	-43.4	179.3	-55.8	0	0	0	0	111	L101 Y109 I142	L101-T105 WeakPolarHBondContact O-CB 3.49Å; L101-T105 PolarHBondContact O-N 3.43Å; L101-T105 PolarHBondContact O-OG1 3.08Å; T105-Y109 HydrophobicContact CG2-CD2 3.82Å; T105-Y109 HydrophobicContact CG2-CE2 4.17Å; T105-Y109 WeakPolarHBondContact O-CB 3.47Å; T105-Y109 WeakPolarHBondContact O-CD2 3.44Å; T105-Y109 PolarHBondContact O-N 2.97Å; T105-Y109 VanDerWaalsContact O-N 3.13Å; T105-I142 HydrophobicContact CG2-CD1 4.33Å
106	S	89.8	Confident	88.5	Confident	20 Å²	20	33.8 Å²	33.8	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-67.3	-47.7	-179.2	-55.1	0	0	0	0	112.3	R102 L103 F104 G110 L111	R102-S106 WeakPolarHBondContact O-CB 3.43Å; R102-S106 PolarHBondContact O-N 3.46Å; R102-S106 PolarHBondContact O-OG 3.49Å; L103-S106 PolarHBondContact O-N 3.46Å; F104-S106 VanDerWaalsContact C-N 3.27Å; F104-S106 PolarHBondContact O-N 3.23Å; S106-G110 CarbonylContact O-C 3.52Å; S106-G110 WeakPolarHBondContact O-CA 3.38Å; S106-G110 PolarHBondContact O-N 3.09Å; S106-L111 PolarHBondContact O-N 2.94Å
107	V	90.2	Very high	87.9	Confident	25 Å²	25	37.1 Å²	37.1	15%	0.152	21%	0.214	C	C	.	.	H	α-helix	trans	-68.5	-44.8	-179.2	173.8	0	0	0	0	110.9	L103 F104 Y109 G110 L123 F128 L129	L103-V107 WeakPolarHBondContact O-CB 3.47Å; L103-V107 VanDerWaalsContact O-CG2 3.25Å; L103-V107 WeakPolarHBondContact O-CG2 3.21Å; L103-V107 PolarHBondContact O-N 2.92Å; F104-V107 PolarHBondContact O-N 3.27Å; V107-Y109 PolarHBondContact O-N 2.94Å; V107-G110 PolarHBondContact O-N 3.31Å; V107-L123 WeakPolarHBondContact CG1-O 3.47Å; V107-L123 HydrophobicContact CG2-CB 3.92Å; V107-F128 HydrophobicContact CB-CD1 4.49Å; V107-F128 HydrophobicContact CB-CE1 4.17Å; V107-F128 HydrophobicContact CG1-CD1 4.35Å; V107-F128 HydrophobicContact CG2-CD1 4.22Å; V107-F128 HydrophobicContact CG2-CE1 3.8Å; V107-L129 HydrophobicContact CB-CD2 4.15Å; V107-L129 HydrophobicContact CG1-CD1 4.47Å; V107-L129 HydrophobicContact CG1-CD2 3.8Å; V107-L129 HydrophobicContact CG1-CG 4.12Å
108	F	90.1	Very high	87.5	Confident	14 Å²	14	42.7 Å²	42.7	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-44.2	-178.1	177.8	-112	0	0	0	112	F104 L129 F139 A148 L149 L152	F104-F108 HydrophobicContact CD1-CB 4.48Å; F104-F108 HydrophobicContact CE1-CB 4.25Å; F104-F108 HydrophobicContact CE1-CD1 4.49Å; F104-F108 HydrophobicContact CE1-CG 4.3Å; F104-F108 HydrophobicContact CZ-CB 4.38Å; F104-F108 HydrophobicContact CZ-CG 4.31Å; F104-F108 WeakPolarHBondContact O-CB 3.32Å; F104-F108 PolarHBondContact O-N 3.1Å; F108-L129 HydrophobicContact CB-CD2 4.21Å; F108-F139 HydrophobicContact CE1-CZ 4.34Å; F108-A148 HydrophobicContact CD1-CB 4.47Å; F108-A148 HydrophobicContact CE1-CB 4.07Å; F108-A148 HydrophobicContact CE2-CB 4.32Å; F108-A148 HydrophobicContact CZ-CB 3.95Å; F108-A148 WeakPolarHBondContact CZ-O 3.34Å; F108-A148 WeakPolarHBondContact O-CB 3.27Å; F108-L149 HydrophobicContact CE1-CD2 4.1Å; F108-L149 HydrophobicContact CZ-CD2 4.24Å; F108-L152 HydrophobicContact CE1-CD1 4.27Å; F108-L152 HydrophobicContact CE2-CD1 3.9Å; F108-L152 HydrophobicContact CE2-CD2 3.78Å; F108-L152 HydrophobicContact CE2-CG 3.65Å; F108-L152 HydrophobicContact CZ-CD1 3.38Å; F108-L152 HydrophobicContact CZ-CD2 4.17Å; F108-L152 HydrophobicContact CZ-CG 3.58Å
109	Y	88.6	Confident	87	Confident	17 Å²	17	41.7 Å²	41.7	7%	0.067	23%	0.233	C	C	.	.	H	α-helix	trans	-90.7	0.5	178.7	-68.1	-60.2	0	0	0	114.4	T105 V107 L111 I140 I142 M145 A148 L149	T105-Y109 HydrophobicContact CG2-CD2 3.82Å; T105-Y109 HydrophobicContact CG2-CE2 4.17Å; T105-Y109 WeakPolarHBondContact O-CB 3.47Å; T105-Y109 WeakPolarHBondContact O-CD2 3.44Å; T105-Y109 PolarHBondContact O-N 2.97Å; T105-Y109 VanDerWaalsContact O-N 3.13Å; V107-Y109 PolarHBondContact O-N 2.94Å; Y109-L111 VanDerWaalsContact C-N 3.29Å; Y109-L111 PolarHBondContact O-N 3.21Å; Y109-I140 WeakPolarHBondContact CE2-O 3.45Å; Y109-I140 PolarHBondContact OH-O 3.29Å; Y109-I140 VanDerWaalsContact OH-O 3.1Å; Y109-I142 HydrophobicContact CD1-CB 4.45Å; Y109-I142 HydrophobicContact CD2-CB 4.39Å; Y109-I142 HydrophobicContact CD2-CD1 3.66Å; Y109-I142 HydrophobicContact CD2-CG1 4.11Å; Y109-I142 HydrophobicContact CE1-CB 4.05Å; Y109-I142 HydrophobicContact CE2-CB 3.99Å; Y109-I142 HydrophobicContact CE2-CD1 3.79Å; Y109-I142 HydrophobicContact CE2-CG1 3.72Å; Y109-I142 HydrophobicContact CG-CD1 4.26Å; Y109-I142 PolarHBondContact OH-N 2.88Å; Y109-M145 HydrophobicContact CD1-CB 3.32Å; Y109-M145 HydrophobicContact CD1-CG 3.81Å; Y109-M145 HydrophobicContact CE1-CB 3.75Å; Y109-M145 HydrophobicContact CE1-CG 4.47Å; Y109-M145 HydrophobicContact CG-CB 4.23Å; Y109-M145 HydrophobicContact CG-CG 4.25Å; Y109-A148 HydrophobicContact CD1-CB 3.76Å; Y109-A148 HydrophobicContact CE1-CB 4.16Å; Y109-L149 HydrophobicContact CE1-CD2 4.38Å; Y109-L149 HydrophobicContact CE1-CG 4.28Å
110	G	86.5	Confident	86.3	Confident	58 Å²	58	43.6 Å²	43.6	60%	0.598	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.5	22.8	-177.9	0	0	0	0	0	114.6	S106 V107	S106-G110 CarbonylContact O-C 3.52Å; S106-G110 WeakPolarHBondContact O-CA 3.38Å; S106-G110 PolarHBondContact O-N 3.09Å; V107-G110 PolarHBondContact O-N 3.31Å
111	L	85.6	Confident	85.5	Confident	66 Å²	66	49.3 Å²	49.3	35%	0.346	28%	0.282	S	S	.	.			trans	-72.5	130.5	176.4	-52.9	173.8	0	0	0	110.1	S106 Y109 I142 M145	S106-L111 PolarHBondContact O-N 2.94Å; Y109-L111 VanDerWaalsContact C-N 3.29Å; Y109-L111 PolarHBondContact O-N 3.21Å; L111-I142 HydrophobicContact CD1-CD1 4.47Å; L111-M145 HydrophobicContact CD2-CE 3.98Å
112	S	79.4	Confident	84.7	Confident	96 Å²	96	51.7 Å²	51.7	67%	0.671	29%	0.294	S	S	*	.			trans	-90.2	130.1	-179.3	-65.8	0	0	0	0	111.3
113	S	80.1	Confident	84.3	Confident	34 Å²	34	47.7 Å²	47.7	24%	0.238	28%	0.279	C	S	.	.			trans	-130.7	158.2	166.2	77	0	0	0	0	109.7	Y115 V116 L117	S113-Y115 PolarHBondContact O-N 3.2Å; S113-V116 PolarHBondContact O-N 3.15Å; S113-V116 VanDerWaalsContact OG-CG2 3.25Å; S113-V116 WeakPolarHBondContact OG-CG2 3.49Å; S113-V116 PolarHBondContact OG-N 2.92Å; S113-V116 VanDerWaalsContact OG-N 3.14Å; S113-L117 WeakPolarHBondContact O-CG 3.43Å; S113-L117 PolarHBondContact O-N 3.47Å
114	N	80.3	Confident	83.4	Confident	147 Å²	147	55.5 Å²	55.5	79%	0.786	31%	0.313	S	S	*	.	H	α-helix	trans	-54.4	-38.6	178.2	-72.6	-20.1	0	0	0	111.9	K118	N114-K118 VanDerWaalsContact O-CB 3.31Å; N114-K118 WeakPolarHBondContact O-CB 3.34Å; N114-K118 PolarHBondContact O-N 2.98Å; N114-K118 VanDerWaalsContact O-N 3.12Å
115	Y	83	Confident	82.7	Confident	13 Å²	13	57 Å²	57	5%	0.051	32%	0.324	C	S	.	.	H	α-helix	trans	-67.1	-45.1	175.5	-172.5	-83.3	0	0	0	112.2	A52 I76 D79 L80 L103 S113 K118 N119 L123	A52-Y115 PolarHBondContact N-OH 3.37Å; I76-Y115 HydrophobicContact CB-CE2 4.4Å; I76-Y115 WeakPolarHBondContact CD1-OH 3.42Å; I76-Y115 HydrophobicContact CG1-CE2 4.1Å; I76-Y115 HydrophobicContact CG2-CD2 4.44Å; I76-Y115 HydrophobicContact CG2-CE1 4.29Å; I76-Y115 HydrophobicContact CG2-CE2 3.81Å; D79-Y115 HydrophobicContact CB-CD2 4.06Å; L80-Y115 HydrophobicContact CD2-CD1 4.43Å; L80-Y115 HydrophobicContact CD2-CG 4.18Å; L103-Y115 HydrophobicContact CD1-CE1 4.03Å; L103-Y115 HydrophobicContact CD2-CD1 3.65Å; L103-Y115 HydrophobicContact CD2-CE1 3.86Å; S113-Y115 PolarHBondContact O-N 3.2Å; Y115-K118 PolarHBondContact O-N 2.96Å; Y115-N119 HydrophobicContact CE1-CB 4.46Å; Y115-N119 PolarHBondContact O-N 3.49Å; Y115-N119 VanDerWaalsContact O-N 3.1Å; Y115-N119 PolarHBondContact O-ND2 3.38Å; Y115-L123 HydrophobicContact CD1-CD1 4.34Å; Y115-L123 HydrophobicContact CE1-CD1 4.27Å
116	V	82.4	Confident	82.3	Confident	12 Å²	12	61.7 Å²	61.7	7%	0.073	35%	0.349	C	S	.	.	H	α-helix	trans	-64.5	-42	-180	170.2	0	0	0	0	111.1	L103 S113 N119 S120 L123	L103-V116 HydrophobicContact CD2-CG2 4.11Å; S113-V116 PolarHBondContact O-N 3.15Å; S113-V116 VanDerWaalsContact OG-CG2 3.25Å; S113-V116 WeakPolarHBondContact OG-CG2 3.49Å; S113-V116 PolarHBondContact OG-N 2.92Å; S113-V116 VanDerWaalsContact OG-N 3.14Å; V116-N119 CarbonylContact O-C 3.6Å; V116-N119 PolarHBondContact O-N 2.79Å; V116-S120 VanDerWaalsContact O-CA 3.28Å; V116-S120 WeakPolarHBondContact O-CA 3.43Å; V116-S120 WeakPolarHBondContact O-CB 3.04Å; V116-S120 PolarHBondContact O-N 2.78Å; V116-L123 HydrophobicContact CG2-CD1 4.28Å
117	L	81.1	Confident	82	Confident	102 Å²	102	64.5 Å²	64.5	53%	0.534	37%	0.368	S	S	.	.	H	α-helix	trans	-62.7	-46.1	177.3	-69.5	172	0	0	0	111.3	S113 N119 S120	S113-L117 WeakPolarHBondContact O-CG 3.43Å; S113-L117 PolarHBondContact O-N 3.47Å; L117-N119 PolarHBondContact O-N 2.69Å; L117-S120 PolarHBondContact O-N 2.98Å; L117-S120 PolarHBondContact O-OG 3.37Å
118	K	82.9	Confident	82	Confident	146 Å²	146	63.5 Å²	63.5	64%	0.635	36%	0.362	S	S	*	.	H	α-helix	trans	-62.9	-27.8	178.4	-173.9	176.8	178	-177	0	113.4	N114 Y115	N114-K118 VanDerWaalsContact O-CB 3.31Å; N114-K118 WeakPolarHBondContact O-CB 3.34Å; N114-K118 PolarHBondContact O-N 2.98Å; N114-K118 VanDerWaalsContact O-N 3.12Å; Y115-K118 PolarHBondContact O-N 2.96Å
119	N	81.9	Confident	82	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.043	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	21.6	-175.2	-61.3	-72.3	0	0	0	113.4	R24 T51 Y115 V116 L117 T121 N122 L123	R24-N119 PolarHBondContact NH2-OD1 3.41Å; T51-N119 WeakPolarHBondContact CG2-OD1 3.2Å; Y115-N119 HydrophobicContact CE1-CB 4.46Å; Y115-N119 PolarHBondContact O-N 3.49Å; Y115-N119 VanDerWaalsContact O-N 3.1Å; Y115-N119 PolarHBondContact O-ND2 3.38Å; V116-N119 CarbonylContact O-C 3.6Å; V116-N119 PolarHBondContact O-N 2.79Å; L117-N119 PolarHBondContact O-N 2.69Å; N119-T121 VanDerWaalsContact C-N 3.26Å; N119-T121 PolarHBondContact O-N 3.45Å; N119-N122 PolarHBondContact O-N 3.3Å; N119-N122 VanDerWaalsContact O-N 3.16Å; N119-L123 HydrophobicContact CB-CD1 3.76Å; N119-L123 HydrophobicContact CB-CG 4.13Å; N119-L123 WeakPolarHBondContact O-CG 3.49Å; N119-L123 PolarHBondContact O-N 2.88Å; N119-L123 VanDerWaalsContact O-N 3.16Å
120	S	77.8	Confident	82.1	Confident	40 Å²	40	64.4 Å²	64.4	28%	0.28	37%	0.372	S	S	.	.	H	α-helix	trans	-60	-31.9	-169.1	55.4	0	0	0	0	114.3	V116 L117 K124	V116-S120 VanDerWaalsContact O-CA 3.28Å; V116-S120 WeakPolarHBondContact O-CA 3.43Å; V116-S120 WeakPolarHBondContact O-CB 3.04Å; V116-S120 PolarHBondContact O-N 2.78Å; L117-S120 PolarHBondContact O-N 2.98Å; L117-S120 PolarHBondContact O-OG 3.37Å; S120-K124 WeakPolarHBondContact O-CB 3.26Å; S120-K124 WeakPolarHBondContact O-CG 3.49Å; S120-K124 PolarHBondContact O-N 3.45Å; S120-K124 VanDerWaalsContact O-N 3.11Å
121	T	76.2	Confident	82.2	Confident	121 Å²	121	63.5 Å²	63.5	74%	0.742	36%	0.356	S	S	*	.	H	α-helix	trans	-63.1	-40	178.2	50.5	0	0	0	0	112.8	N119	N119-T121 VanDerWaalsContact C-N 3.26Å; N119-T121 PolarHBondContact O-N 3.45Å
122	N	77.2	Confident	82.5	Confident	61 Å²	61	60.4 Å²	60.4	33%	0.326	34%	0.34	S	S	.	.	H	α-helix	trans	-82.1	-36.5	-179.5	-65.9	-18.1	0	0	0	111.8	N119 S125	N119-N122 PolarHBondContact O-N 3.3Å; N119-N122 VanDerWaalsContact O-N 3.16Å; N122-S125 PolarHBondContact O-OG 3.39Å
123	L	80.6	Confident	83.1	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-82.7	-29	-170.6	-67.4	176.4	0	0	0	114.1	L103 V107 Y115 V116 N119 S125 F128	L103-L123 HydrophobicContact CD1-CD2 4.3Å; L103-L123 HydrophobicContact CD2-CD1 4.37Å; V107-L123 WeakPolarHBondContact CG1-O 3.47Å; V107-L123 HydrophobicContact CG2-CB 3.92Å; Y115-L123 HydrophobicContact CD1-CD1 4.34Å; Y115-L123 HydrophobicContact CE1-CD1 4.27Å; V116-L123 HydrophobicContact CG2-CD1 4.28Å; N119-L123 HydrophobicContact CB-CD1 3.76Å; N119-L123 HydrophobicContact CB-CG 4.13Å; N119-L123 WeakPolarHBondContact O-CG 3.49Å; N119-L123 PolarHBondContact O-N 2.88Å; N119-L123 VanDerWaalsContact O-N 3.16Å; L123-S125 PolarHBondContact O-N 3.25Å; L123-F128 HydrophobicContact CD2-CD1 4.17Å; L123-F128 HydrophobicContact CD2-CD2 3.81Å; L123-F128 HydrophobicContact CD2-CE1 3.99Å; L123-F128 HydrophobicContact CD2-CE2 3.6Å; L123-F128 HydrophobicContact CD2-CG 4.09Å; L123-F128 HydrophobicContact CD2-CZ 3.72Å; L123-F128 WeakPolarHBondContact O-CD1 3.33Å
124	K	73.9	Confident	83.7	Confident	164 Å²	164	59.5 Å²	59.5	71%	0.713	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	5	179.5	-70.3	-177.1	177	-175.6	0	114.1	S120	S120-K124 WeakPolarHBondContact O-CB 3.26Å; S120-K124 WeakPolarHBondContact O-CG 3.49Å; S120-K124 PolarHBondContact O-N 3.45Å; S120-K124 VanDerWaalsContact O-N 3.11Å
125	S	79.1	Confident	84.1	Confident	35 Å²	35	53.7 Å²	53.7	25%	0.245	29%	0.29	C	S	.	.	S	Bend	trans	-77.8	142.9	178.9	64.3	0	0	0	0	111.6	N122 L123 S127 F128 L129	N122-S125 PolarHBondContact O-OG 3.39Å; L123-S125 PolarHBondContact O-N 3.25Å; S125-S127 WeakPolarHBondContact CB-OG 3.06Å; S125-S127 PolarHBondContact O-N 2.89Å; S125-S127 PolarHBondContact OG-OG 2.9Å; S125-F128 PolarHBondContact O-N 2.85Å; S125-F128 VanDerWaalsContact O-N 3.13Å; S125-F128 WeakPolarHBondContact OG-CB 3.25Å; S125-F128 PolarHBondContact OG-N 3.4Å; S125-L129 PolarHBondContact O-N 2.82Å
126	N	81.3	Confident	84.6	Confident	113 Å²	113	53 Å²	53	60%	0.604	29%	0.288	S	S	*	.	H	α-helix	trans	-62.5	-26.6	172.8	-74.6	-15.6	0	0	0	112.1	S130	N126-S130 WeakPolarHBondContact O-CB 3.37Å; N126-S130 PolarHBondContact O-N 3.37Å; N126-S130 VanDerWaalsContact O-N 3.14Å; N126-S130 PolarHBondContact O-OG 2.68Å
127	S	84.4	Confident	85.2	Confident	79 Å²	79	55.9 Å²	55.9	55%	0.552	30%	0.3	S	S	*	.	H	α-helix	trans	-63.9	-43.4	173.1	48.3	0	0	0	0	111.5	S125 S130 S131	S125-S127 WeakPolarHBondContact CB-OG 3.06Å; S125-S127 PolarHBondContact O-N 2.89Å; S125-S127 PolarHBondContact OG-OG 2.9Å; S127-S130 PolarHBondContact O-N 3.2Å; S127-S131 PolarHBondContact O-N 3.29Å; S127-S131 PolarHBondContact O-OG 3.13Å
128	F	89.8	Confident	85.7	Confident	5 Å²	5	55 Å²	55	2%	0.022	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-50.9	176.5	170.9	-101.6	0	0	0	111.8	C53 M100 L103 V107 L123 S125 S130 S131 A132	C53-F128 WeakPolarHBondContact SG-CD2 3.33Å; M100-F128 HydrophobicContact SD-CE2 4.11Å; L103-F128 HydrophobicContact CB-CE1 4.29Å; L103-F128 HydrophobicContact CB-CZ 3.6Å; L103-F128 HydrophobicContact CD1-CZ 4.4Å; V107-F128 HydrophobicContact CB-CD1 4.49Å; V107-F128 HydrophobicContact CB-CE1 4.17Å; V107-F128 HydrophobicContact CG1-CD1 4.35Å; V107-F128 HydrophobicContact CG2-CD1 4.22Å; V107-F128 HydrophobicContact CG2-CE1 3.8Å; L123-F128 HydrophobicContact CD2-CD1 4.17Å; L123-F128 HydrophobicContact CD2-CD2 3.81Å; L123-F128 HydrophobicContact CD2-CE1 3.99Å; L123-F128 HydrophobicContact CD2-CE2 3.6Å; L123-F128 HydrophobicContact CD2-CG 4.09Å; L123-F128 HydrophobicContact CD2-CZ 3.72Å; L123-F128 WeakPolarHBondContact O-CD1 3.33Å; S125-F128 PolarHBondContact O-N 2.85Å; S125-F128 VanDerWaalsContact O-N 3.13Å; S125-F128 WeakPolarHBondContact OG-CB 3.25Å; S125-F128 PolarHBondContact OG-N 3.4Å; F128-S130 PolarHBondContact O-N 3.3Å; F128-S131 PolarHBondContact O-N 2.95Å; F128-S131 VanDerWaalsContact O-N 3.16Å; F128-A132 HydrophobicContact CE1-CB 4.34Å; F128-A132 HydrophobicContact CE2-CB 4.27Å; F128-A132 HydrophobicContact CZ-CB 4.01Å; F128-A132 WeakPolarHBondContact O-CB 3.41Å; F128-A132 PolarHBondContact O-N 2.85Å
129	L	90.2	Very high	86.3	Confident	11 Å²	11	48.2 Å²	48.2	6%	0.058	26%	0.264	C	S	.	.	H	α-helix	trans	-57.9	-38.9	179	-74.9	175.3	0	0	0	111.8	F104 V107 F108 S125 A133 L159	F104-L129 HydrophobicContact CD2-CD2 3.76Å; F104-L129 HydrophobicContact CE2-CD2 3.88Å; V107-L129 HydrophobicContact CB-CD2 4.15Å; V107-L129 HydrophobicContact CG1-CD1 4.47Å; V107-L129 HydrophobicContact CG1-CD2 3.8Å; V107-L129 HydrophobicContact CG1-CG 4.12Å; F108-L129 HydrophobicContact CB-CD2 4.21Å; S125-L129 PolarHBondContact O-N 2.82Å; L129-A133 WeakPolarHBondContact O-CB 3.43Å; L129-A133 PolarHBondContact O-N 2.73Å; L129-L159 HydrophobicContact CB-CD1 4.33Å; L129-L159 HydrophobicContact CB-CD2 4.16Å; L129-L159 HydrophobicContact CD1-CD2 4.32Å
130	S	90.3	Very high	86.7	Confident	39 Å²	39	50.4 Å²	50.4	27%	0.273	28%	0.275	S	S	.	.	H	α-helix	trans	-68.5	-40.8	177.8	-57.6	0	0	0	0	112.7	N126 S127 F128 K134	N126-S130 WeakPolarHBondContact O-CB 3.37Å; N126-S130 PolarHBondContact O-N 3.37Å; N126-S130 VanDerWaalsContact O-N 3.14Å; N126-S130 PolarHBondContact O-OG 2.68Å; S127-S130 PolarHBondContact O-N 3.2Å; F128-S130 PolarHBondContact O-N 3.3Å; S130-K134 WeakPolarHBondContact O-CG 3.39Å; S130-K134 PolarHBondContact O-N 3.3Å
131	S	89.3	Confident	87.3	Confident	39 Å²	39	48.5 Å²	48.5	27%	0.273	26%	0.261	S	S	.	.	H	α-helix	trans	-68.5	-42.5	175.8	-70.8	0	0	0	0	112.2	D56 S127 F128 K134 S135	D56-S131 WeakPolarHBondContact OD2-CB 3.36Å; S127-S131 PolarHBondContact O-N 3.29Å; S127-S131 PolarHBondContact O-OG 3.13Å; F128-S131 PolarHBondContact O-N 2.95Å; F128-S131 VanDerWaalsContact O-N 3.16Å; S131-K134 PolarHBondContact O-N 2.93Å; S131-S135 PolarHBondContact O-N 3.42Å; S131-S135 PolarHBondContact O-OG 2.97Å; S131-S135 VanDerWaalsContact O-OG 3.12Å
132	A	92.3	Very high	87.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.1	-43.5	176.2	0	0	0	0	0	110.9	M100 F104 F128 K134 S135 I136	M100-A132 HydrophobicContact CB-CB 4.5Å; M100-A132 HydrophobicContact SD-CB 4.02Å; F104-A132 HydrophobicContact CB-CB 4.01Å; F104-A132 HydrophobicContact CD2-CB 3.99Å; F104-A132 HydrophobicContact CG-CB 4.47Å; F128-A132 HydrophobicContact CE1-CB 4.34Å; F128-A132 HydrophobicContact CE2-CB 4.27Å; F128-A132 HydrophobicContact CZ-CB 4.01Å; F128-A132 WeakPolarHBondContact O-CB 3.41Å; F128-A132 PolarHBondContact O-N 2.85Å; A132-K134 PolarHBondContact O-N 3.1Å; A132-S135 PolarHBondContact O-N 2.97Å; A132-I136 WeakPolarHBondContact O-CG1 3.4Å; A132-I136 WeakPolarHBondContact O-CG2 3.4Å; A132-I136 PolarHBondContact O-N 3.06Å; A132-I136 VanDerWaalsContact O-N 3.1Å
133	A	91.9	Very high	87.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-31.9	176	0	0	0	0	0	113.8	F104 L129 L159 L162 L163	F104-A133 HydrophobicContact CE2-CB 4.21Å; L129-A133 WeakPolarHBondContact O-CB 3.43Å; L129-A133 PolarHBondContact O-N 2.73Å; A133-L159 HydrophobicContact CB-CD1 3.64Å; A133-L162 HydrophobicContact CB-CB 4.38Å; A133-L163 HydrophobicContact CB-CD2 3.92Å
134	K	91.1	Very high	87.6	Confident	112 Å²	112	46.8 Å²	46.8	49%	0.487	25%	0.254	S	S	.	.	H	α-helix	trans	-75.4	-24.5	174.9	-68.6	169.8	-176	176.8	0	113.4	S130 S131 A132 L162 H166	S130-K134 WeakPolarHBondContact O-CG 3.39Å; S130-K134 PolarHBondContact O-N 3.3Å; S131-K134 PolarHBondContact O-N 2.93Å; A132-K134 PolarHBondContact O-N 3.1Å; K134-L162 HydrophobicContact CG-CD2 4.37Å; K134-H166 PolarHBondContact O-CD2 3.39Å
135	S	90	Very high	88	Confident	24 Å²	24	42.2 Å²	42.2	17%	0.168	24%	0.236	C	C	.	.	H	α-helix	trans	-92.7	-15.5	-176.1	-58.8	0	0	0	0	113	K96 H97 S131 A132	K96-S135 WeakPolarHBondContact CE-OG 3.45Å; H97-S135 PolarHBondContact ND1-O 3.38Å; S131-S135 PolarHBondContact O-N 3.42Å; S131-S135 PolarHBondContact O-OG 2.97Å; S131-S135 VanDerWaalsContact O-OG 3.12Å; A132-S135 PolarHBondContact O-N 2.97Å
136	I	93.3	Very high	87.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.234	C	C	.	.			trans	-99.2	145.6	-178	65	175.8	0	0	0	111.6	M100 L101 F104 A132 L163 I167	M100-I136 HydrophobicContact CB-CG2 3.95Å; L101-I136 HydrophobicContact CB-CG2 4.04Å; L101-I136 HydrophobicContact CD1-CG2 4.48Å; F104-I136 HydrophobicContact CB-CD1 4.43Å; F104-I136 HydrophobicContact CD1-CD1 3.71Å; F104-I136 HydrophobicContact CD2-CD1 4.31Å; F104-I136 HydrophobicContact CE1-CD1 4.01Å; F104-I136 HydrophobicContact CG-CD1 3.89Å; F104-I136 HydrophobicContact CZ-CD1 4.43Å; A132-I136 WeakPolarHBondContact O-CG1 3.4Å; A132-I136 WeakPolarHBondContact O-CG2 3.4Å; A132-I136 PolarHBondContact O-N 3.06Å; A132-I136 VanDerWaalsContact O-N 3.1Å; I136-L163 HydrophobicContact CD1-CD2 4.08Å; I136-I167 HydrophobicContact CD1-CD1 3.98Å; I136-I167 HydrophobicContact CG1-CD1 3.81Å
137	H	93.6	Very high	88.1	Confident	71 Å²	71	45.3 Å²	45.3	33%	0.329	24%	0.243	S	C	.	.			trans	-114.6	-8.8	173	-58	-51	0	0	0	112.8	H97 H166 I167 R168 S169	H97-H137 PolarHBondContact CE1-N 2.98Å; H97-H137 VanDerWaalsContact CE1-N 3.25Å; H137-H166 WeakPolarHBondContact CA-O 3.45Å; H137-H166 PolarHBondContact ND1-O 3.33Å; H137-H166 VanDerWaalsContact ND1-O 3.1Å; H137-I167 WeakPolarHBondContact O-CA 3.25Å; H137-R168 PolarHBondContact O-N 2.89Å; H137-S169 PolarHBondContact O-N 3.41Å
138	H	93.5	Very high	88.1	Confident	85 Å²	85	42.3 Å²	42.3	39%	0.394	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.4	-177.7	-64.5	176.7	0	0	0	109.3	H97 L101 S169	H97-H138 AromaticContact NE2-CG 3.98Å; H97-H138 AromaticContact NE2-ND1 3.82Å; L101-H138 HydrophobicContact CD1-CB 4.24Å; L101-H138 WeakPolarHBondContact CD1-O 3.44Å; L101-H138 HydrophobicContact CD2-CB 4.09Å; H138-S169 CarbonylContact C-O 3.6Å; H138-S169 VanDerWaalsContact CA-O 3.31Å; H138-S169 WeakPolarHBondContact CA-O 3.29Å; H138-S169 VanDerWaalsContact CD2-CB 3.45Å; H138-S169 WeakPolarHBondContact CD2-CB 3.37Å
139	F	94.3	Very high	88	Confident	3 Å²	3	42.1 Å²	42.1	1%	0.013	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.5	174.2	-175.9	-96.5	0	0	0	109.7	F104 F108 L141 L149 L163 I167 S169 V170 H171 V188 L192	F104-F139 HydrophobicContact CE1-CD2 4.21Å; F104-F139 HydrophobicContact CE1-CE2 4.06Å; F108-F139 HydrophobicContact CE1-CZ 4.34Å; F139-L141 HydrophobicContact CE1-CB 4.3Å; F139-L141 HydrophobicContact CE1-CD1 3.87Å; F139-L149 HydrophobicContact CZ-CD2 4.33Å; F139-L163 HydrophobicContact CD2-CD1 4.16Å; F139-L163 HydrophobicContact CD2-CD2 4.35Å; F139-L163 HydrophobicContact CE2-CD1 3.93Å; F139-I167 HydrophobicContact CB-CD1 3.96Å; F139-I167 HydrophobicContact CB-CG1 4.1Å; F139-I167 HydrophobicContact CB-CG2 3.79Å; F139-S169 PolarHBondContact N-O 3.26Å; F139-V170 HydrophobicContact CB-CG2 4.48Å; F139-V170 WeakPolarHBondContact O-CA 3.45Å; F139-H171 PolarHBondContact O-N 3.02Å; F139-V188 HydrophobicContact CE1-CG1 4.42Å; F139-V188 HydrophobicContact CZ-CG1 4.5Å; F139-L192 HydrophobicContact CB-CD1 4.38Å; F139-L192 HydrophobicContact CD1-CD1 3.63Å; F139-L192 HydrophobicContact CE1-CD1 3.99Å; F139-L192 HydrophobicContact CG-CD1 3.94Å
140	I	91.3	Very high	87.8	Confident	53 Å²	53	46 Å²	46	27%	0.272	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	113.7	178.6	-58	173.4	0	0	0	107.8	Y109 I142	Y109-I140 WeakPolarHBondContact CE2-O 3.45Å; Y109-I140 PolarHBondContact OH-O 3.29Å; Y109-I140 VanDerWaalsContact OH-O 3.1Å; I140-I142 HydrophobicContact CG2-CG1 4.26Å
141	L	89.9	Confident	87.6	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	121.9	176.9	-171.4	79.3	0	0	0	110.5	F139 P143 L149 H171 V172 L175 V185 L189	F139-L141 HydrophobicContact CE1-CB 4.3Å; F139-L141 HydrophobicContact CE1-CD1 3.87Å; L141-P143 HydrophobicContact CD2-CG 4.35Å; L141-P143 WeakPolarHBondContact O-CD 3.41Å; L141-L149 HydrophobicContact CD1-CD1 3.88Å; L141-L149 HydrophobicContact CD1-CD2 3.88Å; L141-H171 WeakPolarHBondContact CB-O 3.38Å; L141-H171 PolarHBondContact N-O 3.14Å; L141-V172 HydrophobicContact CD2-CG1 4.04Å; L141-V172 HydrophobicContact CD2-CG2 4.28Å; L141-L175 HydrophobicContact CD2-CD1 3.81Å; L141-V185 HydrophobicContact CD1-CG1 4.15Å; L141-V185 HydrophobicContact CD2-CG1 3.7Å; L141-V185 HydrophobicContact CG-CG1 4.3Å; L141-L189 HydrophobicContact CD2-CD1 3.73Å; L141-L189 HydrophobicContact CD2-CD2 4Å; L141-L189 HydrophobicContact CD2-CG 3.9Å
142	I	85.9	Confident	87.4	Confident	41 Å²	41	43.5 Å²	43.5	21%	0.21	22%	0.224	C	C	.	.			trans	-115.5	91.6	172.4	-52.5	-178.3	0	0	0	108.9	T105 Y109 L111 I140 C144 M145	T105-I142 HydrophobicContact CG2-CD1 4.33Å; Y109-I142 HydrophobicContact CD1-CB 4.45Å; Y109-I142 HydrophobicContact CD2-CB 4.39Å; Y109-I142 HydrophobicContact CD2-CD1 3.66Å; Y109-I142 HydrophobicContact CD2-CG1 4.11Å; Y109-I142 HydrophobicContact CE1-CB 4.05Å; Y109-I142 HydrophobicContact CE2-CB 3.99Å; Y109-I142 HydrophobicContact CE2-CD1 3.79Å; Y109-I142 HydrophobicContact CE2-CG1 3.72Å; Y109-I142 HydrophobicContact CG-CD1 4.26Å; Y109-I142 PolarHBondContact OH-N 2.88Å; L111-I142 HydrophobicContact CD1-CD1 4.47Å; I140-I142 HydrophobicContact CG2-CG1 4.26Å; I142-C144 VanDerWaalsContact C-N 3.32Å; I142-C144 VanDerWaalsContact CG2-SG 3.52Å; I142-C144 PolarHBondContact O-N 3.19Å; I142-M145 HydrophobicContact CB-CG 4.27Å; I142-M145 HydrophobicContact CG2-CB 4.38Å; I142-M145 HydrophobicContact CG2-CG 3.7Å; I142-M145 PolarHBondContact O-N 2.79Å; I142-M145 VanDerWaalsContact O-N 3.12Å
143	P	78.2	Confident	87	Confident	14 Å²	14	43.6 Å²	43.6	9%	0.091	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-29.7	-170.8	-13.8	19.8	0	0	0	114.8	L141 M145 H174 V185	L141-P143 HydrophobicContact CD2-CG 4.35Å; L141-P143 WeakPolarHBondContact O-CD 3.41Å; P143-M145 PolarHBondContact O-N 3.12Å; P143-H174 HydrophobicContact CG-CB 4.33Å; P143-H174 WeakPolarHBondContact CG-O 3.24Å; P143-V185 HydrophobicContact CB-CG1 4.32Å; P143-V185 HydrophobicContact CB-CG2 4.48Å
144	C	76.4	Confident	86.5	Confident	93 Å²	93	46.9 Å²	46.9	63%	0.628	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.8	178	59.7	0	0	0	0	112.5	I142 H146	I142-C144 VanDerWaalsContact C-N 3.32Å; I142-C144 VanDerWaalsContact CG2-SG 3.52Å; I142-C144 PolarHBondContact O-N 3.19Å; C144-H146 VanDerWaalsContact C-N 3.25Å; C144-H146 PolarHBondContact O-N 3.29Å
145	M	80.9	Confident	86	Confident	68 Å²	68	48.4 Å²	48.4	34%	0.335	26%	0.259	S	S	.	.			trans	-89.8	53.7	174.8	-59.3	-63.3	177.7	0	0	111.5	Y109 L111 I142 P143 Q147 A148	Y109-M145 HydrophobicContact CD1-CB 3.32Å; Y109-M145 HydrophobicContact CD1-CG 3.81Å; Y109-M145 HydrophobicContact CE1-CB 3.75Å; Y109-M145 HydrophobicContact CE1-CG 4.47Å; Y109-M145 HydrophobicContact CG-CB 4.23Å; Y109-M145 HydrophobicContact CG-CG 4.25Å; L111-M145 HydrophobicContact CD2-CE 3.98Å; I142-M145 HydrophobicContact CB-CG 4.27Å; I142-M145 HydrophobicContact CG2-CB 4.38Å; I142-M145 HydrophobicContact CG2-CG 3.7Å; I142-M145 PolarHBondContact O-N 2.79Å; I142-M145 VanDerWaalsContact O-N 3.12Å; P143-M145 PolarHBondContact O-N 3.12Å; M145-Q147 PolarHBondContact O-N 3.05Å; M145-A148 PolarHBondContact O-N 3.17Å
146	H	78.9	Confident	85.7	Confident	45 Å²	45	49.5 Å²	49.5	21%	0.208	26%	0.261	C	S	.	.	H	α-helix	trans	-56.6	-35.1	-172.9	-177.5	-74.7	0	0	0	113.3	C144 A148 L149 Q150 K181	C144-H146 VanDerWaalsContact C-N 3.25Å; C144-H146 PolarHBondContact O-N 3.29Å; H146-A148 PolarHBondContact O-N 2.92Å; H146-L149 PolarHBondContact O-N 3.04Å; H146-Q150 PolarHBondContact CE1-OE1 3.35Å; H146-Q150 PolarHBondContact ND1-OE1 2.95Å; H146-Q150 VanDerWaalsContact O-CB 3.31Å; H146-Q150 WeakPolarHBondContact O-CB 3.48Å; H146-Q150 PolarHBondContact O-N 3.15Å; H146-K181 PolarHBondContact CD2-O 3.09Å; H146-K181 PolarHBondContact NE2-O 2.89Å
147	Q	83.9	Confident	85.2	Confident	168 Å²	168	52.4 Å²	52.4	79%	0.785	28%	0.275	S	S	*	.	H	α-helix	trans	-60.9	-41.7	-178.4	-66.7	178.9	-0.6	0	0	112.7	M145 Q150 A151	M145-Q147 PolarHBondContact O-N 3.05Å; Q147-Q150 PolarHBondContact O-N 3.25Å; Q147-A151 PolarHBondContact O-N 3.42Å
148	A	85.5	Confident	85	Confident	17 Å²	17	53.7 Å²	53.7	14%	0.14	29%	0.289	C	S	.	.	H	α-helix	trans	-66.7	-41.4	177.6	0	0	0	0	0	111.5	F108 Y109 M145 H146 A151 L152	F108-A148 HydrophobicContact CD1-CB 4.47Å; F108-A148 HydrophobicContact CE1-CB 4.07Å; F108-A148 HydrophobicContact CE2-CB 4.32Å; F108-A148 HydrophobicContact CZ-CB 3.95Å; F108-A148 WeakPolarHBondContact CZ-O 3.34Å; F108-A148 WeakPolarHBondContact O-CB 3.27Å; Y109-A148 HydrophobicContact CD1-CB 3.76Å; Y109-A148 HydrophobicContact CE1-CB 4.16Å; M145-A148 PolarHBondContact O-N 3.17Å; H146-A148 PolarHBondContact O-N 2.92Å; A148-A151 WeakPolarHBondContact O-CB 3.33Å; A148-A151 PolarHBondContact O-N 3.4Å; A148-L152 PolarHBondContact O-N 2.95Å
149	L	87	Confident	84.9	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-69.1	-35.9	177.8	-65.1	172.1	0	0	0	112	F108 Y109 F139 L141 H146 A151 L152 T153 V185 V188	F108-L149 HydrophobicContact CE1-CD2 4.1Å; F108-L149 HydrophobicContact CZ-CD2 4.24Å; Y109-L149 HydrophobicContact CE1-CD2 4.38Å; Y109-L149 HydrophobicContact CE1-CG 4.28Å; F139-L149 HydrophobicContact CZ-CD2 4.33Å; L141-L149 HydrophobicContact CD1-CD1 3.88Å; L141-L149 HydrophobicContact CD1-CD2 3.88Å; H146-L149 PolarHBondContact O-N 3.04Å; L149-A151 VanDerWaalsContact C-N 3.3Å; L149-A151 PolarHBondContact O-N 3.31Å; L149-L152 HydrophobicContact CD2-CD1 4.3Å; L149-L152 WeakPolarHBondContact O-CB 3.41Å; L149-L152 PolarHBondContact O-N 2.98Å; L149-T153 WeakPolarHBondContact O-CG2 3.45Å; L149-T153 PolarHBondContact O-N 3.04Å; L149-V185 HydrophobicContact CD1-CB 4.4Å; L149-V185 HydrophobicContact CD1-CG1 4.32Å; L149-V185 HydrophobicContact CD1-CG2 3.77Å; L149-V188 HydrophobicContact CD2-CG1 4.4Å
150	Q	86.8	Confident	84.7	Confident	92 Å²	92	50.1 Å²	50.1	43%	0.43	27%	0.273	S	S	.	.	H	α-helix	trans	-67.2	-31.3	172.8	-171.6	173.8	9.5	0	0	112.3	H146 Q147 L152 T153 T154 A184	H146-Q150 PolarHBondContact CE1-OE1 3.35Å; H146-Q150 PolarHBondContact ND1-OE1 2.95Å; H146-Q150 VanDerWaalsContact O-CB 3.31Å; H146-Q150 WeakPolarHBondContact O-CB 3.48Å; H146-Q150 PolarHBondContact O-N 3.15Å; Q147-Q150 PolarHBondContact O-N 3.25Å; Q150-L152 VanDerWaalsContact C-N 3.3Å; Q150-L152 PolarHBondContact O-N 2.97Å; Q150-T153 PolarHBondContact O-N 3.43Å; Q150-T153 PolarHBondContact O-OG1 3.48Å; Q150-T154 PolarHBondContact O-N 3.14Å; Q150-T154 PolarHBondContact O-OG1 3.38Å; Q150-A184 HydrophobicContact CB-CB 4.34Å
151	A	86	Confident	84.7	Confident	26 Å²	26	50.4 Å²	50.4	22%	0.215	28%	0.277	C	S	.	.	H	α-helix	trans	-63.5	-36.5	172.8	0	0	0	0	0	111.6	Q147 A148 L149 T153 T154 N155 Q156	Q147-A151 PolarHBondContact O-N 3.42Å; A148-A151 WeakPolarHBondContact O-CB 3.33Å; A148-A151 PolarHBondContact O-N 3.4Å; L149-A151 VanDerWaalsContact C-N 3.3Å; L149-A151 PolarHBondContact O-N 3.31Å; A151-T153 VanDerWaalsContact C-N 3.28Å; A151-T153 PolarHBondContact O-N 3.02Å; A151-T154 PolarHBondContact O-N 3.18Å; A151-N155 PolarHBondContact O-N 2.86Å; A151-Q156 WeakPolarHBondContact O-CB 3.39Å; A151-Q156 PolarHBondContact O-N 3.28Å
152	L	85.5	Confident	84.8	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-32.9	174.6	-69.6	177.3	0	0	0	113.1	F108 A148 L149 Q150 T154 Q156 Q157 L159 L163 V188	F108-L152 HydrophobicContact CE1-CD1 4.27Å; F108-L152 HydrophobicContact CE2-CD1 3.9Å; F108-L152 HydrophobicContact CE2-CD2 3.78Å; F108-L152 HydrophobicContact CE2-CG 3.65Å; F108-L152 HydrophobicContact CZ-CD1 3.38Å; F108-L152 HydrophobicContact CZ-CD2 4.17Å; F108-L152 HydrophobicContact CZ-CG 3.58Å; A148-L152 PolarHBondContact O-N 2.95Å; L149-L152 HydrophobicContact CD2-CD1 4.3Å; L149-L152 WeakPolarHBondContact O-CB 3.41Å; L149-L152 PolarHBondContact O-N 2.98Å; Q150-L152 VanDerWaalsContact C-N 3.3Å; Q150-L152 PolarHBondContact O-N 2.97Å; L152-T154 VanDerWaalsContact C-N 3.34Å; L152-Q156 HydrophobicContact CD2-CB 4.16Å; L152-Q157 WeakPolarHBondContact O-CA 3.34Å; L152-Q157 PolarHBondContact O-N 2.88Å; L152-L159 HydrophobicContact CD2-CB 4.14Å; L152-L159 HydrophobicContact CD2-CD2 3.92Å; L152-L159 HydrophobicContact CD2-CG 4.12Å; L152-L163 HydrophobicContact CD1-CD1 4.48Å; L152-V188 HydrophobicContact CB-CG2 4.05Å; L152-V188 HydrophobicContact CD1-CG1 4.15Å; L152-V188 HydrophobicContact CD1-CG2 4.03Å
153	T	82.2	Confident	85.2	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.018	28%	0.277	C	S	.	.	H	α-helix	trans	-81.2	-17	-179	73.3	0	0	0	0	113.2	L149 Q150 A151 Q157 A184 Y187 V188 F295	L149-T153 WeakPolarHBondContact O-CG2 3.45Å; L149-T153 PolarHBondContact O-N 3.04Å; Q150-T153 PolarHBondContact O-N 3.43Å; Q150-T153 PolarHBondContact O-OG1 3.48Å; A151-T153 VanDerWaalsContact C-N 3.28Å; A151-T153 PolarHBondContact O-N 3.02Å; T153-Q157 PolarHBondContact O-NE2 3.24Å; T153-A184 HydrophobicContact CG2-CB 3.96Å; T153-Y187 HydrophobicContact CG2-CD1 3.52Å; T153-Y187 HydrophobicContact CG2-CE1 4.17Å; T153-Y187 HydrophobicContact CG2-CG 4.41Å; T153-V188 HydrophobicContact CG2-CG2 4.14Å; T153-F295 HydrophobicContact CG2-CD1 4.29Å; T153-F295 HydrophobicContact CG2-CE1 4.34Å; T153-F295 WeakPolarHBondContact OG1-CE1 3.5Å
154	T	82	Confident	85.9	Confident	68 Å²	68	50.4 Å²	50.4	42%	0.417	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-78.9	-174.4	51.8	0	0	0	0	111.9	Q150 A151 L152	Q150-T154 PolarHBondContact O-N 3.14Å; Q150-T154 PolarHBondContact O-OG1 3.38Å; A151-T154 PolarHBondContact O-N 3.18Å; L152-T154 VanDerWaalsContact C-N 3.34Å
155	N	80.2	Confident	86.7	Confident	145 Å²	145	52.3 Å²	52.3	78%	0.775	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-16.7	-167.4	-60.7	-21.8	0	0	0	113.8	A151	A151-N155 PolarHBondContact O-N 2.86Å
156	Q	83.9	Confident	87.3	Confident	46 Å²	46	51.6 Å²	51.6	22%	0.215	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	28.4	-176.8	-64.2	-170.8	-21.4	0	0	112.8	A151 L152 P158 L159 L160	A151-Q156 WeakPolarHBondContact O-CB 3.39Å; A151-Q156 PolarHBondContact O-N 3.28Å; L152-Q156 HydrophobicContact CD2-CB 4.16Å; Q156-P158 VanDerWaalsContact C-N 3.29Å; Q156-L159 HydrophobicContact CB-CB 4.25Å; Q156-L159 WeakPolarHBondContact O-CA 3.39Å; Q156-L159 VanDerWaalsContact O-CB 3.27Å; Q156-L159 WeakPolarHBondContact O-CB 3.18Å; Q156-L159 PolarHBondContact O-N 2.92Å; Q156-L160 PolarHBondContact O-N 3.33Å
157	Q	84.1	Confident	88.1	Confident	61 Å²	61	49.5 Å²	49.5	29%	0.285	26%	0.26	S	S	.	.	H	α-helix	trans	-51.9	-38.2	175	-69.4	-176.3	-5.1	0	0	114.3	L152 T153 L159 L160 V161	L152-Q157 WeakPolarHBondContact O-CA 3.34Å; L152-Q157 PolarHBondContact O-N 2.88Å; T153-Q157 PolarHBondContact O-NE2 3.24Å; Q157-L159 PolarHBondContact O-N 3.4Å; Q157-L160 WeakPolarHBondContact O-CB 3.19Å; Q157-L160 PolarHBondContact O-N 3.06Å; Q157-L160 VanDerWaalsContact O-N 3.1Å; Q157-V161 PolarHBondContact O-N 3.12Å; Q157-V161 VanDerWaalsContact O-N 3.07Å
158	P	89	Confident	88.6	Confident	98 Å²	98	48.3 Å²	48.3	64%	0.636	25%	0.248	S	C	*	.	H	α-helix	trans	-60.7	-32.2	175.2	-25.1	35.4	0	0	0	113.5	Q156 L162	Q156-P158 VanDerWaalsContact C-N 3.29Å; P158-L162 WeakPolarHBondContact O-CG 3.28Å; P158-L162 PolarHBondContact O-N 2.68Å; P158-L162 VanDerWaalsContact O-N 3.13Å
159	L	90.5	Very high	89.1	Confident	9 Å²	9	48 Å²	48	5%	0.047	25%	0.245	C	C	.	.	H	α-helix	trans	-69.2	-40.4	175.7	-173.8	61.6	0	0	0	110.6	F104 L129 A133 L152 Q156 Q157 V161 L162 L163	F104-L159 HydrophobicContact CE2-CD1 4.35Å; F104-L159 HydrophobicContact CE2-CD2 4.35Å; L129-L159 HydrophobicContact CB-CD1 4.33Å; L129-L159 HydrophobicContact CB-CD2 4.16Å; L129-L159 HydrophobicContact CD1-CD2 4.32Å; A133-L159 HydrophobicContact CB-CD1 3.64Å; L152-L159 HydrophobicContact CD2-CB 4.14Å; L152-L159 HydrophobicContact CD2-CD2 3.92Å; L152-L159 HydrophobicContact CD2-CG 4.12Å; Q156-L159 HydrophobicContact CB-CB 4.25Å; Q156-L159 WeakPolarHBondContact O-CA 3.39Å; Q156-L159 VanDerWaalsContact O-CB 3.27Å; Q156-L159 WeakPolarHBondContact O-CB 3.18Å; Q156-L159 PolarHBondContact O-N 2.92Å; Q157-L159 PolarHBondContact O-N 3.4Å; L159-V161 PolarHBondContact O-N 3.11Å; L159-L162 WeakPolarHBondContact O-CB 3.45Å; L159-L162 PolarHBondContact O-N 3.01Å; L159-L162 VanDerWaalsContact O-N 3.16Å; L159-L163 WeakPolarHBondContact O-CG 3.46Å; L159-L163 PolarHBondContact O-N 3.29Å
160	L	90.8	Very high	89.5	Confident	4 Å²	4	48 Å²	48	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-43.6	175.6	-176	57.3	0	0	0	111.9	Q156 Q157 L162 L163 E164 Y187 V188 R191 L192	Q156-L160 PolarHBondContact O-N 3.33Å; Q157-L160 WeakPolarHBondContact O-CB 3.19Å; Q157-L160 PolarHBondContact O-N 3.06Å; Q157-L160 VanDerWaalsContact O-N 3.1Å; L160-L162 VanDerWaalsContact C-N 3.28Å; L160-L162 PolarHBondContact O-N 2.86Å; L160-L163 WeakPolarHBondContact O-CB 3.33Å; L160-L163 PolarHBondContact O-N 3.09Å; L160-L163 VanDerWaalsContact O-N 3.09Å; L160-E164 WeakPolarHBondContact O-CG 3.23Å; L160-E164 PolarHBondContact O-N 3Å; L160-Y187 HydrophobicContact CD2-CD1 4.37Å; L160-Y187 HydrophobicContact CD2-CE1 3.77Å; L160-V188 HydrophobicContact CD1-CG1 4.18Å; L160-R191 HydrophobicContact CD1-CB 4.3Å; L160-R191 HydrophobicContact CD2-CB 4.2Å; L160-R191 HydrophobicContact CD2-CG 4.03Å; L160-R191 HydrophobicContact CG-CB 4.37Å; L160-L192 HydrophobicContact CD1-CD2 4.29Å; L160-L192 HydrophobicContact CD1-CG 4.49Å
161	V	90.4	Very high	89.8	Confident	60 Å²	60	45.1 Å²	45.1	36%	0.364	23%	0.232	S	C	.	.	H	α-helix	trans	-62.8	-34.1	175	175.2	0	0	0	0	112.1	Q157 L159 K165	Q157-V161 PolarHBondContact O-N 3.12Å; Q157-V161 VanDerWaalsContact O-N 3.07Å; L159-V161 PolarHBondContact O-N 3.11Å; V161-K165 WeakPolarHBondContact O-CG 3.39Å
162	L	92.6	Very high	90	Very high	39 Å²	39	43.9 Å²	43.9	20%	0.204	22%	0.221	C	C	.	.	H	α-helix	trans	-66.8	-42.5	172.7	-75.2	172.4	0	0	0	111.4	A133 K134 P158 L159 L160 K165 H166	A133-L162 HydrophobicContact CB-CB 4.38Å; K134-L162 HydrophobicContact CG-CD2 4.37Å; P158-L162 WeakPolarHBondContact O-CG 3.28Å; P158-L162 PolarHBondContact O-N 2.68Å; P158-L162 VanDerWaalsContact O-N 3.13Å; L159-L162 WeakPolarHBondContact O-CB 3.45Å; L159-L162 PolarHBondContact O-N 3.01Å; L159-L162 VanDerWaalsContact O-N 3.16Å; L160-L162 VanDerWaalsContact C-N 3.28Å; L160-L162 PolarHBondContact O-N 2.86Å; L162-K165 PolarHBondContact O-N 2.88Å; L162-H166 PolarHBondContact O-N 3.2Å; L162-H166 PolarHBondContact O-ND1 3.36Å
163	L	94.1	Very high	89.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.6	-44.3	178	-66.1	171	0	0	0	111.3	F104 A133 I136 F139 L152 L159 L160 K165 H166 I167 L192	F104-L163 HydrophobicContact CE1-CD2 4.45Å; F104-L163 HydrophobicContact CZ-CD1 4.29Å; F104-L163 HydrophobicContact CZ-CD2 3.98Å; A133-L163 HydrophobicContact CB-CD2 3.92Å; I136-L163 HydrophobicContact CD1-CD2 4.08Å; F139-L163 HydrophobicContact CD2-CD1 4.16Å; F139-L163 HydrophobicContact CD2-CD2 4.35Å; F139-L163 HydrophobicContact CE2-CD1 3.93Å; L152-L163 HydrophobicContact CD1-CD1 4.48Å; L159-L163 WeakPolarHBondContact O-CG 3.46Å; L159-L163 PolarHBondContact O-N 3.29Å; L160-L163 WeakPolarHBondContact O-CB 3.33Å; L160-L163 PolarHBondContact O-N 3.09Å; L160-L163 VanDerWaalsContact O-N 3.09Å; L163-K165 PolarHBondContact O-N 3.14Å; L163-K165 VanDerWaalsContact O-N 3.08Å; L163-H166 PolarHBondContact O-N 3.3Å; L163-H166 VanDerWaalsContact O-N 3.09Å; L163-I167 HydrophobicContact CB-CG1 3.93Å; L163-I167 HydrophobicContact CD2-CD1 4.03Å; L163-I167 HydrophobicContact CD2-CG1 3.92Å; L163-I167 VanDerWaalsContact O-CB 3.27Å; L163-I167 WeakPolarHBondContact O-CB 3.31Å; L163-I167 WeakPolarHBondContact O-CG1 3.5Å; L163-I167 PolarHBondContact O-N 3.43Å; L163-L192 HydrophobicContact CB-CD2 3.71Å
164	E	92.8	Very high	89.3	Confident	17 Å²	17	50.3 Å²	50.3	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-52.4	-34.8	176.2	-71.9	166.7	-162.5	0	0	113.3	L160 R191 L192 G196 I197	L160-E164 WeakPolarHBondContact O-CG 3.23Å; L160-E164 PolarHBondContact O-N 3Å; E164-R191 HydrophobicContact CG-CB 4.46Å; E164-R191 IonicContact OE1-CZ 2.83Å; E164-R191 IonicContact OE1-NE 3Å; E164-R191 PolarHBondContact OE1-NE 3.24Å; E164-R191 IonicContact OE1-NH2 3Å; E164-R191 PolarHBondContact OE1-NH2 3.27Å; E164-R191 IonicContact OE2-CZ 3.17Å; E164-R191 IonicContact OE2-NE 2.71Å; E164-R191 IonicContact OE2-NH2 2.85Å; E164-R191 PolarHBondContact OE2-NH2 2.9Å; E164-L192 HydrophobicContact CG-CD2 4.36Å; E164-G196 CarbonylContact O-C 3.6Å; E164-G196 WeakPolarHBondContact O-CA 3.46Å; E164-I197 PolarHBondContact O-N 2.84Å
165	K	93.1	Very high	88.5	Confident	133 Å²	133	47.4 Å²	47.4	58%	0.578	24%	0.237	S	C	*	.	H	α-helix	trans	-83.4	-19.3	-177.2	-68.7	177.9	-177.6	-178.1	0	114.7	V161 L162 L163 I197	V161-K165 WeakPolarHBondContact O-CG 3.39Å; L162-K165 PolarHBondContact O-N 2.88Å; L163-K165 PolarHBondContact O-N 3.14Å; L163-K165 VanDerWaalsContact O-N 3.08Å; K165-I197 WeakPolarHBondContact O-CD1 3.34Å
166	H	93.2	Very high	87.8	Confident	53 Å²	53	43.5 Å²	43.5	25%	0.245	22%	0.215	C	C	.	.	H	α-helix	trans	-121.8	-26.2	-170.6	-61.5	85.6	0	0	0	113.6	K134 H137 L162 L163 R168	K134-H166 PolarHBondContact O-CD2 3.39Å; H137-H166 WeakPolarHBondContact CA-O 3.45Å; H137-H166 PolarHBondContact ND1-O 3.33Å; H137-H166 VanDerWaalsContact ND1-O 3.1Å; L162-H166 PolarHBondContact O-N 3.2Å; L162-H166 PolarHBondContact O-ND1 3.36Å; L163-H166 PolarHBondContact O-N 3.3Å; L163-H166 VanDerWaalsContact O-N 3.09Å; H166-R168 PolarHBondContact O-N 3.22Å
167	I	95.6	Very high	86.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.211	C	C	.	.			trans	-76.1	117.9	-178.8	-61.2	-55.9	0	0	0	110.1	I136 H137 F139 L163 S169 V170 I197 T198	I136-I167 HydrophobicContact CD1-CD1 3.98Å; I136-I167 HydrophobicContact CG1-CD1 3.81Å; H137-I167 WeakPolarHBondContact O-CA 3.25Å; F139-I167 HydrophobicContact CB-CD1 3.96Å; F139-I167 HydrophobicContact CB-CG1 4.1Å; F139-I167 HydrophobicContact CB-CG2 3.79Å; L163-I167 HydrophobicContact CB-CG1 3.93Å; L163-I167 HydrophobicContact CD2-CD1 4.03Å; L163-I167 HydrophobicContact CD2-CG1 3.92Å; L163-I167 VanDerWaalsContact O-CB 3.27Å; L163-I167 WeakPolarHBondContact O-CB 3.31Å; L163-I167 WeakPolarHBondContact O-CG1 3.5Å; L163-I167 PolarHBondContact O-N 3.43Å; I167-S169 VanDerWaalsContact CG2-O 3.31Å; I167-S169 WeakPolarHBondContact CG2-O 3.15Å; I167-V170 HydrophobicContact CG2-CG2 3.87Å; I167-I197 WeakPolarHBondContact O-CG1 3.39Å; I167-T198 PolarHBondContact O-N 3.41Å; I167-T198 PolarHBondContact O-OG1 2.92Å
168	R	95.1	Very high	85.4	Confident	143 Å²	143	45.5 Å²	45.5	54%	0.54	23%	0.234	S	C	.	.			trans	-102.6	-23.8	175.3	-64.4	-177.8	179.8	-179.8	-0.5	112.4	H137 H166 I197 T199 N200	H137-R168 PolarHBondContact O-N 2.89Å; H166-R168 PolarHBondContact O-N 3.22Å; R168-I197 HydrophobicContact CG-CD1 3.94Å; R168-I197 HydrophobicContact CG-CG1 4.4Å; R168-T199 PolarHBondContact O-N 3.1Å; R168-N200 WeakPolarHBondContact O-CB 3.36Å; R168-N200 PolarHBondContact O-N 2.95Å
169	S	95.9	Very high	83.9	Confident	11 Å²	11	45.5 Å²	45.5	8%	0.077	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134.8	178.9	-170.7	0	0	0	0	112.9	H137 H138 F139 I167 N200	H137-S169 PolarHBondContact O-N 3.41Å; H138-S169 CarbonylContact C-O 3.6Å; H138-S169 VanDerWaalsContact CA-O 3.31Å; H138-S169 WeakPolarHBondContact CA-O 3.29Å; H138-S169 VanDerWaalsContact CD2-CB 3.45Å; H138-S169 WeakPolarHBondContact CD2-CB 3.37Å; F139-S169 PolarHBondContact N-O 3.26Å; I167-S169 VanDerWaalsContact CG2-O 3.31Å; I167-S169 WeakPolarHBondContact CG2-O 3.15Å; S169-N200 CarbonylContact C-O 3.57Å; S169-N200 WeakPolarHBondContact CA-O 3.31Å; S169-N200 PolarHBondContact OG-O 3.46Å
170	V	95.7	Very high	82.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.5	174.5	174.8	0	0	0	0	109.1	F139 I167 V172 L189 L192 L193 T198 N200 V202	F139-V170 HydrophobicContact CB-CG2 4.48Å; F139-V170 WeakPolarHBondContact O-CA 3.45Å; I167-V170 HydrophobicContact CG2-CG2 3.87Å; V170-V172 HydrophobicContact CG1-CG2 3.92Å; V170-L189 HydrophobicContact CG1-CD2 3.76Å; V170-L192 HydrophobicContact CG2-CB 4.17Å; V170-L192 HydrophobicContact CG2-CD1 4.2Å; V170-L193 HydrophobicContact CB-CD2 4.31Å; V170-L193 HydrophobicContact CG2-CD2 4.3Å; V170-T198 HydrophobicContact CB-CG2 4.3Å; V170-T198 HydrophobicContact CG2-CG2 3.75Å; V170-N200 PolarHBondContact N-O 3.2Å; V170-V202 PolarHBondContact O-N 3.25Å
171	H	93.9	Very high	81	Confident	32 Å²	32	62.4 Å²	62.4	15%	0.148	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.6	173.5	-178.3	-159.6	0	0	0	110.4	F139 L141 S173 V202 S204 R317	F139-H171 PolarHBondContact O-N 3.02Å; L141-H171 WeakPolarHBondContact CB-O 3.38Å; L141-H171 PolarHBondContact N-O 3.14Å; H171-S173 PolarHBondContact CE1-OG 3.44Å; H171-S173 VanDerWaalsContact CE1-OG 3.32Å; H171-S173 PolarHBondContact NE2-OG 2.83Å; H171-V202 CarbonylContact C-O 3.5Å; H171-V202 WeakPolarHBondContact CA-O 3.17Å; H171-V202 HydrophobicContact CB-CB 4.18Å; H171-V202 PolarHBondContact CD2-O 3.39Å; H171-S204 PolarHBondContact NE2-OG 2.72Å; H171-R317 PolarHBondContact CE1-NH1 2.77Å; H171-R317 VanDerWaalsContact CE1-NH1 3.32Å
172	V	90.4	Very high	80.2	Confident	0 Å²	0	60 Å²	60	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	105.5	178.6	-172.7	0	0	0	0	109.4	L141 V170 H174 L175 L189 L201 V202 V203 S204 I205 L214	L141-V172 HydrophobicContact CD2-CG1 4.04Å; L141-V172 HydrophobicContact CD2-CG2 4.28Å; V170-V172 HydrophobicContact CG1-CG2 3.92Å; V172-H174 WeakPolarHBondContact CG1-O 3.24Å; V172-L175 HydrophobicContact CG1-CD1 3.43Å; V172-L175 VanDerWaalsContact CG1-CD1 3.43Å; V172-L189 HydrophobicContact CG2-CD2 4.02Å; V172-L201 HydrophobicContact CG2-CD1 4.19Å; V172-V202 PolarHBondContact N-O 2.99Å; V172-V203 CarbonylContact O-C 3.45Å; V172-V203 WeakPolarHBondContact O-CA 3.49Å; V172-S204 PolarHBondContact O-N 3.25Å; V172-I205 HydrophobicContact CB-CD1 4.24Å; V172-I205 HydrophobicContact CG1-CD1 3.58Å; V172-I205 HydrophobicContact CG1-CG1 4.13Å; V172-L214 HydrophobicContact CB-CD1 4.44Å; V172-L214 HydrophobicContact CG1-CD1 4.38Å; V172-L214 HydrophobicContact CG2-CD1 4.48Å; V172-L214 HydrophobicContact CG2-CD2 4.38Å
173	S	79.9	Confident	79.6	Confident	32 Å²	32	60.6 Å²	60.6	22%	0.224	28%	0.282	C	S	.	.	S	Bend	trans	-85.4	-33.7	177.8	-66.9	0	0	0	0	113.3	H171 S204	H171-S173 PolarHBondContact CE1-OG 3.44Å; H171-S173 VanDerWaalsContact CE1-OG 3.32Å; H171-S173 PolarHBondContact NE2-OG 2.83Å; S173-S204 CarbonylContact O-C 3.5Å; S173-S204 VanDerWaalsContact O-C 3.26Å
174	H	71.8	Confident	79.1	Confident	106 Å²	106	60.7 Å²	60.7	49%	0.491	28%	0.283	S	S	.	.			trans	-140.3	144.8	174.3	-57.9	-67.5	0	0	0	106.3	P143 V172	P143-H174 HydrophobicContact CG-CB 4.33Å; P143-H174 WeakPolarHBondContact CG-O 3.24Å; V172-H174 WeakPolarHBondContact CG1-O 3.24Å
175	L	65.9	Low	78.8	Confident	7 Å²	7	60.3 Å²	60.3	4%	0.037	28%	0.282	C	S	.	.			trans	-115	137.9	152.5	-127.1	72.1	0	0	0	104	L141 V172 L177 V185 L186 L189 I205 D210 W213	L141-L175 HydrophobicContact CD2-CD1 3.81Å; V172-L175 HydrophobicContact CG1-CD1 3.43Å; V172-L175 VanDerWaalsContact CG1-CD1 3.43Å; L175-L177 HydrophobicContact CD2-CD1 4.37Å; L175-L177 HydrophobicContact CD2-CD2 4.12Å; L175-L177 HydrophobicContact CD2-CG 4.02Å; L175-V185 HydrophobicContact CD1-CG1 4.44Å; L175-L186 HydrophobicContact CD2-CD2 3.7Å; L175-L189 HydrophobicContact CD1-CD1 3.44Å; L175-L189 VanDerWaalsContact CD1-CD1 3.44Å; L175-L189 HydrophobicContact CD2-CD1 4.31Å; L175-L189 HydrophobicContact CG-CD1 4.46Å; L175-I205 HydrophobicContact CB-CD1 4.29Å; L175-D210 HydrophobicContact CB-CB 3.68Å; L175-D210 HydrophobicContact CD2-CB 4.39Å; L175-W213 HydrophobicContact CD2-CE3 4.33Å
176	L	64.3	Low	78.5	Confident	63 Å²	63	54 Å²	54	33%	0.33	26%	0.255	S	S	.	.			trans	-115.4	62.3	177.9	-66.4	157.6	0	0	0	106.4	T178 L179	L176-T178 PolarHBondContact O-N 2.92Å; L176-L179 HydrophobicContact CB-CB 3.89Å; L176-L179 HydrophobicContact CB-CD1 3.32Å; L176-L179 HydrophobicContact CB-CG 4.07Å; L176-L179 HydrophobicContact CD1-CD1 3.22Å; L176-L179 HydrophobicContact CD2-CD1 3.95Å; L176-L179 HydrophobicContact CG-CD1 3.61Å; L176-L179 WeakPolarHBondContact O-CB 3.23Å; L176-L179 PolarHBondContact O-N 2.88Å
177	L	61	Low	78.2	Confident	24 Å²	24	52.2 Å²	52.2	13%	0.126	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-20.2	174.4	-73.6	-176.6	0	0	0	111.9	L175 P182 L186 L209 D210 W213 L286	L175-L177 HydrophobicContact CD2-CD1 4.37Å; L175-L177 HydrophobicContact CD2-CD2 4.12Å; L175-L177 HydrophobicContact CD2-CG 4.02Å; L177-P182 HydrophobicContact CD2-CB 4.19Å; L177-L186 HydrophobicContact CD2-CD1 3.63Å; L177-L186 HydrophobicContact CD2-CD2 3.59Å; L177-L186 HydrophobicContact CD2-CG 4.02Å; L177-L209 HydrophobicContact CB-CD2 4.48Å; L177-L209 HydrophobicContact CD1-CD2 4.16Å; L177-L209 HydrophobicContact CD1-CG 4.01Å; L177-D210 WeakPolarHBondContact CB-OD1 3.45Å; L177-D210 WeakPolarHBondContact CD1-OD1 3.25Å; L177-D210 WeakPolarHBondContact CG-OD1 3.19Å; L177-W213 HydrophobicContact CD1-CB 4.34Å; L177-L286 HydrophobicContact CD2-CD2 3.68Å
178	T	56.9	Low	77.9	Confident	125 Å²	125	52.2 Å²	52.2	77%	0.767	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.3	175.8	55.7	0	0	0	0	114.7	L176	L176-T178 PolarHBondContact O-N 2.92Å
179	L	58.5	Low	77.7	Confident	98 Å²	98	45.4 Å²	45.4	51%	0.513	22%	0.22	S	C	.	.	S	Bend	trans	-87.4	151.6	-179.8	-101.4	151.8	0	0	0	112.5	L176 K181 P182	L176-L179 HydrophobicContact CB-CB 3.89Å; L176-L179 HydrophobicContact CB-CD1 3.32Å; L176-L179 HydrophobicContact CB-CG 4.07Å; L176-L179 HydrophobicContact CD1-CD1 3.22Å; L176-L179 HydrophobicContact CD2-CD1 3.95Å; L176-L179 HydrophobicContact CG-CD1 3.61Å; L176-L179 WeakPolarHBondContact O-CB 3.23Å; L176-L179 PolarHBondContact O-N 2.88Å; L179-K181 PolarHBondContact O-N 3.49Å; L179-P182 WeakPolarHBondContact O-CD 3.48Å
180	R	55.2	Low	77.4	Confident	235 Å²	235	45 Å²	45	89%	0.887	22%	0.217	S	C	*	.	S	Bend	trans	-61.4	107.3	174.4	-68.9	-178.2	179.7	-179.4	-1.8	108.9
181	K	64.9	Low	77.2	Confident	132 Å²	132	47.3 Å²	47.3	57%	0.574	23%	0.225	S	C	*	.			trans	89.2	68	176.2	-49.9	171.7	-176.4	180	0	116.6	H146 L179 Q183	H146-K181 PolarHBondContact CD2-O 3.09Å; H146-K181 PolarHBondContact NE2-O 2.89Å; L179-K181 PolarHBondContact O-N 3.49Å; K181-Q183 VanDerWaalsContact C-N 3.31Å; K181-Q183 PolarHBondContact O-N 3.22Å
182	P	73.1	Confident	77.1	Confident	10 Å²	10	45.8 Å²	45.8	7%	0.065	22%	0.218	C	C	.	.			trans	-80.2	-10.1	173.1	33.5	-34.7	0	0	0	113.7	L177 L179 A184 V185 L186	L177-P182 HydrophobicContact CD2-CB 4.19Å; L179-P182 WeakPolarHBondContact O-CD 3.48Å; P182-A184 PolarHBondContact O-N 3.36Å; P182-V185 WeakPolarHBondContact O-CB 3.34Å; P182-V185 PolarHBondContact O-N 2.82Å; P182-V185 VanDerWaalsContact O-N 3.09Å; P182-L186 HydrophobicContact CB-CD1 4.05Å; P182-L186 HydrophobicContact CB-CG 4.27Å; P182-L186 HydrophobicContact CG-CD1 4.28Å; P182-L186 WeakPolarHBondContact O-CG 3.32Å; P182-L186 PolarHBondContact O-N 3.39Å
183	Q	79.9	Confident	77.1	Confident	51 Å²	51	45.9 Å²	45.9	24%	0.238	22%	0.219	C	C	.	.	H	α-helix	trans	-58.2	-42.6	-165.2	-68.1	169.4	-27.4	0	0	114.3	K181 L186 Y187 F284 L291 F295	K181-Q183 VanDerWaalsContact C-N 3.31Å; K181-Q183 PolarHBondContact O-N 3.22Å; Q183-L186 PolarHBondContact O-N 3.39Å; Q183-Y187 VanDerWaalsContact O-CB 3.27Å; Q183-Y187 WeakPolarHBondContact O-CB 3.47Å; Q183-Y187 PolarHBondContact O-N 2.96Å; Q183-F284 HydrophobicContact CG-CD1 4.47Å; Q183-L291 HydrophobicContact CB-CD2 4.03Å; Q183-L291 HydrophobicContact CG-CD2 4.13Å; Q183-F295 HydrophobicContact CB-CE2 3.98Å; Q183-F295 HydrophobicContact CB-CZ 4.03Å
184	A	83.5	Confident	77.6	Confident	3 Å²	3	44.6 Å²	44.6	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-65.8	-40.4	178.7	0	0	0	0	0	111.7	Q150 T153 P182 Y187 V188	Q150-A184 HydrophobicContact CB-CB 4.34Å; T153-A184 HydrophobicContact CG2-CB 3.96Å; P182-A184 PolarHBondContact O-N 3.36Å; A184-Y187 PolarHBondContact O-N 3.45Å; A184-V188 VanDerWaalsContact O-CG2 3.32Å; A184-V188 WeakPolarHBondContact O-CG2 3.48Å; A184-V188 PolarHBondContact O-N 3.04Å
185	V	86.9	Confident	78.4	Confident	9 Å²	9	42.4 Å²	42.4	6%	0.055	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-48.5	177.4	-174.3	0	0	0	0	110.4	L141 P143 L149 L175 P182 V188 L189	L141-V185 HydrophobicContact CD1-CG1 4.15Å; L141-V185 HydrophobicContact CD2-CG1 3.7Å; L141-V185 HydrophobicContact CG-CG1 4.3Å; P143-V185 HydrophobicContact CB-CG1 4.32Å; P143-V185 HydrophobicContact CB-CG2 4.48Å; L149-V185 HydrophobicContact CD1-CB 4.4Å; L149-V185 HydrophobicContact CD1-CG1 4.32Å; L149-V185 HydrophobicContact CD1-CG2 3.77Å; L175-V185 HydrophobicContact CD1-CG1 4.44Å; P182-V185 WeakPolarHBondContact O-CB 3.34Å; P182-V185 PolarHBondContact O-N 2.82Å; P182-V185 VanDerWaalsContact O-N 3.09Å; V185-V188 PolarHBondContact O-N 2.83Å; V185-L189 PolarHBondContact O-N 2.8Å
186	L	86.7	Confident	79.4	Confident	1 Å²	1	43 Å²	43	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-66.8	-37.4	180	-62.7	176.7	0	0	0	112.2	L175 L177 P182 Q183 L189 H190 W213 L286 L291	L175-L186 HydrophobicContact CD2-CD2 3.7Å; L177-L186 HydrophobicContact CD2-CD1 3.63Å; L177-L186 HydrophobicContact CD2-CD2 3.59Å; L177-L186 HydrophobicContact CD2-CG 4.02Å; P182-L186 HydrophobicContact CB-CD1 4.05Å; P182-L186 HydrophobicContact CB-CG 4.27Å; P182-L186 HydrophobicContact CG-CD1 4.28Å; P182-L186 WeakPolarHBondContact O-CG 3.32Å; P182-L186 PolarHBondContact O-N 3.39Å; Q183-L186 PolarHBondContact O-N 3.39Å; L186-L189 PolarHBondContact O-N 2.87Å; L186-H190 VanDerWaalsContact O-CB 3.26Å; L186-H190 WeakPolarHBondContact O-CB 2.8Å; L186-H190 PolarHBondContact O-N 3.02Å; L186-W213 HydrophobicContact CB-CH2 4.23Å; L186-W213 HydrophobicContact CB-CZ2 4.05Å; L186-W213 HydrophobicContact CD2-CD2 4.03Å; L186-W213 HydrophobicContact CD2-CE3 4.05Å; L186-W213 HydrophobicContact CD2-CH2 3.9Å; L186-W213 HydrophobicContact CD2-CZ2 3.87Å; L186-W213 HydrophobicContact CD2-CZ3 4Å; L186-W213 HydrophobicContact CG-CZ2 4.44Å; L186-L286 HydrophobicContact CD1-CD2 3.63Å; L186-L291 HydrophobicContact CB-CD1 3.44Å; L186-L291 VanDerWaalsContact CB-CD1 3.44Å; L186-L291 HydrophobicContact CB-CD2 4.49Å; L186-L291 HydrophobicContact CD1-CD1 4.36Å
187	Y	87.3	Confident	80.7	Confident	15 Å²	15	43.8 Å²	43.8	6%	0.059	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-48	174.4	176.3	-100.4	0	0	0	111.3	T153 L160 Q183 A184 L189 H190 R191 L291 F295	T153-Y187 HydrophobicContact CG2-CD1 3.52Å; T153-Y187 HydrophobicContact CG2-CE1 4.17Å; T153-Y187 HydrophobicContact CG2-CG 4.41Å; L160-Y187 HydrophobicContact CD2-CD1 4.37Å; L160-Y187 HydrophobicContact CD2-CE1 3.77Å; Q183-Y187 VanDerWaalsContact O-CB 3.27Å; Q183-Y187 WeakPolarHBondContact O-CB 3.47Å; Q183-Y187 PolarHBondContact O-N 2.96Å; A184-Y187 PolarHBondContact O-N 3.45Å; Y187-L189 VanDerWaalsContact C-N 3.31Å; Y187-L189 PolarHBondContact O-N 2.88Å; Y187-H190 PolarHBondContact O-N 3.2Å; Y187-R191 HydrophobicContact CD1-CG 4.19Å; Y187-R191 HydrophobicContact CD2-CG 4.29Å; Y187-R191 HydrophobicContact CE1-CG 3.79Å; Y187-R191 HydrophobicContact CE2-CG 3.87Å; Y187-R191 HydrophobicContact CG-CG 4.45Å; Y187-R191 WeakPolarHBondContact O-CB 3.45Å; Y187-R191 VanDerWaalsContact O-CG 3.3Å; Y187-R191 WeakPolarHBondContact O-CG 3.12Å; Y187-R191 PolarHBondContact O-N 2.72Å; Y187-L291 HydrophobicContact CD2-CB 4.43Å; Y187-F295 HydrophobicContact CD1-CB 4.12Å; Y187-F295 HydrophobicContact CD1-CD2 4.17Å; Y187-F295 HydrophobicContact CD1-CG 4.19Å; Y187-F295 HydrophobicContact CD2-CB 3.89Å; Y187-F295 AromaticContact CD2-CD2 3.75Å; Y187-F295 HydrophobicContact CD2-CD2 3.75Å; Y187-F295 HydrophobicContact CD2-CG 4.19Å; Y187-F295 HydrophobicContact CE1-CB 3.94Å; Y187-F295 HydrophobicContact CE1-CG 4.48Å; Y187-F295 HydrophobicContact CE2-CB 3.72Å; Y187-F295 HydrophobicContact CE2-CD2 4.46Å; Y187-F295 HydrophobicContact CG-CB 4.07Å; Y187-F295 AromaticContact CG-CD2 3.56Å; Y187-F295 HydrophobicContact CG-CD2 3.56Å; Y187-F295 HydrophobicContact CG-CE2 4.29Å; Y187-F295 HydrophobicContact CG-CG 4.01Å
188	V	89.7	Confident	82.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.8	-44.3	176.3	171.1	0	0	0	0	110.9	F139 L149 L152 T153 L160 A184 V185 R191 L192	F139-V188 HydrophobicContact CE1-CG1 4.42Å; F139-V188 HydrophobicContact CZ-CG1 4.5Å; L149-V188 HydrophobicContact CD2-CG1 4.4Å; L152-V188 HydrophobicContact CB-CG2 4.05Å; L152-V188 HydrophobicContact CD1-CG1 4.15Å; L152-V188 HydrophobicContact CD1-CG2 4.03Å; T153-V188 HydrophobicContact CG2-CG2 4.14Å; L160-V188 HydrophobicContact CD1-CG1 4.18Å; A184-V188 VanDerWaalsContact O-CG2 3.32Å; A184-V188 WeakPolarHBondContact O-CG2 3.48Å; A184-V188 PolarHBondContact O-N 3.04Å; V185-V188 PolarHBondContact O-N 2.83Å; V188-R191 PolarHBondContact O-N 2.74Å; V188-L192 HydrophobicContact CG1-CD1 4.02Å; V188-L192 HydrophobicContact CG1-CG 4.44Å; V188-L192 WeakPolarHBondContact O-CG 2.93Å; V188-L192 PolarHBondContact O-N 2.88Å
189	L	90.8	Very high	84.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.5	-46	176.2	-81	177.9	0	0	0	112.8	L141 V170 V172 L175 V185 L186 Y187 R191 L192 L193 W213 L214	L141-L189 HydrophobicContact CD2-CD1 3.73Å; L141-L189 HydrophobicContact CD2-CD2 4Å; L141-L189 HydrophobicContact CD2-CG 3.9Å; V170-L189 HydrophobicContact CG1-CD2 3.76Å; V172-L189 HydrophobicContact CG2-CD2 4.02Å; L175-L189 HydrophobicContact CD1-CD1 3.44Å; L175-L189 VanDerWaalsContact CD1-CD1 3.44Å; L175-L189 HydrophobicContact CD2-CD1 4.31Å; L175-L189 HydrophobicContact CG-CD1 4.46Å; V185-L189 PolarHBondContact O-N 2.8Å; L186-L189 PolarHBondContact O-N 2.87Å; Y187-L189 VanDerWaalsContact C-N 3.31Å; Y187-L189 PolarHBondContact O-N 2.88Å; L189-R191 VanDerWaalsContact C-N 3.32Å; L189-R191 PolarHBondContact O-N 2.86Å; L189-L192 PolarHBondContact O-N 3.45Å; L189-L193 HydrophobicContact CB-CD1 4.41Å; L189-L193 HydrophobicContact CD2-CD1 4.3Å; L189-L193 VanDerWaalsContact O-CB 3.23Å; L189-L193 WeakPolarHBondContact O-CB 3.5Å; L189-L193 VanDerWaalsContact O-CG 3.25Å; L189-L193 WeakPolarHBondContact O-CG 3.45Å; L189-L193 PolarHBondContact O-N 3.04Å; L189-W213 HydrophobicContact CB-CH2 4.02Å; L189-W213 HydrophobicContact CB-CZ3 3.94Å; L189-W213 HydrophobicContact CD1-CZ3 4.01Å; L189-L214 HydrophobicContact CD1-CD2 4.04Å
190	H	89.6	Confident	85.9	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-58.1	-46.4	176.1	174.1	48.7	0	0	0	110.9	L186 Y187 L192 D194 H195 C292	L186-H190 VanDerWaalsContact O-CB 3.26Å; L186-H190 WeakPolarHBondContact O-CB 2.8Å; L186-H190 PolarHBondContact O-N 3.02Å; Y187-H190 PolarHBondContact O-N 3.2Å; H190-L192 PolarHBondContact O-N 3.27Å; H190-D194 IonicContact CE1-OD2 3.69Å; H190-D194 IonicContact CG-OD2 3.97Å; H190-D194 WeakPolarHBondContact ND1-CB 3.38Å; H190-D194 IonicContact ND1-OD2 2.75Å; H190-D194 PolarHBondContact ND1-OD2 3.44Å; H190-D194 WeakPolarHBondContact O-CA 3.39Å; H190-D194 WeakPolarHBondContact O-CB 3.21Å; H190-D194 PolarHBondContact O-N 3.33Å; H190-H195 AromaticContact CE1-NE2 3.78Å; H190-H195 AromaticContact NE2-CD2 3.81Å; H190-H195 AromaticContact NE2-NE2 3.37Å; H190-H195 PolarHBondContact NE2-NE2 2.64Å; H190-C292 PolarHBondContact CD2-SG 3.22Å; H190-C292 PolarHBondContact NE2-SG 2.81Å
191	R	90.2	Very high	87.8	Confident	49 Å²	49	25.7 Å²	25.7	19%	0.185	13%	0.129	C	C	.	.	I	π-helix	trans	-59	-47.9	176.5	-69.7	-59.3	-59	171.6	-1.3	112.3	L160 E164 Y187 V188 L189 H195 G196	L160-R191 HydrophobicContact CD1-CB 4.3Å; L160-R191 HydrophobicContact CD2-CB 4.2Å; L160-R191 HydrophobicContact CD2-CG 4.03Å; L160-R191 HydrophobicContact CG-CB 4.37Å; E164-R191 HydrophobicContact CG-CB 4.46Å; E164-R191 IonicContact OE1-CZ 2.83Å; E164-R191 IonicContact OE1-NE 3Å; E164-R191 PolarHBondContact OE1-NE 3.24Å; E164-R191 IonicContact OE1-NH2 3Å; E164-R191 PolarHBondContact OE1-NH2 3.27Å; E164-R191 IonicContact OE2-CZ 3.17Å; E164-R191 IonicContact OE2-NE 2.71Å; E164-R191 IonicContact OE2-NH2 2.85Å; E164-R191 PolarHBondContact OE2-NH2 2.9Å; Y187-R191 HydrophobicContact CD1-CG 4.19Å; Y187-R191 HydrophobicContact CD2-CG 4.29Å; Y187-R191 HydrophobicContact CE1-CG 3.79Å; Y187-R191 HydrophobicContact CE2-CG 3.87Å; Y187-R191 HydrophobicContact CG-CG 4.45Å; Y187-R191 WeakPolarHBondContact O-CB 3.45Å; Y187-R191 VanDerWaalsContact O-CG 3.3Å; Y187-R191 WeakPolarHBondContact O-CG 3.12Å; Y187-R191 PolarHBondContact O-N 2.72Å; V188-R191 PolarHBondContact O-N 2.74Å; L189-R191 VanDerWaalsContact C-N 3.32Å; L189-R191 PolarHBondContact O-N 2.86Å; R191-H195 PolarHBondContact NH1-CD2 2.67Å; R191-H195 VanDerWaalsContact NH1-CD2 3.31Å; R191-H195 PolarHBondContact NH1-ND1 3.2Å; R191-H195 CarbonylContact O-C 3.59Å; R191-H195 WeakPolarHBondContact O-CB 3.44Å; R191-H195 PolarHBondContact O-N 3.48Å; R191-G196 PolarHBondContact O-N 2.85Å
192	L	92.5	Very high	89.3	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.106	C	C	.	.	I	π-helix	trans	-70	-41.2	-178.7	-65.9	178.4	0	0	0	113.3	F139 L160 L163 E164 V170 V188 L189 H190 T198	F139-L192 HydrophobicContact CB-CD1 4.38Å; F139-L192 HydrophobicContact CD1-CD1 3.63Å; F139-L192 HydrophobicContact CE1-CD1 3.99Å; F139-L192 HydrophobicContact CG-CD1 3.94Å; L160-L192 HydrophobicContact CD1-CD2 4.29Å; L160-L192 HydrophobicContact CD1-CG 4.49Å; L163-L192 HydrophobicContact CB-CD2 3.71Å; E164-L192 HydrophobicContact CG-CD2 4.36Å; V170-L192 HydrophobicContact CG2-CB 4.17Å; V170-L192 HydrophobicContact CG2-CD1 4.2Å; V188-L192 HydrophobicContact CG1-CD1 4.02Å; V188-L192 HydrophobicContact CG1-CG 4.44Å; V188-L192 WeakPolarHBondContact O-CG 2.93Å; V188-L192 PolarHBondContact O-N 2.88Å; L189-L192 PolarHBondContact O-N 3.45Å; H190-L192 PolarHBondContact O-N 3.27Å; L192-T198 VanDerWaalsContact O-CB 3.23Å; L192-T198 WeakPolarHBondContact O-CB 3.09Å; L192-T198 PolarHBondContact O-OG1 3.49Å
193	L	91.7	Very high	90.2	Very high	3 Å²	3	19.6 Å²	19.6	2%	0.016	10%	0.103	C	C	.	.	I	π-helix	trans	-82.8	-36	-174.5	-65.1	173.8	0	0	0	112.7	V170 L189 T198 L201 L214 G309	V170-L193 HydrophobicContact CB-CD2 4.31Å; V170-L193 HydrophobicContact CG2-CD2 4.3Å; L189-L193 HydrophobicContact CB-CD1 4.41Å; L189-L193 HydrophobicContact CD2-CD1 4.3Å; L189-L193 VanDerWaalsContact O-CB 3.23Å; L189-L193 WeakPolarHBondContact O-CB 3.5Å; L189-L193 VanDerWaalsContact O-CG 3.25Å; L189-L193 WeakPolarHBondContact O-CG 3.45Å; L189-L193 PolarHBondContact O-N 3.04Å; L193-T198 HydrophobicContact CD2-CG2 3.78Å; L193-L201 HydrophobicContact CD2-CD1 4.32Å; L193-L214 HydrophobicContact CD1-CD2 3.98Å; L193-G309 VanDerWaalsContact O-CA 3.25Å; L193-G309 WeakPolarHBondContact O-CA 3.43Å
194	D	89.1	Confident	90.6	Very high	5 Å²	5	18 Å²	18	3%	0.027	10%	0.097	C	C	.	.	I	π-helix	trans	-107.2	-29	-169	-62	-55.3	0	0	0	114.7	H190 R218 T307 G309	H190-D194 IonicContact CE1-OD2 3.69Å; H190-D194 IonicContact CG-OD2 3.97Å; H190-D194 WeakPolarHBondContact ND1-CB 3.38Å; H190-D194 IonicContact ND1-OD2 2.75Å; H190-D194 PolarHBondContact ND1-OD2 3.44Å; H190-D194 WeakPolarHBondContact O-CA 3.39Å; H190-D194 WeakPolarHBondContact O-CB 3.21Å; H190-D194 PolarHBondContact O-N 3.33Å; D194-R218 VanDerWaalsContact OD1-CD 3.31Å; D194-R218 WeakPolarHBondContact OD1-CD 3.29Å; D194-R218 VanDerWaalsContact OD1-CG 3.29Å; D194-R218 WeakPolarHBondContact OD1-CG 3.27Å; D194-R218 IonicContact OD1-CZ 3.98Å; D194-R218 IonicContact OD1-NE 3.79Å; D194-R218 PolarHBondContact OD1-NE 3.34Å; D194-R218 IonicContact OD1-NH2 2.67Å; D194-R218 IonicContact OD2-CZ 2.66Å; D194-R218 VanDerWaalsContact OD2-CZ 3.22Å; D194-R218 IonicContact OD2-NE 2.68Å; D194-R218 PolarHBondContact OD2-NE 2.86Å; D194-R218 IonicContact OD2-NH2 3.57Å; D194-R218 PolarHBondContact OD2-NH2 2.88Å; D194-T307 WeakPolarHBondContact CB-O 3.47Å; D194-T307 PolarHBondContact O-OG1 3.43Å; D194-G309 PolarHBondContact OD1-N 3.28Å
195	H	88.3	Confident	90.4	Very high	60 Å²	60	18 Å²	18	28%	0.278	10%	0.097	S	C	.	.	I	π-helix	trans	-107.8	-18.7	177.1	-65.5	-81.5	0	0	0	113.3	H190 R191	H190-H195 AromaticContact CE1-NE2 3.78Å; H190-H195 AromaticContact NE2-CD2 3.81Å; H190-H195 AromaticContact NE2-NE2 3.37Å; H190-H195 PolarHBondContact NE2-NE2 2.64Å; R191-H195 PolarHBondContact NH1-CD2 2.67Å; R191-H195 VanDerWaalsContact NH1-CD2 3.31Å; R191-H195 PolarHBondContact NH1-ND1 3.2Å; R191-H195 CarbonylContact O-C 3.59Å; R191-H195 WeakPolarHBondContact O-CB 3.44Å; R191-H195 PolarHBondContact O-N 3.48Å
196	G	88.1	Confident	89.8	Confident	19 Å²	19	22.6 Å²	22.6	20%	0.196	12%	0.121	C	C	.	.	S	Bend	trans	-86.4	-175.5	177.9	0	0	0	0	0	113.5	E164 R191 T198	E164-G196 CarbonylContact O-C 3.6Å; E164-G196 WeakPolarHBondContact O-CA 3.46Å; R191-G196 PolarHBondContact O-N 2.85Å; G196-T198 VanDerWaalsContact C-N 3.29Å
197	I	91.8	Very high	89.5	Confident	80 Å²	80	24.5 Å²	24.5	41%	0.41	14%	0.135	S	C	.	.			trans	-91	15.6	176.7	66.9	164.7	0	0	0	113.2	E164 K165 I167 R168 T199	E164-I197 PolarHBondContact O-N 2.84Å; K165-I197 WeakPolarHBondContact O-CD1 3.34Å; I167-I197 WeakPolarHBondContact O-CG1 3.39Å; R168-I197 HydrophobicContact CG-CD1 3.94Å; R168-I197 HydrophobicContact CG-CG1 4.4Å; I197-T199 PolarHBondContact O-N 3.07Å
198	T	94.3	Very high	89.2	Confident	5 Å²	5	25.3 Å²	25.3	3%	0.031	14%	0.144	C	C	.	.			trans	-69.3	126	-174.5	-54.8	0	0	0	0	110.7	I167 V170 L192 L193 G196	I167-T198 PolarHBondContact O-N 3.41Å; I167-T198 PolarHBondContact O-OG1 2.92Å; V170-T198 HydrophobicContact CB-CG2 4.3Å; V170-T198 HydrophobicContact CG2-CG2 3.75Å; L192-T198 VanDerWaalsContact O-CB 3.23Å; L192-T198 WeakPolarHBondContact O-CB 3.09Å; L192-T198 PolarHBondContact O-OG1 3.49Å; L193-T198 HydrophobicContact CD2-CG2 3.78Å; G196-T198 VanDerWaalsContact C-N 3.29Å
199	T	94.7	Very high	88.8	Confident	49 Å²	49	27.5 Å²	27.5	30%	0.301	16%	0.156	S	C	.	.			trans	-120.2	-16	175.5	58.3	0	0	0	0	112.9	R168 I197 I311 T312 H313	R168-T199 PolarHBondContact O-N 3.1Å; I197-T199 PolarHBondContact O-N 3.07Å; T199-I311 CarbonylContact O-C 3.54Å; T199-I311 WeakPolarHBondContact O-CA 3.46Å; T199-T312 WeakPolarHBondContact CB-OG1 3.36Å; T199-T312 PolarHBondContact O-N 3.38Å; T199-H313 PolarHBondContact O-N 3.35Å; T199-H313 VanDerWaalsContact O-N 3.12Å
200	N	96.4	Very high	88.4	Confident	46 Å²	46	27.9 Å²	27.9	25%	0.246	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	120.1	-172.4	-58.2	3.3	0	0	0	110.1	R168 S169 V170 H313	R168-N200 WeakPolarHBondContact O-CB 3.36Å; R168-N200 PolarHBondContact O-N 2.95Å; S169-N200 CarbonylContact C-O 3.57Å; S169-N200 WeakPolarHBondContact CA-O 3.31Å; S169-N200 PolarHBondContact OG-O 3.46Å; V170-N200 PolarHBondContact N-O 3.2Å; N200-H313 CarbonylContact C-O 3.42Å; N200-H313 WeakPolarHBondContact CA-O 3.27Å; N200-H313 HydrophobicContact CB-CB 4.16Å; N200-H313 WeakPolarHBondContact OD1-CB 3.42Å; N200-H313 PolarHBondContact OD1-ND1 2.74Å
201	L	95.5	Very high	88.3	Confident	1 Å²	1	28 Å²	28	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.4	177.6	-178.9	65.2	0	0	0	109.9	V172 L193 V203 L214 L215 I311 H313 L314 E315	V172-L201 HydrophobicContact CG2-CD1 4.19Å; L193-L201 HydrophobicContact CD2-CD1 4.32Å; L201-V203 HydrophobicContact CD1-CG2 4.24Å; L201-V203 HydrophobicContact CD2-CG2 3.81Å; L201-V203 HydrophobicContact CG-CG2 3.66Å; L201-L214 HydrophobicContact CD1-CD2 4.48Å; L201-L214 HydrophobicContact CD2-CB 3.98Å; L201-L214 HydrophobicContact CD2-CD1 4.48Å; L201-L215 HydrophobicContact CD2-CD2 4.29Å; L201-I311 HydrophobicContact CB-CD1 4.24Å; L201-I311 HydrophobicContact CB-CG1 4.48Å; L201-I311 HydrophobicContact CB-CG2 4.04Å; L201-I311 HydrophobicContact CD2-CD1 3.76Å; L201-H313 PolarHBondContact N-O 3.32Å; L201-L314 HydrophobicContact CB-CD1 4.14Å; L201-L314 HydrophobicContact CD2-CD1 3.96Å; L201-L314 HydrophobicContact CG-CD1 4.15Å; L201-L314 WeakPolarHBondContact O-CA 3.21Å; L201-E315 PolarHBondContact O-N 3.14Å
202	V	94.9	Very high	88	Confident	13 Å²	13	25.7 Å²	25.7	8%	0.079	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	125.6	171.7	-175.2	0	0	0	0	108.4	V170 H171 V172 E315 R317	V170-V202 PolarHBondContact O-N 3.25Å; H171-V202 CarbonylContact C-O 3.5Å; H171-V202 WeakPolarHBondContact CA-O 3.17Å; H171-V202 HydrophobicContact CB-CB 4.18Å; H171-V202 PolarHBondContact CD2-O 3.39Å; V172-V202 PolarHBondContact N-O 2.99Å; V202-E315 CarbonylContact C-O 3.26Å; V202-E315 WeakPolarHBondContact CA-O 3.39Å; V202-E315 HydrophobicContact CB-CB 4.47Å; V202-E315 HydrophobicContact CG1-CB 4.24Å; V202-E315 HydrophobicContact CG1-CG 4.27Å; V202-E315 HydrophobicContact CG2-CB 4.2Å; V202-R317 HydrophobicContact CG1-CG 4.21Å
203	V	92.5	Very high	87.7	Confident	1 Å²	1	26 Å²	26	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.8	-174.2	-171.4	0	0	0	0	109.2	V172 L201 I205 L211 L214 L314 E315 I316 R317	V172-V203 CarbonylContact O-C 3.45Å; V172-V203 WeakPolarHBondContact O-CA 3.49Å; L201-V203 HydrophobicContact CD1-CG2 4.24Å; L201-V203 HydrophobicContact CD2-CG2 3.81Å; L201-V203 HydrophobicContact CG-CG2 3.66Å; V203-I205 HydrophobicContact CG1-CB 3.76Å; V203-I205 HydrophobicContact CG1-CD1 3.47Å; V203-I205 VanDerWaalsContact CG1-CD1 3.47Å; V203-I205 HydrophobicContact CG1-CG1 3.52Å; V203-L211 HydrophobicContact CG1-CD1 4.23Å; V203-L211 HydrophobicContact CG2-CD1 4.33Å; V203-L214 HydrophobicContact CG1-CD1 4.34Å; V203-L214 HydrophobicContact CG2-CD1 4.19Å; V203-L314 HydrophobicContact CG2-CD1 4.15Å; V203-E315 PolarHBondContact N-O 3.41Å; V203-I316 CarbonylContact O-C 3.57Å; V203-I316 WeakPolarHBondContact O-CA 3.47Å; V203-R317 PolarHBondContact O-N 3.47Å
204	S	88.6	Confident	87.6	Confident	17 Å²	17	25.9 Å²	25.9	12%	0.119	15%	0.151	C	C	.	.			trans	-130.3	40.1	172	-38.9	0	0	0	0	111.1	H171 V172 S173 T318	H171-S204 PolarHBondContact NE2-OG 2.72Å; V172-S204 PolarHBondContact O-N 3.25Å; S173-S204 CarbonylContact O-C 3.5Å; S173-S204 VanDerWaalsContact O-C 3.26Å; S204-T318 WeakPolarHBondContact CA-OG1 3.27Å; S204-T318 PolarHBondContact O-OG1 3.31Å
205	I	78.3	Confident	87.5	Confident	5 Å²	5	25.8 Å²	25.8	3%	0.026	15%	0.15	C	C	.	.			trans	-102.1	136.9	-171.4	-54	167.3	0	0	0	109.9	V172 L175 V203 D210 L214 T318	V172-I205 HydrophobicContact CB-CD1 4.24Å; V172-I205 HydrophobicContact CG1-CD1 3.58Å; V172-I205 HydrophobicContact CG1-CG1 4.13Å; L175-I205 HydrophobicContact CB-CD1 4.29Å; V203-I205 HydrophobicContact CG1-CB 3.76Å; V203-I205 HydrophobicContact CG1-CD1 3.47Å; V203-I205 VanDerWaalsContact CG1-CD1 3.47Å; V203-I205 HydrophobicContact CG1-CG1 3.52Å; I205-D210 HydrophobicContact CD1-CB 3.99Å; I205-D210 HydrophobicContact CG2-CB 3.64Å; I205-D210 WeakPolarHBondContact CG2-OD2 3.39Å; I205-L214 HydrophobicContact CD1-CD1 3.53Å; I205-T318 PolarHBondContact N-OG1 3.08Å; I205-T318 PolarHBondContact O-OG1 3.31Å
206	D	73.9	Confident	87.3	Confident	104 Å²	104	25.2 Å²	25.2	56%	0.556	15%	0.147	S	C	*	.			trans	-93.7	-0.4	177.6	-61.1	-33.5	0	0	0	112.8	T318	D206-T318 WeakPolarHBondContact OD1-CB 3.46Å; D206-T318 PolarHBondContact OD1-OG1 3.48Å
207	S	81	Confident	86.8	Confident	42 Å²	42	25.4 Å²	25.4	29%	0.294	15%	0.149	S	C	.	.			trans	-99.9	124.6	-177.2	169.5	0	0	0	0	112.7	L209 D210 L211	S207-L209 VanDerWaalsContact C-N 3.31Å; S207-L209 PolarHBondContact O-N 3.49Å; S207-L209 PolarHBondContact OG-N 3.05Å; S207-D210 WeakPolarHBondContact CB-OD2 3.45Å; S207-D210 PolarHBondContact O-N 2.99Å; S207-D210 PolarHBondContact OG-N 3.29Å; S207-D210 PolarHBondContact OG-OD2 3.44Å; S207-L211 PolarHBondContact O-N 2.9Å
208	A	81.3	Confident	86.4	Confident	31 Å²	31	21.6 Å²	21.6	26%	0.256	13%	0.13	S	C	.	.	H	α-helix	trans	-60.2	-38.9	174.9	0	0	0	0	0	112.8	A212 D322 V326	A208-A212 VanDerWaalsContact O-CB 3.26Å; A208-A212 WeakPolarHBondContact O-CB 3.41Å; A208-A212 PolarHBondContact O-N 2.79Å; A208-D322 HydrophobicContact CB-CB 4.18Å; A208-V326 HydrophobicContact CB-CG2 3.82Å; A208-V326 WeakPolarHBondContact O-CG2 3.49Å
209	L	80.5	Confident	85.4	Confident	47 Å²	47	22 Å²	22	25%	0.246	13%	0.134	C	C	.	.	H	α-helix	trans	-65.4	-43.3	-177	-178.2	67.7	0	0	0	111.3	L177 S207 A212 W213 L230 F231	L177-L209 HydrophobicContact CB-CD2 4.48Å; L177-L209 HydrophobicContact CD1-CD2 4.16Å; L177-L209 HydrophobicContact CD1-CG 4.01Å; S207-L209 VanDerWaalsContact C-N 3.31Å; S207-L209 PolarHBondContact O-N 3.49Å; S207-L209 PolarHBondContact OG-N 3.05Å; L209-A212 PolarHBondContact O-N 3Å; L209-W213 PolarHBondContact O-N 3.06Å; L209-L230 HydrophobicContact CD1-CB 3.94Å; L209-F231 HydrophobicContact CD1-CD1 4.07Å; L209-F231 HydrophobicContact CD1-CE1 3.96Å
210	D	84	Confident	84.1	Confident	7 Å²	7	20 Å²	20	4%	0.037	12%	0.123	C	C	.	.	H	α-helix	trans	-66.5	-44.8	-179.2	-61.6	-24.6	0	0	0	111	L175 L177 I205 S207 A212 W213 L214	L175-D210 HydrophobicContact CB-CB 3.68Å; L175-D210 HydrophobicContact CD2-CB 4.39Å; L177-D210 WeakPolarHBondContact CB-OD1 3.45Å; L177-D210 WeakPolarHBondContact CD1-OD1 3.25Å; L177-D210 WeakPolarHBondContact CG-OD1 3.19Å; I205-D210 HydrophobicContact CD1-CB 3.99Å; I205-D210 HydrophobicContact CG2-CB 3.64Å; I205-D210 WeakPolarHBondContact CG2-OD2 3.39Å; S207-D210 WeakPolarHBondContact CB-OD2 3.45Å; S207-D210 PolarHBondContact O-N 2.99Å; S207-D210 PolarHBondContact OG-N 3.29Å; S207-D210 PolarHBondContact OG-OD2 3.44Å; D210-A212 VanDerWaalsContact C-N 3.33Å; D210-W213 PolarHBondContact O-N 3.43Å; D210-L214 WeakPolarHBondContact O-CG 3.39Å; D210-L214 PolarHBondContact O-N 2.88Å
211	L	87.1	Confident	82.3	Confident	3 Å²	3	25.4 Å²	25.4	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-43.5	175.7	-179.4	62.6	0	0	0	110.8	V203 S207 W213 L214 L215 I316 V326	V203-L211 HydrophobicContact CG1-CD1 4.23Å; V203-L211 HydrophobicContact CG2-CD1 4.33Å; S207-L211 PolarHBondContact O-N 2.9Å; L211-W213 VanDerWaalsContact C-N 3.31Å; L211-W213 PolarHBondContact O-N 3Å; L211-L214 PolarHBondContact O-N 3.31Å; L211-L215 HydrophobicContact CD1-CD1 4Å; L211-L215 HydrophobicContact CD1-CG 4.13Å; L211-L215 HydrophobicContact CG-CD1 4.12Å; L211-L215 WeakPolarHBondContact O-CG 3.31Å; L211-L215 PolarHBondContact O-N 3.42Å; L211-I316 HydrophobicContact CD1-CD1 4.13Å; L211-I316 HydrophobicContact CD2-CD1 4.01Å; L211-V326 HydrophobicContact CB-CG1 4.39Å; L211-V326 HydrophobicContact CD2-CB 4.03Å; L211-V326 HydrophobicContact CD2-CG1 4.05Å; L211-V326 HydrophobicContact CG-CB 4.42Å; L211-V326 HydrophobicContact CG-CG1 3.92Å
212	A	84.3	Confident	80.3	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-59.3	-42.5	176.4	0	0	0	0	0	111.8	A208 L209 D210 L215 H216 L227 F231 V326	A208-A212 VanDerWaalsContact O-CB 3.26Å; A208-A212 WeakPolarHBondContact O-CB 3.41Å; A208-A212 PolarHBondContact O-N 2.79Å; L209-A212 PolarHBondContact O-N 3Å; D210-A212 VanDerWaalsContact C-N 3.33Å; A212-L215 PolarHBondContact O-N 2.68Å; A212-H216 WeakPolarHBondContact O-CB 3.21Å; A212-H216 PolarHBondContact O-N 2.54Å; A212-L227 HydrophobicContact CB-CD1 4.39Å; A212-L227 HydrophobicContact CB-CD2 3.53Å; A212-L227 HydrophobicContact CB-CG 4.48Å; A212-F231 HydrophobicContact CB-CZ 3.96Å; A212-V326 HydrophobicContact CB-CG1 4.04Å
213	W	85.6	Confident	78.3	Confident	7 Å²	7	33.9 Å²	33.9	3%	0.027	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-43.6	178.3	-173.5	88.4	0	0	0	111.6	L175 L177 L186 L189 L209 D210 L211 L215 H216 R218 F231 L286 P288 L291	L175-W213 HydrophobicContact CD2-CE3 4.33Å; L177-W213 HydrophobicContact CD1-CB 4.34Å; L186-W213 HydrophobicContact CB-CH2 4.23Å; L186-W213 HydrophobicContact CB-CZ2 4.05Å; L186-W213 HydrophobicContact CD2-CD2 4.03Å; L186-W213 HydrophobicContact CD2-CE3 4.05Å; L186-W213 HydrophobicContact CD2-CH2 3.9Å; L186-W213 HydrophobicContact CD2-CZ2 3.87Å; L186-W213 HydrophobicContact CD2-CZ3 4Å; L186-W213 HydrophobicContact CG-CZ2 4.44Å; L189-W213 HydrophobicContact CB-CH2 4.02Å; L189-W213 HydrophobicContact CB-CZ3 3.94Å; L189-W213 HydrophobicContact CD1-CZ3 4.01Å; L209-W213 PolarHBondContact O-N 3.06Å; D210-W213 PolarHBondContact O-N 3.43Å; L211-W213 VanDerWaalsContact C-N 3.31Å; L211-W213 PolarHBondContact O-N 3Å; W213-L215 VanDerWaalsContact C-N 3.31Å; W213-L215 PolarHBondContact O-N 3.37Å; W213-H216 WeakPolarHBondContact O-CB 3.46Å; W213-H216 PolarHBondContact O-N 3.21Å; W213-R218 PolarHBondContact O-NH1 3.37Å; W213-F231 HydrophobicContact CB-CE1 3.73Å; W213-F231 HydrophobicContact CB-CZ 4.09Å; W213-F231 AromaticContact CD1-CE1 3.95Å; W213-F231 HydrophobicContact CG-CE1 4.27Å; W213-L286 PolarHBondContact NE1-O 3.46Å; W213-P288 HydrophobicContact CZ2-CG 4.49Å; W213-L291 HydrophobicContact CZ2-CD1 4.48Å
214	L	88.7	Confident	76.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-39.3	179.5	-74	169.1	0	0	0	112	V172 L189 L193 L201 V203 I205 D210 L211 R218	V172-L214 HydrophobicContact CB-CD1 4.44Å; V172-L214 HydrophobicContact CG1-CD1 4.38Å; V172-L214 HydrophobicContact CG2-CD1 4.48Å; V172-L214 HydrophobicContact CG2-CD2 4.38Å; L189-L214 HydrophobicContact CD1-CD2 4.04Å; L193-L214 HydrophobicContact CD1-CD2 3.98Å; L201-L214 HydrophobicContact CD1-CD2 4.48Å; L201-L214 HydrophobicContact CD2-CB 3.98Å; L201-L214 HydrophobicContact CD2-CD1 4.48Å; V203-L214 HydrophobicContact CG1-CD1 4.34Å; V203-L214 HydrophobicContact CG2-CD1 4.19Å; I205-L214 HydrophobicContact CD1-CD1 3.53Å; D210-L214 WeakPolarHBondContact O-CG 3.39Å; D210-L214 PolarHBondContact O-N 2.88Å; L211-L214 PolarHBondContact O-N 3.31Å; L214-R218 WeakPolarHBondContact O-CD 3.26Å; L214-R218 PolarHBondContact O-NH1 2.96Å
215	L	87.9	Confident	74.9	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-84.2	-16	-179	-59.6	-176.2	0	0	0	113.7	L201 L211 A212 W213 G217 R218 I311 L314 V326 L327 F334	L201-L215 HydrophobicContact CD2-CD2 4.29Å; L211-L215 HydrophobicContact CD1-CD1 4Å; L211-L215 HydrophobicContact CD1-CG 4.13Å; L211-L215 HydrophobicContact CG-CD1 4.12Å; L211-L215 WeakPolarHBondContact O-CG 3.31Å; L211-L215 PolarHBondContact O-N 3.42Å; A212-L215 PolarHBondContact O-N 2.68Å; W213-L215 VanDerWaalsContact C-N 3.31Å; W213-L215 PolarHBondContact O-N 3.37Å; L215-G217 PolarHBondContact O-N 3.28Å; L215-G217 VanDerWaalsContact O-N 3.15Å; L215-R218 PolarHBondContact O-N 3.41Å; L215-I311 HydrophobicContact CD2-CD1 4.34Å; L215-L314 HydrophobicContact CD1-CD2 4.36Å; L215-L314 HydrophobicContact CD2-CD1 4.17Å; L215-L314 HydrophobicContact CD2-CD2 3.92Å; L215-V326 HydrophobicContact CD1-CG1 4.35Å; L215-L327 HydrophobicContact CD1-CD2 4.03Å; L215-F334 HydrophobicContact CD2-CE1 4.11Å
216	H	83.3	Confident	73.8	Confident	47 Å²	47	42.5 Å²	42.5	22%	0.218	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-61.9	115.5	-175.5	-174	82.2	0	0	0	112.1	A212 W213 R218 F231	A212-H216 WeakPolarHBondContact O-CB 3.21Å; A212-H216 PolarHBondContact O-N 2.54Å; W213-H216 WeakPolarHBondContact O-CB 3.46Å; W213-H216 PolarHBondContact O-N 3.21Å; H216-R218 PolarHBondContact O-N 3.27Å; H216-R218 VanDerWaalsContact O-N 3.13Å; H216-F231 HydrophobicContact CB-CE2 4.44Å; H216-F231 AromaticContact ND1-CE2 3.95Å
217	G	78.2	Confident	72.8	Confident	23 Å²	23	38.2 Å²	38.2	24%	0.237	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	-15	177.6	0	0	0	0	0	115.3	L215 G219 F308	L215-G217 PolarHBondContact O-N 3.28Å; L215-G217 VanDerWaalsContact O-N 3.15Å; G217-G219 VanDerWaalsContact C-N 3.27Å; G217-G219 PolarHBondContact O-N 3.34Å; G217-F308 WeakPolarHBondContact O-CB 3.42Å
218	R	83.8	Confident	71.6	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	14.7	-173.4	-54.4	-168.4	-177.2	78.9	6.7	114.8	D194 W213 L214 L215 H216 G309 I311	D194-R218 VanDerWaalsContact OD1-CD 3.31Å; D194-R218 WeakPolarHBondContact OD1-CD 3.29Å; D194-R218 VanDerWaalsContact OD1-CG 3.29Å; D194-R218 WeakPolarHBondContact OD1-CG 3.27Å; D194-R218 IonicContact OD1-CZ 3.98Å; D194-R218 IonicContact OD1-NE 3.79Å; D194-R218 PolarHBondContact OD1-NE 3.34Å; D194-R218 IonicContact OD1-NH2 2.67Å; D194-R218 IonicContact OD2-CZ 2.66Å; D194-R218 VanDerWaalsContact OD2-CZ 3.22Å; D194-R218 IonicContact OD2-NE 2.68Å; D194-R218 PolarHBondContact OD2-NE 2.86Å; D194-R218 IonicContact OD2-NH2 3.57Å; D194-R218 PolarHBondContact OD2-NH2 2.88Å; W213-R218 PolarHBondContact O-NH1 3.37Å; L214-R218 WeakPolarHBondContact O-CD 3.26Å; L214-R218 PolarHBondContact O-NH1 2.96Å; L215-R218 PolarHBondContact O-N 3.41Å; H216-R218 PolarHBondContact O-N 3.27Å; H216-R218 VanDerWaalsContact O-N 3.13Å; R218-G309 CarbonylContact C-O 3.48Å; R218-G309 VanDerWaalsContact CA-O 3.27Å; R218-G309 WeakPolarHBondContact CA-O 3.46Å; R218-I311 HydrophobicContact CB-CD1 3.66Å; R218-I311 HydrophobicContact CB-CG1 4.02Å; R218-I311 PolarHBondContact O-N 2.9Å
219	G	72.1	Confident	70.4	Confident	12 Å²	12	45.4 Å²	45.4	12%	0.124	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	178.7	-63.7	-167.6	0	0	0	0	0	113.4	G217	G217-G219 VanDerWaalsContact C-N 3.27Å; G217-G219 PolarHBondContact O-N 3.34Å
220	S	67.4	Low	68.9	Low	8 Å²	8	47.6 Å²	47.6	6%	0.056	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-75.2	120.1	173.6	177.3	0	0	0	0	110	Y222 S330 T333	S220-Y222 PolarHBondContact O-N 3.13Å; S220-Y222 PolarHBondContact OG-N 3.35Å; S220-Y222 PolarHBondContact OG-O 3.15Å; S220-S330 WeakPolarHBondContact CB-O 3.1Å; S220-S330 PolarHBondContact OG-O 3.46Å; S220-T333 WeakPolarHBondContact CA-OG1 3.43Å; S220-T333 PolarHBondContact OG-OG1 3.49Å
221	Q	59.3	Low	67.2	Low	160 Å²	160	49.3 Å²	49.3	75%	0.748	25%	0.245	S	C	*	.	S	Bend	trans	-71.8	-20.6	170.7	-65.4	-175.4	4.8	0	0	111.7	V223 T333	Q221-V223 PolarHBondContact O-N 3.33Å; Q221-T333 PolarHBondContact N-OG1 2.82Å
222	Y	52.9	Low	65	Low	134 Å²	134	53.2 Å²	53.2	53%	0.525	27%	0.272	S	S	.	.			trans	-82.9	114.8	177.4	-169	-107.1	0	0	0	110.9	S220 N224 T333	S220-Y222 PolarHBondContact O-N 3.13Å; S220-Y222 PolarHBondContact OG-N 3.35Å; S220-Y222 PolarHBondContact OG-O 3.15Å; Y222-N224 HydrophobicContact CD1-CB 4.02Å; Y222-N224 VanDerWaalsContact CE1-CA 3.48Å; Y222-N224 HydrophobicContact CE1-CB 3.84Å; Y222-N224 PolarHBondContact O-N 3.05Å; Y222-T333 WeakPolarHBondContact CB-OG1 3.46Å; Y222-T333 PolarHBondContact N-OG1 2.79Å
223	V	53.3	Low	62.7	Low	58 Å²	58	60.1 Å²	60.1	35%	0.352	30%	0.302	S	S	.	.			trans	-80.2	97.9	162.8	174.6	0	0	0	0	107.1	Q221 T225 K228	Q221-V223 PolarHBondContact O-N 3.33Å; V223-T225 PolarHBondContact O-N 3.04Å; V223-T225 VanDerWaalsContact O-N 3.15Å; V223-K228 HydrophobicContact CG1-CB 4.13Å; V223-K228 HydrophobicContact CG1-CD 4.06Å; V223-K228 HydrophobicContact CG1-CG 4.35Å
224	N	55.2	Low	60.3	Low	15 Å²	15	64.7 Å²	64.7	8%	0.08	33%	0.333	C	S	.	.			trans	-60	122.4	172.3	-174.1	-27	0	0	0	109.3	Y222 E226 L227 K228 F329	Y222-N224 HydrophobicContact CD1-CB 4.02Å; Y222-N224 VanDerWaalsContact CE1-CA 3.48Å; Y222-N224 HydrophobicContact CE1-CB 3.84Å; Y222-N224 PolarHBondContact O-N 3.05Å; N224-E226 PolarHBondContact O-N 2.71Å; N224-E226 WeakPolarHBondContact OD1-CA 3.39Å; N224-E226 WeakPolarHBondContact OD1-CB 3.48Å; N224-E226 WeakPolarHBondContact OD1-CG 3.36Å; N224-E226 PolarHBondContact OD1-N 2.81Å; N224-L227 HydrophobicContact CB-CB 4.14Å; N224-L227 HydrophobicContact CB-CD1 3.99Å; N224-L227 HydrophobicContact CB-CG 3.95Å; N224-L227 WeakPolarHBondContact O-CA 3.34Å; N224-L227 WeakPolarHBondContact O-CB 3.37Å; N224-L227 PolarHBondContact O-N 2.73Å; N224-K228 PolarHBondContact O-N 3.44Å; N224-F329 HydrophobicContact CB-CB 4.46Å; N224-F329 WeakPolarHBondContact ND2-CD1 3.37Å; N224-F329 WeakPolarHBondContact ND2-CG 3.5Å
225	T	55.6	Low	57.6	Low	84 Å²	84	72.7 Å²	72.7	52%	0.515	37%	0.37	S	S	.	.	H	α-helix	trans	-58.1	-31.2	177.9	-41.4	0	0	0	0	111.8	V223 K228 K229	V223-T225 PolarHBondContact O-N 3.04Å; V223-T225 VanDerWaalsContact O-N 3.15Å; T225-K228 PolarHBondContact O-N 3.32Å; T225-K229 VanDerWaalsContact O-CG 3.25Å; T225-K229 WeakPolarHBondContact O-CG 3.39Å; T225-K229 PolarHBondContact O-N 2.99Å
226	E	54.6	Low	54.9	Low	104 Å²	104	78.7 Å²	78.7	49%	0.486	41%	0.406	S	S	.	.	H	α-helix	trans	-65.3	-42.6	171.7	-62.2	-90.1	109.5	0	0	112	N224 K228 K229 L230	N224-E226 PolarHBondContact O-N 2.71Å; N224-E226 WeakPolarHBondContact OD1-CA 3.39Å; N224-E226 WeakPolarHBondContact OD1-CB 3.48Å; N224-E226 WeakPolarHBondContact OD1-CG 3.36Å; N224-E226 PolarHBondContact OD1-N 2.81Å; E226-K228 VanDerWaalsContact C-N 3.34Å; E226-K229 WeakPolarHBondContact O-CB 3.44Å; E226-K229 PolarHBondContact O-N 3.42Å; E226-K229 IonicContact OE1-NZ 2.9Å; E226-K229 PolarHBondContact OE1-NZ 3.07Å; E226-L230 WeakPolarHBondContact O-CG 3.49Å; E226-L230 PolarHBondContact O-N 3.27Å
227	L	52.8	Low	52.5	Low	14 Å²	14	84.2 Å²	84.2	7%	0.073	44%	0.437	C	S	.	.	H	α-helix	trans	-66.7	-38.9	173.1	-68.8	178.3	0	0	0	110.7	A212 N224 K229 L230 F231 F329	A212-L227 HydrophobicContact CB-CD1 4.39Å; A212-L227 HydrophobicContact CB-CD2 3.53Å; A212-L227 HydrophobicContact CB-CG 4.48Å; N224-L227 HydrophobicContact CB-CB 4.14Å; N224-L227 HydrophobicContact CB-CD1 3.99Å; N224-L227 HydrophobicContact CB-CG 3.95Å; N224-L227 WeakPolarHBondContact O-CA 3.34Å; N224-L227 WeakPolarHBondContact O-CB 3.37Å; N224-L227 PolarHBondContact O-N 2.73Å; L227-K229 VanDerWaalsContact C-N 3.32Å; L227-K229 PolarHBondContact O-N 3.41Å; L227-L230 HydrophobicContact CD2-CD1 3.93Å; L227-L230 WeakPolarHBondContact O-CB 3.26Å; L227-L230 PolarHBondContact O-N 3.04Å; L227-L230 VanDerWaalsContact O-N 3.12Å; L227-F231 HydrophobicContact CB-CE2 4.17Å; L227-F231 WeakPolarHBondContact O-CD2 3.41Å; L227-F231 WeakPolarHBondContact O-CE2 3.25Å; L227-F231 WeakPolarHBondContact O-CG 3.48Å; L227-F231 PolarHBondContact O-N 3.4Å; L227-F329 HydrophobicContact CD1-CB 4.34Å
228	K	56.6	Low	50.2	Low	124 Å²	124	92.2 Å²	92.2	54%	0.539	47%	0.468	S	S	.	.	H	α-helix	trans	-62.2	-39.1	173.6	-156.1	177.4	-176	178.7	0	111.9	V223 N224 T225 E226 F231 S232	V223-K228 HydrophobicContact CG1-CB 4.13Å; V223-K228 HydrophobicContact CG1-CD 4.06Å; V223-K228 HydrophobicContact CG1-CG 4.35Å; N224-K228 PolarHBondContact O-N 3.44Å; T225-K228 PolarHBondContact O-N 3.32Å; E226-K228 VanDerWaalsContact C-N 3.34Å; K228-F231 PolarHBondContact O-N 3.24Å; K228-S232 WeakPolarHBondContact O-CB 3.38Å; K228-S232 PolarHBondContact O-N 2.99Å; K228-S232 PolarHBondContact O-OG 3.32Å
229	K	55.1	Low	47.4	Very low	100 Å²	100	98.1 Å²	98.1	44%	0.435	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-44	170.9	-72.1	171.2	-162.7	170.4	0	110.8	T225 E226 L227 F231 S232 F233	T225-K229 VanDerWaalsContact O-CG 3.25Å; T225-K229 WeakPolarHBondContact O-CG 3.39Å; T225-K229 PolarHBondContact O-N 2.99Å; E226-K229 WeakPolarHBondContact O-CB 3.44Å; E226-K229 PolarHBondContact O-N 3.42Å; E226-K229 IonicContact OE1-NZ 2.9Å; E226-K229 PolarHBondContact OE1-NZ 3.07Å; L227-K229 VanDerWaalsContact C-N 3.32Å; L227-K229 PolarHBondContact O-N 3.41Å; K229-F231 VanDerWaalsContact C-N 3.27Å; K229-F231 PolarHBondContact O-N 2.86Å; K229-S232 WeakPolarHBondContact O-CA 3.09Å; K229-S232 PolarHBondContact O-N 3.15Å; K229-F233 HydrophobicContact CB-CE2 4.31Å; K229-F233 WeakPolarHBondContact O-CD2 3.33Å; K229-F233 PolarHBondContact O-N 3.02Å
230	L	49.7	Very low	45.3	Very low	93 Å²	93	102.7 Å²	102.7	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-60	-34.3	175.7	-71.2	172.1	0	0	0	113.1	L209 E226 L227 S232	L209-L230 HydrophobicContact CD1-CB 3.94Å; E226-L230 WeakPolarHBondContact O-CG 3.49Å; E226-L230 PolarHBondContact O-N 3.27Å; L227-L230 HydrophobicContact CD2-CD1 3.93Å; L227-L230 WeakPolarHBondContact O-CB 3.26Å; L227-L230 PolarHBondContact O-N 3.04Å; L227-L230 VanDerWaalsContact O-N 3.12Å; L230-S232 VanDerWaalsContact C-N 3.26Å; L230-S232 PolarHBondContact O-N 3.24Å
231	F	48.6	Very low	43.6	Very low	44 Å²	44	108.3 Å²	108.3	19%	0.193	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-8	172.4	-59.6	-55.9	0	0	0	114.4	L209 A212 W213 H216 L227 K228 K229 L286	L209-F231 HydrophobicContact CD1-CD1 4.07Å; L209-F231 HydrophobicContact CD1-CE1 3.96Å; A212-F231 HydrophobicContact CB-CZ 3.96Å; W213-F231 HydrophobicContact CB-CE1 3.73Å; W213-F231 HydrophobicContact CB-CZ 4.09Å; W213-F231 AromaticContact CD1-CE1 3.95Å; W213-F231 HydrophobicContact CG-CE1 4.27Å; H216-F231 HydrophobicContact CB-CE2 4.44Å; H216-F231 AromaticContact ND1-CE2 3.95Å; L227-F231 HydrophobicContact CB-CE2 4.17Å; L227-F231 WeakPolarHBondContact O-CD2 3.41Å; L227-F231 WeakPolarHBondContact O-CE2 3.25Å; L227-F231 WeakPolarHBondContact O-CG 3.48Å; L227-F231 PolarHBondContact O-N 3.4Å; K228-F231 PolarHBondContact O-N 3.24Å; K229-F231 VanDerWaalsContact C-N 3.27Å; K229-F231 PolarHBondContact O-N 2.86Å; F231-L286 HydrophobicContact CD1-CD1 4.04Å
232	S	40.5	Very low	42.1	Very low	84 Å²	84	105.3 Å²	105.3	59%	0.587	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	1	-173.8	-53.2	0	0	0	0	114.1	K228 K229 L230	K228-S232 WeakPolarHBondContact O-CB 3.38Å; K228-S232 PolarHBondContact O-N 2.99Å; K228-S232 PolarHBondContact O-OG 3.32Å; K229-S232 WeakPolarHBondContact O-CA 3.09Å; K229-S232 PolarHBondContact O-N 3.15Å; L230-S232 VanDerWaalsContact C-N 3.26Å; L230-S232 PolarHBondContact O-N 3.24Å
233	F	36.6	Very low	40.7	Very low	147 Å²	147	106.8 Å²	106.8	65%	0.645	60%	0.595	S	S	*	*			trans	-107.7	120.3	-178.6	-87.1	-73.3	0	0	0	113.4	K229	K229-F233 HydrophobicContact CB-CE2 4.31Å; K229-F233 WeakPolarHBondContact O-CD2 3.33Å; K229-F233 PolarHBondContact O-N 3.02Å
234	P	33.8	Very low	39.4	Very low	102 Å²	102	109.3 Å²	109.3	66%	0.662	62%	0.616	S	S	*	*			trans	-84.4	-4.3	170	-9	26.4	0	0	0	114.9
235	H	33.3	Very low	38	Very low	168 Å²	168	113.5 Å²	113.5	78%	0.778	65%	0.646	S	S	*	*			trans	-124.4	73.8	-166.8	-88.7	-68.3	0	0	0	113.3
236	V	30.9	Very low	36.6	Very low	130 Å²	130	116.8 Å²	116.8	79%	0.788	66%	0.66	S	S	*	*			trans	-138.5	65.7	154.4	-168.1	0	0	0	0	109.1
237	L	32.4	Very low	35.1	Very low	163 Å²	163	118.7 Å²	118.7	85%	0.853	67%	0.673	S	S	*	*			trans	-129.3	72.9	157.1	-87.2	167.5	0	0	0	106.6
238	Q	29.2	Very low	33.9	Very low	191 Å²	191	124.9 Å²	124.9	89%	0.893	71%	0.711	S	S	*	*			trans	-169.7	89.3	159.1	-104.9	164.6	37.3	0	0	108.4
239	S	26.5	Very low	32.3	Very low	125 Å²	125	128 Å²	128	87%	0.874	73%	0.728	S	S	*	*			trans	-89.4	99.7	155.8	57.1	0	0	0	0	107.8
240	S	27.1	Very low	30.9	Very low	108 Å²	108	128.6 Å²	128.6	76%	0.755	74%	0.744	S	S	*	*			trans	-140.5	143	151.7	-101	0	0	0	0	108
241	P	31.7	Very low	29.7	Very low	126 Å²	126	130.4 Å²	130.4	82%	0.818	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-70.3	138.3	-170.2	28.7	-31.9	0	0	0	110.7	N243	P241-N243 PolarHBondContact O-N 2.81Å
242	A	27.2	Very low	28.5	Very low	97 Å²	97	132.7 Å²	132.7	80%	0.802	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-58.3	129.6	177.5	0	0	0	0	0	111.6
243	N	24.6	Very low	27.8	Very low	165 Å²	165	134.7 Å²	134.7	88%	0.882	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-100.5	136.1	147.7	-95.5	-11.7	0	0	0	108.3	P241	P241-N243 PolarHBondContact O-N 2.81Å
244	S	26.1	Very low	27.3	Very low	112 Å²	112	131.2 Å²	131.2	78%	0.783	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-68.8	138.8	-176.4	51	0	0	0	0	115.1
245	S	25.6	Very low	26.9	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	82%	0.819	S	S	*	*			trans	177.4	114.5	132.9	53.5	0	0	0	0	109.5
246	L	25.7	Very low	26.6	Very low	152 Å²	152	134.1 Å²	134.1	80%	0.796	82%	0.821	S	S	*	*				74.8	112.2	102	-78.7	161.6	0	0	0	115.5
247	D	23.6	Very low	26.4	Very low	145 Å²	145	135.1 Å²	135.1	78%	0.775	82%	0.822	S	S	*	*			trans	39.4	133.8	141.6	-61.1	-23.3	0	0	0	121.8
248	V	27.2	Very low	26.2	Very low	143 Å²	143	134.6 Å²	134.6	87%	0.867	82%	0.82	S	S	*	*				179.3	137.3	110.3	159	0	0	0	0	110.3
249	E	23.1	Very low	26.1	Very low	190 Å²	190	131.6 Å²	131.6	89%	0.888	81%	0.814	S	S	*	*			trans	-58.7	151	174.7	-63.8	168.7	128.4	0	0	114.3
250	S	26	Very low	26.1	Very low	112 Å²	112	133.3 Å²	133.3	78%	0.783	81%	0.812	S	S	*	*			trans	-172.7	131.6	133.8	173.2	0	0	0	0	113.3
251	T	23.6	Very low	26.1	Very low	131 Å²	131	133.2 Å²	133.2	80%	0.804	81%	0.809	S	S	*	*			trans	-53.1	156.6	172.4	32.1	0	0	0	0	119.5
252	A	25.1	Very low	25.9	Very low	93 Å²	93	133.2 Å²	133.2	77%	0.769	81%	0.811	S	S	*	*			trans	98.4	118.6	132.5	0	0	0	0	0	122.3
253	S	25	Very low	25.9	Very low	126 Å²	126	138 Å²	138	88%	0.881	81%	0.813	S	S	*	*				64.9	123.8	124.4	175.3	0	0	0	0	121.5
254	G	25.4	Very low	26	Very low	74 Å²	74	141.8 Å²	141.8	76%	0.763	82%	0.815	S	S	*	*			trans	168.9	106.1	148.3	0	0	0	0	0	115.4
255	K	26.2	Very low	26	Very low	215 Å²	215	143.5 Å²	143.5	94%	0.935	82%	0.82	S	S	*	*			trans	-74	143.6	164.8	-75.6	174.9	171.6	178	0	110.9
256	S	26.5	Very low	26	Very low	116 Å²	116	147.9 Å²	147.9	81%	0.811	83%	0.826	S	S	*	*			trans	-169	126.7	134.8	63.4	0	0	0	0	112.6
257	D	27.4	Very low	26.1	Very low	151 Å²	151	148.4 Å²	148.4	81%	0.807	83%	0.829	S	S	*	*			trans	-55.5	147.5	160.7	-69.1	-54	0	0	0	112.3
258	N	27.4	Very low	26.1	Very low	151 Å²	151	152.7 Å²	152.7	81%	0.807	84%	0.836	S	S	*	*			trans	-171.7	113.7	136.1	-95.4	-31	0	0	0	113.4
259	V	26.3	Very low	26.1	Very low	129 Å²	129	151.3 Å²	151.3	78%	0.782	83%	0.833	S	S	*	*			trans	31.9	113.8	132.4	-169.3	0	0	0	0	118.5
260	I	27	Very low	26.1	Very low	160 Å²	160	151.4 Å²	151.4	82%	0.821	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-88.2	126.4	168.5	-58.3	167.6	0	0	0	109.8
261	P	27.8	Very low	26.5	Very low	106 Å²	106	151.5 Å²	151.5	69%	0.688	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-98.4	121.6	160.7	30.6	-20.6	0	0	0	111	K263	P261-K263 PolarHBondContact O-N 3.27Å
262	C	27.3	Very low	26.5	Very low	127 Å²	127	150.7 Å²	150.7	86%	0.858	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-56.2	122.8	167.1	-68	0	0	0	0	111.3
263	K	27.1	Very low	26.8	Very low	196 Å²	196	155.9 Å²	155.9	85%	0.852	84%	0.837	S	S	*	*			trans	-130.8	120.8	159.7	-80.5	-174	177.9	175.9	0	111	P261	P261-K263 PolarHBondContact O-N 3.27Å
264	R	26.9	Very low	26.9	Very low	245 Å²	245	158.2 Å²	158.2	93%	0.925	83%	0.831	S	S	*	*			trans	-42.1	137.1	164.4	-87.7	173.5	171	158	-2.9	111.7
265	V	26.8	Very low	27.3	Very low	148 Å²	148	164.4 Å²	164.4	90%	0.897	84%	0.84	S	S	*	*			trans	-104.8	120.2	155.7	179.3	0	0	0	0	108.2
266	K	24	Very low	27.4	Very low	195 Å²	195	163 Å²	163	85%	0.848	84%	0.837	S	S	*	*			trans	-73.6	138.1	174.8	-88.4	176.2	170.1	178.6	0	109.9
267	L	27.9	Very low	27.5	Very low	164 Å²	164	163.7 Å²	163.7	86%	0.859	83%	0.832	S	S	*	*			trans	-56.9	131.6	159.9	-79.5	145.5	0	0	0	110.9
268	Y	23.2	Very low	27.6	Very low	235 Å²	235	162.5 Å²	162.5	92%	0.922	83%	0.832	S	S	*	*				-161	139	128.9	-101.3	-75	0	0	0	109.9
269	S	27.9	Very low	27.8	Very low	113 Å²	113	159.9 Å²	159.9	79%	0.79	83%	0.826	S	S	*	*			trans	-63.4	140	176.5	-56.1	0	0	0	0	112.8
270	E	22.4	Very low	28.1	Very low	193 Å²	193	160.7 Å²	160.7	90%	0.902	83%	0.826	S	S	*	*			trans	-166.1	134.6	134	-109.6	169.9	-162.5	0	0	110.3	V272	E270-V272 PolarHBondContact O-N 2.95Å
271	S	34.3	Very low	28.3	Very low	114 Å²	114	158.5 Å²	158.5	80%	0.797	82%	0.82	S	S	*	*			trans	-72.8	110.2	-179.3	46.8	0	0	0	0	111.6
272	V	25.5	Very low	28.8	Very low	114 Å²	114	157.2 Å²	157.2	69%	0.691	81%	0.811	S	S	*	*			trans	-148.7	117.7	152.9	-175.5	0	0	0	0	108	E270 K274	E270-V272 PolarHBondContact O-N 2.95Å; V272-K274 HydrophobicContact CG1-CG 4.21Å; V272-K274 PolarHBondContact O-N 3.36Å; V272-K274 VanDerWaalsContact O-N 3.09Å
273	E	31.4	Very low	29.5	Very low	202 Å²	202	158 Å²	158	94%	0.944	81%	0.807	S	S	*	*			trans	-60.2	106.8	163.3	-67.1	178.1	158.9	0	0	108
274	K	25.8	Very low	30.8	Very low	174 Å²	174	152.7 Å²	152.7	76%	0.757	78%	0.784	S	S	*	*			trans	-113.4	127.1	163.4	-84.9	-173.7	174.8	-179.5	0	107.9	V272 E276	V272-K274 HydrophobicContact CG1-CG 4.21Å; V272-K274 PolarHBondContact O-N 3.36Å; V272-K274 VanDerWaalsContact O-N 3.09Å; K274-E276 PolarHBondContact O-N 2.89Å; K274-E276 VanDerWaalsContact O-N 3.14Å
275	E	33.5	Very low	32.5	Very low	204 Å²	204	143.2 Å²	143.2	95%	0.953	75%	0.753	S	S	*	*			trans	-51	112.9	167.2	-71.4	175.7	140.1	0	0	109
276	E	29.9	Very low	34.4	Very low	186 Å²	186	137.8 Å²	137.8	87%	0.869	72%	0.719	S	S	*	*			trans	-93.4	140.4	168	-76	-178.3	162.7	0	0	109.3	K274	K274-E276 PolarHBondContact O-N 2.89Å; K274-E276 VanDerWaalsContact O-N 3.14Å
277	D	26.8	Very low	36.7	Very low	130 Å²	130	131.9 Å²	131.9	70%	0.695	70%	0.697	S	S	*	*			trans	-45.2	144.5	-178.8	-101.8	-44.4	0	0	0	114	S279	D277-S279 PolarHBondContact O-N 3.27Å; D277-S279 VanDerWaalsContact O-N 3.09Å
278	P	31	Very low	38.7	Very low	127 Å²	127	124.8 Å²	124.8	83%	0.825	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	6.4	179.5	17.5	-11.4	0	0	0	115
279	S	31.5	Very low	41.2	Very low	95 Å²	95	117.8 Å²	117.8	66%	0.664	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-10.6	-174.3	61.4	0	0	0	0	116	D277 V281	D277-S279 PolarHBondContact O-N 3.27Å; D277-S279 VanDerWaalsContact O-N 3.09Å; S279-V281 PolarHBondContact O-N 3.45Å
280	D	31.6	Very low	43.4	Very low	147 Å²	147	115 Å²	115	79%	0.786	62%	0.615	S	S	*	*			trans	-98.7	83.4	175.9	-83.7	-22.3	0	0	0	110.5	P282	D280-P282 VanDerWaalsContact O-CD 3.23Å; D280-P282 WeakPolarHBondContact O-CD 3.13Å
281	V	32.3	Very low	45.8	Very low	114 Å²	114	105.9 Å²	105.9	69%	0.691	57%	0.572	S	S	*	*			trans	-75	113.2	168.8	-179.2	0	0	0	0	107.8	S279 N283	S279-V281 PolarHBondContact O-N 3.45Å; V281-N283 PolarHBondContact O-N 3.47Å
282	P	37.3	Very low	47.8	Very low	79 Å²	79	101 Å²	101	51%	0.513	54%	0.537	S	S	.	.			trans	-67.4	121.1	174.1	-10.7	26.3	0	0	0	108.1	D280 F284	D280-P282 VanDerWaalsContact O-CD 3.23Å; D280-P282 WeakPolarHBondContact O-CD 3.13Å; P282-F284 HydrophobicContact CB-CE1 4.1Å; P282-F284 HydrophobicContact CB-CE2 3.95Å; P282-F284 HydrophobicContact CB-CZ 3.7Å; P282-F284 HydrophobicContact CG-CE2 4.08Å; P282-F284 HydrophobicContact CG-CZ 3.79Å; P282-F284 WeakPolarHBondContact O-CD2 3.5Å; P282-F284 VanDerWaalsContact O-CE2 3.3Å; P282-F284 WeakPolarHBondContact O-CE2 3.45Å; P282-F284 PolarHBondContact O-N 3.12Å
283	N	43.2	Very low	50.1	Low	144 Å²	144	102.4 Å²	102.4	77%	0.77	54%	0.536	S	S	*	.			trans	-64.4	98.9	171.1	-83.8	-28	0	0	0	109.2	V281	V281-N283 PolarHBondContact O-N 3.47Å
284	F	53.2	Low	52.2	Low	83 Å²	83	96.4 Å²	96.4	36%	0.364	51%	0.514	S	S	.	.			trans	-82	122	175.6	-60.7	-75.5	0	0	0	110.1	Q183 P282	Q183-F284 HydrophobicContact CG-CD1 4.47Å; P282-F284 HydrophobicContact CB-CE1 4.1Å; P282-F284 HydrophobicContact CB-CE2 3.95Å; P282-F284 HydrophobicContact CB-CZ 3.7Å; P282-F284 HydrophobicContact CG-CE2 4.08Å; P282-F284 HydrophobicContact CG-CZ 3.79Å; P282-F284 WeakPolarHBondContact O-CD2 3.5Å; P282-F284 VanDerWaalsContact O-CE2 3.3Å; P282-F284 WeakPolarHBondContact O-CE2 3.45Å; P282-F284 PolarHBondContact O-N 3.12Å
285	T	62.5	Low	54.2	Low	46 Å²	46	90 Å²	90	28%	0.282	49%	0.486	S	S	.	.			trans	-83.5	137.4	173.8	-177.2	0	0	0	0	111.8	D287 V290	T285-D287 PolarHBondContact OG1-N 2.98Å; T285-V290 HydrophobicContact CG2-CB 3.73Å; T285-V290 HydrophobicContact CG2-CG1 3.4Å
286	L	67.2	Low	55.7	Low	35 Å²	35	82.9 Å²	82.9	18%	0.183	46%	0.459	C	S	.	.			trans	-99.2	1.2	175.6	-63.1	174.9	0	0	0	112.6	L177 L186 W213 F231 P288	L177-L286 HydrophobicContact CD2-CD2 3.68Å; L186-L286 HydrophobicContact CD1-CD2 3.63Å; W213-L286 PolarHBondContact NE1-O 3.46Å; F231-L286 HydrophobicContact CD1-CD1 4.04Å; L286-P288 WeakPolarHBondContact O-CD 3.39Å
287	D	71.8	Confident	56.8	Low	71 Å²	71	78 Å²	78	38%	0.38	44%	0.443	S	S	.	.			trans	-73.4	119.8	-177.6	-172.8	-21.9	0	0	0	111	T285 Q289 V290 L291	T285-D287 PolarHBondContact OG1-N 2.98Å; D287-Q289 PolarHBondContact O-N 2.82Å; D287-Q289 PolarHBondContact OD1-N 3.37Å; D287-V290 HydrophobicContact CB-CB 4.24Å; D287-V290 HydrophobicContact CB-CG2 3.85Å; D287-V290 PolarHBondContact O-N 3.47Å; D287-V290 VanDerWaalsContact O-N 3.12Å; D287-L291 WeakPolarHBondContact O-CG 3.13Å; D287-L291 PolarHBondContact O-N 3.42Å
288	P	71	Confident	57.7	Low	14 Å²	14	78 Å²	78	9%	0.091	45%	0.452	C	S	.	.	H	α-helix	trans	-52.3	-36.1	176.5	-26.1	34.9	0	0	0	114.6	W213 L286 L291 C292	W213-P288 HydrophobicContact CZ2-CG 4.49Å; L286-P288 WeakPolarHBondContact O-CD 3.39Å; P288-L291 WeakPolarHBondContact O-CB 3.49Å; P288-L291 PolarHBondContact O-N 3.3Å; P288-C292 PolarHBondContact O-N 3.45Å
289	Q	74.7	Confident	58.1	Low	88 Å²	88	79.9 Å²	79.9	41%	0.411	46%	0.455	S	S	.	.	H	α-helix	trans	-67.3	-42.3	179.8	-63.8	-173.4	-1.8	0	0	111.3	D287 L291 C292 H293 C306	D287-Q289 PolarHBondContact O-N 2.82Å; D287-Q289 PolarHBondContact OD1-N 3.37Å; Q289-L291 VanDerWaalsContact C-N 3.32Å; Q289-L291 PolarHBondContact O-N 3.24Å; Q289-C292 PolarHBondContact O-N 3.08Å; Q289-H293 PolarHBondContact O-CD2 3.12Å; Q289-H293 PolarHBondContact O-N 3.11Å; Q289-C306 HydrophobicContact CG-CB 4.46Å
290	V	74.3	Confident	58.7	Low	56 Å²	56	77.4 Å²	77.4	34%	0.339	44%	0.444	S	S	.	.	H	α-helix	trans	-69.1	-33.8	178.6	-172.1	0	0	0	0	110.9	T285 D287 H293 T294	T285-V290 HydrophobicContact CG2-CB 3.73Å; T285-V290 HydrophobicContact CG2-CG1 3.4Å; D287-V290 HydrophobicContact CB-CB 4.24Å; D287-V290 HydrophobicContact CB-CG2 3.85Å; D287-V290 PolarHBondContact O-N 3.47Å; D287-V290 VanDerWaalsContact O-N 3.12Å; V290-H293 PolarHBondContact O-N 3.04Å; V290-T294 WeakPolarHBondContact O-CB 3.31Å; V290-T294 PolarHBondContact O-N 2.87Å; V290-T294 PolarHBondContact O-OG1 3.48Å
291	L	73.8	Confident	59.1	Low	0 Å²	0	76.5 Å²	76.5	0%	0	45%	0.447	C	S	.	.	H	α-helix	trans	-61.1	-44.8	171.1	-66.8	172.1	0	0	0	111.3	Q183 L186 Y187 W213 D287 P288 Q289 H293 T294 F295	Q183-L291 HydrophobicContact CB-CD2 4.03Å; Q183-L291 HydrophobicContact CG-CD2 4.13Å; L186-L291 HydrophobicContact CB-CD1 3.44Å; L186-L291 VanDerWaalsContact CB-CD1 3.44Å; L186-L291 HydrophobicContact CB-CD2 4.49Å; L186-L291 HydrophobicContact CD1-CD1 4.36Å; Y187-L291 HydrophobicContact CD2-CB 4.43Å; W213-L291 HydrophobicContact CZ2-CD1 4.48Å; D287-L291 WeakPolarHBondContact O-CG 3.13Å; D287-L291 PolarHBondContact O-N 3.42Å; P288-L291 WeakPolarHBondContact O-CB 3.49Å; P288-L291 PolarHBondContact O-N 3.3Å; Q289-L291 VanDerWaalsContact C-N 3.32Å; Q289-L291 PolarHBondContact O-N 3.24Å; L291-H293 PolarHBondContact O-N 3.29Å; L291-T294 PolarHBondContact O-N 3.25Å; L291-F295 WeakPolarHBondContact O-CD2 3.44Å; L291-F295 PolarHBondContact O-N 2.85Å
292	C	76.1	Confident	59.7	Low	11 Å²	11	76.4 Å²	76.4	7%	0.074	45%	0.451	C	S	.	.	H	α-helix	trans	-61.2	-43	175.6	-91.3	0	0	0	0	112.7	H190 P288 Q289 T294 F295 S296 C306	H190-C292 PolarHBondContact CD2-SG 3.22Å; H190-C292 PolarHBondContact NE2-SG 2.81Å; P288-C292 PolarHBondContact O-N 3.45Å; Q289-C292 PolarHBondContact O-N 3.08Å; C292-T294 VanDerWaalsContact C-N 3.27Å; C292-T294 PolarHBondContact O-N 3.36Å; C292-F295 PolarHBondContact O-N 2.88Å; C292-S296 WeakPolarHBondContact O-CB 3.45Å; C292-S296 PolarHBondContact O-N 2.76Å; C292-S296 PolarHBondContact O-OG 3.17Å; C292-C306 VanDerWaalsContact SG-SG 3.67Å
293	H	74.1	Confident	60.3	Low	144 Å²	144	76.5 Å²	76.5	67%	0.667	46%	0.458	S	S	*	.	H	α-helix	trans	-63.6	-32.4	174.9	-70.9	-58.2	0	0	0	113.2	Q289 V290 L291	Q289-H293 PolarHBondContact O-CD2 3.12Å; Q289-H293 PolarHBondContact O-N 3.11Å; V290-H293 PolarHBondContact O-N 3.04Å; L291-H293 PolarHBondContact O-N 3.29Å
294	T	73.8	Confident	60.8	Low	77 Å²	77	72.4 Å²	72.4	47%	0.472	45%	0.451	S	S	.	.	H	α-helix	trans	-72.2	-34.1	-178.4	-56	0	0	0	0	112.7	V290 L291 C292	V290-T294 WeakPolarHBondContact O-CB 3.31Å; V290-T294 PolarHBondContact O-N 2.87Å; V290-T294 PolarHBondContact O-OG1 3.48Å; L291-T294 PolarHBondContact O-N 3.25Å; C292-T294 VanDerWaalsContact C-N 3.27Å; C292-T294 PolarHBondContact O-N 3.36Å
295	F	68.8	Low	61.4	Low	38 Å²	38	72.7 Å²	72.7	17%	0.167	47%	0.468	C	S	.	.	H	α-helix	trans	-110.5	-4.4	-174.2	-66.6	-72.9	0	0	0	114.8	T153 Q183 Y187 L291 C292	T153-F295 HydrophobicContact CG2-CD1 4.29Å; T153-F295 HydrophobicContact CG2-CE1 4.34Å; T153-F295 WeakPolarHBondContact OG1-CE1 3.5Å; Q183-F295 HydrophobicContact CB-CE2 3.98Å; Q183-F295 HydrophobicContact CB-CZ 4.03Å; Y187-F295 HydrophobicContact CD1-CB 4.12Å; Y187-F295 HydrophobicContact CD1-CD2 4.17Å; Y187-F295 HydrophobicContact CD1-CG 4.19Å; Y187-F295 HydrophobicContact CD2-CB 3.89Å; Y187-F295 AromaticContact CD2-CD2 3.75Å; Y187-F295 HydrophobicContact CD2-CD2 3.75Å; Y187-F295 HydrophobicContact CD2-CG 4.19Å; Y187-F295 HydrophobicContact CE1-CB 3.94Å; Y187-F295 HydrophobicContact CE1-CG 4.48Å; Y187-F295 HydrophobicContact CE2-CB 3.72Å; Y187-F295 HydrophobicContact CE2-CD2 4.46Å; Y187-F295 HydrophobicContact CG-CB 4.07Å; Y187-F295 AromaticContact CG-CD2 3.56Å; Y187-F295 HydrophobicContact CG-CD2 3.56Å; Y187-F295 HydrophobicContact CG-CE2 4.29Å; Y187-F295 HydrophobicContact CG-CG 4.01Å; L291-F295 WeakPolarHBondContact O-CD2 3.44Å; L291-F295 PolarHBondContact O-N 2.85Å; C292-F295 PolarHBondContact O-N 2.88Å
296	S	63.8	Low	61.8	Low	56 Å²	56	71.6 Å²	71.6	39%	0.392	46%	0.462	S	S	.	.	S	Bend	trans	-75.1	141.1	176.5	-66	0	0	0	0	111.6	C292 C298	C292-S296 WeakPolarHBondContact O-CB 3.45Å; C292-S296 PolarHBondContact O-N 2.76Å; C292-S296 PolarHBondContact O-OG 3.17Å; S296-C298 PolarHBondContact O-N 3.39Å
297	P	54.9	Low	62.3	Low	84 Å²	84	74.1 Å²	74.1	55%	0.545	48%	0.479	S	S	.	.			trans	-62.2	134.8	173.3	-15	27.3	0	0	0	110.8	D299 G300	P297-D299 PolarHBondContact O-N 2.99Å; P297-G300 PolarHBondContact O-N 3.41Å
298	C	45.4	Very low	62.7	Low	130 Å²	130	75.5 Å²	75.5	88%	0.878	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-13.6	-178.4	-71.1	0	0	0	0	115.3	S296	S296-C298 PolarHBondContact O-N 3.39Å
299	D	39	Very low	63.3	Low	165 Å²	165	75.4 Å²	75.4	88%	0.882	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	11.5	-172.7	-61.5	-40.9	0	0	0	114.3	P297	P297-D299 PolarHBondContact O-N 2.99Å
300	G	44.2	Very low	64	Low	43 Å²	43	77.3 Å²	77.3	44%	0.443	49%	0.493	S	S	.	.	S	Bend	trans	-84.9	149.3	171.6	0	0	0	0	0	112	P297 S302	P297-G300 PolarHBondContact O-N 3.41Å; G300-S302 PolarHBondContact O-N 3.49Å
301	P	40	Very low	65	Low	128 Å²	128	74.9 Å²	74.9	83%	0.831	48%	0.477	S	S	*	.			trans	-53.7	130.5	170.9	23.8	-31.3	0	0	0	107.9	A303	P301-A303 VanDerWaalsContact C-N 3.32Å; P301-A303 PolarHBondContact O-N 3.43Å
302	S	45	Very low	66	Low	113 Å²	113	75.7 Å²	75.7	79%	0.79	48%	0.482	S	S	*	.			trans	-43.2	98.5	175.1	163.9	0	0	0	0	108.4	G300 G304	G300-S302 PolarHBondContact O-N 3.49Å; S302-G304 PolarHBondContact O-N 3.3Å
303	A	49.2	Very low	67	Low	80 Å²	80	78 Å²	78	66%	0.661	49%	0.492	S	S	*	.			trans	-55.5	131	174.8	0	0	0	0	0	105.5	P301	P301-A303 VanDerWaalsContact C-N 3.32Å; P301-A303 PolarHBondContact O-N 3.43Å
304	G	55	Low	68	Low	59 Å²	59	71.3 Å²	71.3	61%	0.608	46%	0.461	S	S	*	.			trans	-54.6	177.5	178.7	0	0	0	0	0	111.9	S302 C306	S302-G304 PolarHBondContact O-N 3.3Å; G304-C306 PolarHBondContact O-N 3.27Å
305	A	65.1	Low	69.1	Low	89 Å²	89	70 Å²	70	74%	0.736	45%	0.45	S	S	*	.	S	Bend	trans	-47.5	130.7	176.8	0	0	0	0	0	110.6	T307	A305-T307 PolarHBondContact O-N 3.47Å
306	C	70.9	Confident	70.4	Confident	23 Å²	23	68.2 Å²	68.2	16%	0.155	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-57.3	125.5	180	-64.8	0	0	0	0	108.8	Q289 C292 G304	Q289-C306 HydrophobicContact CG-CB 4.46Å; C292-C306 VanDerWaalsContact SG-SG 3.67Å; G304-C306 PolarHBondContact O-N 3.27Å
307	T	76.8	Confident	71.7	Confident	88 Å²	88	70.8 Å²	70.8	54%	0.54	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-70.4	156	171.8	48.9	0	0	0	0	109.1	D194 A305	D194-T307 WeakPolarHBondContact CB-O 3.47Å; D194-T307 PolarHBondContact O-OG1 3.43Å; A305-T307 PolarHBondContact O-N 3.47Å
308	F	81.5	Confident	73.2	Confident	99 Å²	99	67.6 Å²	67.6	43%	0.434	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-95.2	142.8	165.3	-70.6	-78.1	0	0	0	109.8	G217	G217-F308 WeakPolarHBondContact O-CB 3.42Å
309	G	83.1	Confident	75.2	Confident	12 Å²	12	61.5 Å²	61.5	12%	0.124	38%	0.381	C	S	.	.			trans	-70.6	177.7	174	0	0	0	0	0	113.2	L193 D194 R218	L193-G309 VanDerWaalsContact O-CA 3.25Å; L193-G309 WeakPolarHBondContact O-CA 3.43Å; D194-G309 PolarHBondContact OD1-N 3.28Å; R218-G309 CarbonylContact C-O 3.48Å; R218-G309 VanDerWaalsContact CA-O 3.27Å; R218-G309 WeakPolarHBondContact CA-O 3.46Å
310	Q	89.4	Confident	77.5	Confident	129 Å²	129	54.7 Å²	54.7	60%	0.603	35%	0.35	S	S	*	.			trans	-127.5	107.3	174.5	-68	-173.7	-6.9	0	0	110.5	T312	Q310-T312 PolarHBondContact O-N 3.39Å
311	I	94	Very high	79.3	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	35%	0.348	C	S	.	.			trans	-81.8	112.6	173.9	-62.5	166.7	0	0	0	108.1	T199 L201 L215 R218 H313 L314 F334	T199-I311 CarbonylContact O-C 3.54Å; T199-I311 WeakPolarHBondContact O-CA 3.46Å; L201-I311 HydrophobicContact CB-CD1 4.24Å; L201-I311 HydrophobicContact CB-CG1 4.48Å; L201-I311 HydrophobicContact CB-CG2 4.04Å; L201-I311 HydrophobicContact CD2-CD1 3.76Å; L215-I311 HydrophobicContact CD2-CD1 4.34Å; R218-I311 HydrophobicContact CB-CD1 3.66Å; R218-I311 HydrophobicContact CB-CG1 4.02Å; R218-I311 PolarHBondContact O-N 2.9Å; I311-H313 WeakPolarHBondContact CG2-O 3.01Å; I311-L314 HydrophobicContact CG2-CB 4.42Å; I311-F334 HydrophobicContact CB-CE2 4.29Å; I311-F334 HydrophobicContact CB-CZ 3.92Å; I311-F334 HydrophobicContact CG2-CZ 4.09Å; I311-F334 WeakPolarHBondContact O-CE2 3.38Å
312	T	95.3	Very high	81.4	Confident	17 Å²	17	54 Å²	54	10%	0.104	33%	0.332	C	S	.	.			trans	-99	-20.6	176.8	63.2	0	0	0	0	112.2	T199 Q310 Q338 S339	T199-T312 WeakPolarHBondContact CB-OG1 3.36Å; T199-T312 PolarHBondContact O-N 3.38Å; Q310-T312 PolarHBondContact O-N 3.39Å; T312-Q338 PolarHBondContact O-N 2.93Å; T312-S339 PolarHBondContact O-N 3.09Å
313	H	97.3	Very high	83.5	Confident	61 Å²	61	48.9 Å²	48.9	28%	0.282	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.9	178.3	-60.6	67	0	0	0	110	T199 N200 L201 I311 S339	T199-H313 PolarHBondContact O-N 3.35Å; T199-H313 VanDerWaalsContact O-N 3.12Å; N200-H313 CarbonylContact C-O 3.42Å; N200-H313 WeakPolarHBondContact CA-O 3.27Å; N200-H313 HydrophobicContact CB-CB 4.16Å; N200-H313 WeakPolarHBondContact OD1-CB 3.42Å; N200-H313 PolarHBondContact OD1-ND1 2.74Å; L201-H313 PolarHBondContact N-O 3.32Å; I311-H313 WeakPolarHBondContact CG2-O 3.01Å; H313-S339 WeakPolarHBondContact CA-O 3.43Å; H313-S339 WeakPolarHBondContact CD2-CB 3.35Å
314	L	96.5	Very high	85.4	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.7	178.6	179.7	61.6	0	0	0	110.4	L201 V203 L215 I311 I316 L327 F334 L337 S339 L340 S341	L201-L314 HydrophobicContact CB-CD1 4.14Å; L201-L314 HydrophobicContact CD2-CD1 3.96Å; L201-L314 HydrophobicContact CG-CD1 4.15Å; L201-L314 WeakPolarHBondContact O-CA 3.21Å; V203-L314 HydrophobicContact CG2-CD1 4.15Å; L215-L314 HydrophobicContact CD1-CD2 4.36Å; L215-L314 HydrophobicContact CD2-CD1 4.17Å; L215-L314 HydrophobicContact CD2-CD2 3.92Å; I311-L314 HydrophobicContact CG2-CB 4.42Å; L314-I316 HydrophobicContact CD1-CG1 4.33Å; L314-I316 HydrophobicContact CD2-CD1 4.39Å; L314-I316 HydrophobicContact CG-CG1 4.19Å; L314-L327 HydrophobicContact CD2-CD2 3.88Å; L314-F334 HydrophobicContact CD2-CE1 4.39Å; L314-L337 HydrophobicContact CB-CD1 3.93Å; L314-S339 PolarHBondContact N-O 2.74Å; L314-L340 HydrophobicContact CB-CD1 4.01Å; L314-L340 HydrophobicContact CD2-CD1 3.88Å; L314-L340 HydrophobicContact CG-CD1 4.02Å; L314-L340 CarbonylContact O-C 3.54Å; L314-L340 WeakPolarHBondContact O-CA 3.4Å; L314-S341 PolarHBondContact O-N 3.27Å
315	E	96.5	Very high	86.9	Confident	50 Å²	50	49.7 Å²	49.7	23%	0.234	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.8	172.2	-177	-170.1	151.9	0	0	109.4	L201 V202 V203 R317 S341	L201-E315 PolarHBondContact O-N 3.14Å; V202-E315 CarbonylContact C-O 3.26Å; V202-E315 WeakPolarHBondContact CA-O 3.39Å; V202-E315 HydrophobicContact CB-CB 4.47Å; V202-E315 HydrophobicContact CG1-CB 4.24Å; V202-E315 HydrophobicContact CG1-CG 4.27Å; V202-E315 HydrophobicContact CG2-CB 4.2Å; V203-E315 PolarHBondContact N-O 3.41Å; E315-R317 HydrophobicContact CG-CG 4.3Å; E315-R317 VanDerWaalsContact OE1-CG 3.27Å; E315-R317 WeakPolarHBondContact OE1-CG 3.16Å; E315-R317 IonicContact OE1-CZ 2.88Å; E315-R317 IonicContact OE1-NE 2.87Å; E315-R317 PolarHBondContact OE1-NE 3.31Å; E315-R317 IonicContact OE1-NH2 2.74Å; E315-R317 PolarHBondContact OE1-NH2 2.78Å; E315-R317 IonicContact OE2-NH2 3.22Å; E315-S341 CarbonylContact C-O 3.41Å; E315-S341 WeakPolarHBondContact CA-O 3.4Å
316	I	94.4	Very high	88	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	106.3	174	-52.5	-175.5	0	0	0	107.9	V203 L211 L314 C319 L327 S341 L342 H343	V203-I316 CarbonylContact O-C 3.57Å; V203-I316 WeakPolarHBondContact O-CA 3.47Å; L211-I316 HydrophobicContact CD1-CD1 4.13Å; L211-I316 HydrophobicContact CD2-CD1 4.01Å; L314-I316 HydrophobicContact CD1-CG1 4.33Å; L314-I316 HydrophobicContact CD2-CD1 4.39Å; L314-I316 HydrophobicContact CG-CG1 4.19Å; I316-C319 HydrophobicContact CB-CB 4.28Å; I316-C319 HydrophobicContact CG2-CB 3.84Å; I316-L327 HydrophobicContact CD1-CD1 3.85Å; I316-L327 HydrophobicContact CD1-CD2 4.31Å; I316-L327 HydrophobicContact CD1-CG 4.26Å; I316-S341 PolarHBondContact N-O 3.1Å; I316-L342 HydrophobicContact CB-CD2 4.14Å; I316-L342 HydrophobicContact CD1-CD2 3.93Å; I316-L342 HydrophobicContact CG1-CD2 4.11Å; I316-H343 PolarHBondContact O-N 2.91Å
317	R	91.2	Very high	88.9	Confident	110 Å²	110	44.7 Å²	44.7	42%	0.415	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-21.8	-176.6	-68.5	-172.7	174.1	163.8	5.6	114.4	H171 V202 V203 E315 H343	H171-R317 PolarHBondContact CE1-NH1 2.77Å; H171-R317 VanDerWaalsContact CE1-NH1 3.32Å; V202-R317 HydrophobicContact CG1-CG 4.21Å; V203-R317 PolarHBondContact O-N 3.47Å; E315-R317 HydrophobicContact CG-CG 4.3Å; E315-R317 VanDerWaalsContact OE1-CG 3.27Å; E315-R317 WeakPolarHBondContact OE1-CG 3.16Å; E315-R317 IonicContact OE1-CZ 2.88Å; E315-R317 IonicContact OE1-NE 2.87Å; E315-R317 PolarHBondContact OE1-NE 3.31Å; E315-R317 IonicContact OE1-NH2 2.74Å; E315-R317 PolarHBondContact OE1-NH2 2.78Å; E315-R317 IonicContact OE2-NH2 3.22Å; R317-H343 CarbonylContact C-O 3.57Å; R317-H343 VanDerWaalsContact C-O 3.27Å
318	T	87.2	Confident	89.4	Confident	18 Å²	18	41.5 Å²	41.5	11%	0.11	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.3	55.5	-177.9	57.2	0	0	0	0	110.1	S204 I205 D206 G320 H343	S204-T318 WeakPolarHBondContact CA-OG1 3.27Å; S204-T318 PolarHBondContact O-OG1 3.31Å; I205-T318 PolarHBondContact N-OG1 3.08Å; I205-T318 PolarHBondContact O-OG1 3.31Å; D206-T318 WeakPolarHBondContact OD1-CB 3.46Å; D206-T318 PolarHBondContact OD1-OG1 3.48Å; T318-G320 PolarHBondContact O-N 2.83Å; T318-H343 PolarHBondContact N-O 3.32Å
319	C	88.1	Confident	89.6	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.014	21%	0.208	C	C	.	.			trans	-72.3	114	-178.7	-169	0	0	0	0	110.2	I316 L342 H343 S344 F348	I316-C319 HydrophobicContact CB-CB 4.28Å; I316-C319 HydrophobicContact CG2-CB 3.84Å; C319-L342 HydrophobicContact CB-CB 4.34Å; C319-H343 VanDerWaalsContact CB-O 3.29Å; C319-H343 WeakPolarHBondContact CB-O 3.12Å; C319-H343 PolarHBondContact N-O 3.47Å; C319-S344 WeakPolarHBondContact O-CB 3.4Å; C319-S344 PolarHBondContact O-OG 2.82Å; C319-F348 HydrophobicContact CB-CE1 4.4Å; C319-F348 HydrophobicContact CB-CZ 4.05Å
320	G	85.8	Confident	89.7	Confident	22 Å²	22	40.1 Å²	40.1	23%	0.227	20%	0.204	C	C	.	.			trans	-110.2	-176.5	170.8	0	0	0	0	0	112.5	T318 D322 S323 L324	T318-G320 PolarHBondContact O-N 2.83Å; G320-D322 PolarHBondContact O-N 3.34Å; G320-S323 PolarHBondContact N-OG 2.78Å; G320-S323 WeakPolarHBondContact O-CB 3.25Å; G320-S323 PolarHBondContact O-N 3.06Å; G320-S323 VanDerWaalsContact O-N 3.1Å; G320-L324 PolarHBondContact O-N 3.05Å; G320-L324 VanDerWaalsContact O-N 3.09Å
321	P	83.8	Confident	89.8	Confident	62 Å²	62	34 Å²	34	40%	0.403	18%	0.176	S	C	.	.	H	α-helix	trans	-56	-38.6	175.4	-24.9	34.3	0	0	0	112.9	S323 L324 K325	P321-S323 VanDerWaalsContact C-N 3.35Å; P321-S323 PolarHBondContact O-N 3.28Å; P321-L324 PolarHBondContact O-N 3.16Å; P321-K325 PolarHBondContact O-N 3.27Å
322	D	83.9	Confident	89.5	Confident	94 Å²	94	35 Å²	35	50%	0.503	18%	0.183	S	C	.	.	H	α-helix	trans	-64.5	-38.8	177.2	-72.5	-26	0	0	0	112.3	A208 G320 K325 V326	A208-D322 HydrophobicContact CB-CB 4.18Å; G320-D322 PolarHBondContact O-N 3.34Å; D322-K325 PolarHBondContact O-N 3.06Å; D322-V326 WeakPolarHBondContact O-CG2 3.32Å; D322-V326 PolarHBondContact O-N 3.39Å
323	S	88.7	Confident	89.1	Confident	6 Å²	6	35.7 Å²	35.7	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-64.2	-44.7	174.9	-44.5	0	0	0	0	111.1	G320 P321 K325 V326 L327	G320-S323 PolarHBondContact N-OG 2.78Å; G320-S323 WeakPolarHBondContact O-CB 3.25Å; G320-S323 PolarHBondContact O-N 3.06Å; G320-S323 VanDerWaalsContact O-N 3.1Å; P321-S323 VanDerWaalsContact C-N 3.35Å; P321-S323 PolarHBondContact O-N 3.28Å; S323-K325 VanDerWaalsContact C-N 3.3Å; S323-K325 PolarHBondContact O-N 3.02Å; S323-V326 PolarHBondContact O-N 3.32Å; S323-L327 WeakPolarHBondContact O-CG 3.35Å; S323-L327 PolarHBondContact O-N 2.83Å
324	L	88.8	Confident	88.8	Confident	17 Å²	17	32.8 Å²	32.8	9%	0.089	17%	0.173	C	C	.	.	H	α-helix	trans	-61.8	-38.5	176.2	-70.5	178.3	0	0	0	111.7	G320 P321 L327 G328 L342 F348 D352 F356	G320-L324 PolarHBondContact O-N 3.05Å; G320-L324 VanDerWaalsContact O-N 3.09Å; P321-L324 PolarHBondContact O-N 3.16Å; L324-L327 CarbonylContact O-C 3.58Å; L324-L327 PolarHBondContact O-N 2.93Å; L324-G328 PolarHBondContact O-N 3.02Å; L324-L342 HydrophobicContact CD2-CD1 3.97Å; L324-F348 HydrophobicContact CD1-CD1 3.75Å; L324-F348 HydrophobicContact CD1-CE1 3.74Å; L324-F348 HydrophobicContact CD2-CE1 4.47Å; L324-F348 HydrophobicContact CG-CE1 4.22Å; L324-D352 HydrophobicContact CD1-CB 3.76Å; L324-F356 HydrophobicContact CD2-CB 4.44Å; L324-F356 HydrophobicContact CD2-CD2 3.92Å; L324-F356 HydrophobicContact CD2-CE2 4.44Å; L324-F356 HydrophobicContact CD2-CG 4.18Å
325	K	86.8	Confident	88.6	Confident	138 Å²	138	35.1 Å²	35.1	60%	0.6	18%	0.183	S	C	*	.	H	α-helix	trans	-63.8	-44.4	176.3	-166.3	177.2	-176.3	177.7	0	112.1	P321 D322 S323 L327 G328 F329	P321-K325 PolarHBondContact O-N 3.27Å; D322-K325 PolarHBondContact O-N 3.06Å; S323-K325 VanDerWaalsContact C-N 3.3Å; S323-K325 PolarHBondContact O-N 3.02Å; K325-L327 VanDerWaalsContact C-N 3.34Å; K325-G328 PolarHBondContact O-N 3.29Å; K325-F329 HydrophobicContact CG-CE2 3.89Å; K325-F329 HydrophobicContact CG-CZ 4.37Å; K325-F329 WeakPolarHBondContact O-CD2 3.22Å; K325-F329 PolarHBondContact O-N 2.81Å
326	V	87.6	Confident	88.3	Confident	8 Å²	8	34 Å²	34	5%	0.048	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-40.4	175.1	174.5	0	0	0	0	111.5	A208 L211 A212 L215 D322 S323 G328 F329 S330	A208-V326 HydrophobicContact CB-CG2 3.82Å; A208-V326 WeakPolarHBondContact O-CG2 3.49Å; L211-V326 HydrophobicContact CB-CG1 4.39Å; L211-V326 HydrophobicContact CD2-CB 4.03Å; L211-V326 HydrophobicContact CD2-CG1 4.05Å; L211-V326 HydrophobicContact CG-CB 4.42Å; L211-V326 HydrophobicContact CG-CG1 3.92Å; A212-V326 HydrophobicContact CB-CG1 4.04Å; L215-V326 HydrophobicContact CD1-CG1 4.35Å; D322-V326 WeakPolarHBondContact O-CG2 3.32Å; D322-V326 PolarHBondContact O-N 3.39Å; S323-V326 PolarHBondContact O-N 3.32Å; V326-G328 VanDerWaalsContact C-N 3.31Å; V326-F329 PolarHBondContact O-N 2.78Å; V326-S330 PolarHBondContact O-N 3.24Å; V326-S330 PolarHBondContact O-OG 3.26Å
327	L	89.9	Confident	88.4	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.5	-39.4	172.5	-72.2	174.5	0	0	0	111.5	L215 L314 I316 S323 L324 K325 F329 S330 L331 L342 F356	L215-L327 HydrophobicContact CD1-CD2 4.03Å; L314-L327 HydrophobicContact CD2-CD2 3.88Å; I316-L327 HydrophobicContact CD1-CD1 3.85Å; I316-L327 HydrophobicContact CD1-CD2 4.31Å; I316-L327 HydrophobicContact CD1-CG 4.26Å; S323-L327 WeakPolarHBondContact O-CG 3.35Å; S323-L327 PolarHBondContact O-N 2.83Å; L324-L327 CarbonylContact O-C 3.58Å; L324-L327 PolarHBondContact O-N 2.93Å; K325-L327 VanDerWaalsContact C-N 3.34Å; L327-F329 PolarHBondContact O-N 3.05Å; L327-F329 VanDerWaalsContact O-N 3.12Å; L327-S330 WeakPolarHBondContact CA-OG 3.31Å; L327-S330 PolarHBondContact O-N 3.12Å; L327-S330 PolarHBondContact O-OG 3.36Å; L327-L331 WeakPolarHBondContact O-CB 3.44Å; L327-L331 PolarHBondContact O-N 3.19Å; L327-L342 HydrophobicContact CD1-CD1 4.2Å; L327-L342 HydrophobicContact CD1-CD2 3.61Å; L327-F356 HydrophobicContact CD1-CE2 4.35Å
328	G	87.9	Confident	88.6	Confident	21 Å²	21	32.9 Å²	32.9	22%	0.216	18%	0.18	C	C	.	.	H	α-helix	trans	-54.1	-32.7	175.8	0	0	0	0	0	113.4	L324 K325 V326 P332	L324-G328 PolarHBondContact O-N 3.02Å; K325-G328 PolarHBondContact O-N 3.29Å; V326-G328 VanDerWaalsContact C-N 3.31Å; G328-P332 WeakPolarHBondContact O-CD 3.41Å
329	F	84.9	Confident	89.1	Confident	76 Å²	76	33 Å²	33	33%	0.333	18%	0.182	S	C	.	.	H	α-helix	trans	-86.8	-25.7	177.5	-61.6	-52.1	0	0	0	115	N224 L227 K325 V326 L327	N224-F329 HydrophobicContact CB-CB 4.46Å; N224-F329 WeakPolarHBondContact ND2-CD1 3.37Å; N224-F329 WeakPolarHBondContact ND2-CG 3.5Å; L227-F329 HydrophobicContact CD1-CB 4.34Å; K325-F329 HydrophobicContact CG-CE2 3.89Å; K325-F329 HydrophobicContact CG-CZ 4.37Å; K325-F329 WeakPolarHBondContact O-CD2 3.22Å; K325-F329 PolarHBondContact O-N 2.81Å; V326-F329 PolarHBondContact O-N 2.78Å; L327-F329 PolarHBondContact O-N 3.05Å; L327-F329 VanDerWaalsContact O-N 3.12Å
330	S	87	Confident	89.5	Confident	5 Å²	5	32.9 Å²	32.9	4%	0.035	18%	0.181	C	C	.	.	H	α-helix	trans	-101.1	-39.5	-172.3	49	0	0	0	0	112.6	S220 V326 L327 P332 T333 F334	S220-S330 WeakPolarHBondContact CB-O 3.1Å; S220-S330 PolarHBondContact OG-O 3.46Å; V326-S330 PolarHBondContact O-N 3.24Å; V326-S330 PolarHBondContact O-OG 3.26Å; L327-S330 WeakPolarHBondContact CA-OG 3.31Å; L327-S330 PolarHBondContact O-N 3.12Å; L327-S330 PolarHBondContact O-OG 3.36Å; S330-P332 VanDerWaalsContact C-CD 3.44Å; S330-T333 PolarHBondContact O-N 2.78Å; S330-F334 PolarHBondContact O-N 3.22Å
331	L	90	Very high	90.1	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-59.5	-38.5	-173.7	-167.3	66.9	0	0	0	114.4	L327 T333 F334 L337 L340 F356 V359 L360 L363	L327-L331 WeakPolarHBondContact O-CB 3.44Å; L327-L331 PolarHBondContact O-N 3.19Å; L331-T333 PolarHBondContact O-N 2.77Å; L331-F334 HydrophobicContact CD1-CB 4.44Å; L331-F334 WeakPolarHBondContact O-CB 3.11Å; L331-F334 PolarHBondContact O-N 3.32Å; L331-L337 HydrophobicContact CD1-CD2 3.53Å; L331-L340 HydrophobicContact CD1-CD2 4.19Å; L331-L340 HydrophobicContact CD2-CD2 4.4Å; L331-F356 HydrophobicContact CD2-CD2 4.43Å; L331-F356 HydrophobicContact CD2-CE2 3.62Å; L331-F356 HydrophobicContact CD2-CZ 4.04Å; L331-V359 HydrophobicContact CB-CG1 3.73Å; L331-V359 HydrophobicContact CD2-CG1 3.91Å; L331-V359 HydrophobicContact CG-CG1 4.22Å; L331-L360 HydrophobicContact CD2-CD2 3.67Å; L331-L360 HydrophobicContact CD2-CG 4.07Å; L331-L363 HydrophobicContact CD1-CD2 3.95Å; L331-L363 HydrophobicContact CG-CD2 4.02Å; L331-L363 WeakPolarHBondContact O-CD1 3.4Å
332	P	89	Confident	90.7	Very high	26 Å²	26	30.1 Å²	30.1	17%	0.169	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-58	-23.7	-179.4	-27.7	37.2	0	0	0	114.6	G328 S330 F335 V359 Q362	G328-P332 WeakPolarHBondContact O-CD 3.41Å; S330-P332 VanDerWaalsContact C-CD 3.44Å; P332-F335 WeakPolarHBondContact O-CE1 3.4Å; P332-V359 HydrophobicContact CG-CG1 3.72Å; P332-Q362 HydrophobicContact CB-CB 4.38Å
333	T	86.6	Confident	91	Very high	31 Å²	31	28.6 Å²	28.6	19%	0.19	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-116.9	14.5	177.9	73.4	0	0	0	0	113.8	S220 Q221 Y222 S330 L331 F335	S220-T333 WeakPolarHBondContact CA-OG1 3.43Å; S220-T333 PolarHBondContact OG-OG1 3.49Å; Q221-T333 PolarHBondContact N-OG1 2.82Å; Y222-T333 WeakPolarHBondContact CB-OG1 3.46Å; Y222-T333 PolarHBondContact N-OG1 2.79Å; S330-T333 PolarHBondContact O-N 2.78Å; L331-T333 PolarHBondContact O-N 2.77Å; T333-F335 VanDerWaalsContact C-N 3.26Å; T333-F335 HydrophobicContact CG2-CZ 4.33Å; T333-F335 PolarHBondContact O-N 2.93Å
334	F	91.4	Very high	90.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.			trans	-87.6	60.8	-176.8	-152.2	157.6	0	0	0	111.5	L215 I311 L314 S330 L331 C336 L337	L215-F334 HydrophobicContact CD2-CE1 4.11Å; I311-F334 HydrophobicContact CB-CE2 4.29Å; I311-F334 HydrophobicContact CB-CZ 3.92Å; I311-F334 HydrophobicContact CG2-CZ 4.09Å; I311-F334 WeakPolarHBondContact O-CE2 3.38Å; L314-F334 HydrophobicContact CD2-CE1 4.39Å; S330-F334 PolarHBondContact O-N 3.22Å; L331-F334 HydrophobicContact CD1-CB 4.44Å; L331-F334 WeakPolarHBondContact O-CB 3.11Å; L331-F334 PolarHBondContact O-N 3.32Å; F334-C336 VanDerWaalsContact C-N 3.33Å; F334-C336 PolarHBondContact O-N 3.07Å; F334-L337 HydrophobicContact CB-CB 4.42Å; F334-L337 HydrophobicContact CD1-CD2 4.22Å; F334-L337 HydrophobicContact CD2-CB 3.77Å; F334-L337 HydrophobicContact CE1-CD1 4.3Å; F334-L337 HydrophobicContact CE2-CB 4.13Å; F334-L337 HydrophobicContact CE2-CD1 4.25Å; F334-L337 HydrophobicContact CG-CB 3.99Å; F334-L337 HydrophobicContact CG-CD2 4.37Å; F334-L337 HydrophobicContact CZ-CD1 4.09Å; F334-L337 VanDerWaalsContact O-CB 3.31Å; F334-L337 WeakPolarHBondContact O-CB 3.27Å; F334-L337 PolarHBondContact O-N 3.43Å; F334-L337 VanDerWaalsContact O-N 3.16Å
335	F	90.4	Very high	90.8	Very high	51 Å²	51	35.9 Å²	35.9	22%	0.224	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.5	-166.3	-53.9	-47.5	0	0	0	115.1	P332 T333 L337 L363 C368 S370	P332-F335 WeakPolarHBondContact O-CE1 3.4Å; T333-F335 VanDerWaalsContact C-N 3.26Å; T333-F335 HydrophobicContact CG2-CZ 4.33Å; T333-F335 PolarHBondContact O-N 2.93Å; F335-L337 VanDerWaalsContact C-N 3.31Å; F335-L363 HydrophobicContact CD1-CD1 3.85Å; F335-L363 HydrophobicContact CE1-CD1 4.26Å; F335-C368 HydrophobicContact CB-CB 4.16Å; F335-C368 HydrophobicContact CD1-CB 3.55Å; F335-C368 HydrophobicContact CD2-CB 4.42Å; F335-C368 HydrophobicContact CE1-CB 3.99Å; F335-C368 HydrophobicContact CG-CB 3.79Å; F335-S370 VanDerWaalsContact O-CB 3.25Å; F335-S370 WeakPolarHBondContact O-CB 3.35Å; F335-S370 PolarHBondContact O-N 3.31Å; F335-S370 PolarHBondContact O-OG 2.97Å
336	C	91.7	Very high	90.8	Very high	26 Å²	26	33 Å²	33	18%	0.176	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-5.3	178.6	61.1	0	0	0	0	113.9	F334 Q338	F334-C336 VanDerWaalsContact C-N 3.33Å; F334-C336 PolarHBondContact O-N 3.07Å; C336-Q338 PolarHBondContact O-N 3.29Å
337	L	95.1	Very high	90.8	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.			trans	-69.1	119.6	-178.9	-169.4	68.8	0	0	0	110.2	L314 L331 F334 F335 S339 L340 S370 L371	L314-L337 HydrophobicContact CB-CD1 3.93Å; L331-L337 HydrophobicContact CD1-CD2 3.53Å; F334-L337 HydrophobicContact CB-CB 4.42Å; F334-L337 HydrophobicContact CD1-CD2 4.22Å; F334-L337 HydrophobicContact CD2-CB 3.77Å; F334-L337 HydrophobicContact CE1-CD1 4.3Å; F334-L337 HydrophobicContact CE2-CB 4.13Å; F334-L337 HydrophobicContact CE2-CD1 4.25Å; F334-L337 HydrophobicContact CG-CB 3.99Å; F334-L337 HydrophobicContact CG-CD2 4.37Å; F334-L337 HydrophobicContact CZ-CD1 4.09Å; F334-L337 VanDerWaalsContact O-CB 3.31Å; F334-L337 WeakPolarHBondContact O-CB 3.27Å; F334-L337 PolarHBondContact O-N 3.43Å; F334-L337 VanDerWaalsContact O-N 3.16Å; F335-L337 VanDerWaalsContact C-N 3.31Å; L337-S339 WeakPolarHBondContact CD1-O 3.29Å; L337-L340 HydrophobicContact CD2-CB 4.13Å; L337-L340 HydrophobicContact CD2-CD1 4.44Å; L337-L340 HydrophobicContact CD2-CD2 4.38Å; L337-S370 CarbonylContact O-C 3.52Å; L337-L371 HydrophobicContact CD2-CD1 4.26Å; L337-L371 HydrophobicContact CG-CD1 4.21Å; L337-L371 WeakPolarHBondContact O-CA 3.36Å; L337-L371 PolarHBondContact O-N 3.35Å
338	Q	96.3	Very high	90.8	Very high	88 Å²	88	35.6 Å²	35.6	41%	0.411	19%	0.191	S	C	.	.			trans	-103	-32.9	179.4	-66.8	174.5	-4.3	0	0	112	T312 C336 S370 A372 H373	T312-Q338 PolarHBondContact O-N 2.93Å; C336-Q338 PolarHBondContact O-N 3.29Å; Q338-S370 WeakPolarHBondContact CA-O 3.21Å; Q338-A372 PolarHBondContact O-N 2.84Å; Q338-H373 PolarHBondContact O-N 2.97Å
339	S	97.8	Very high	90.8	Very high	20 Å²	20	42.4 Å²	42.4	14%	0.14	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131.2	-179	-174.2	0	0	0	0	112.2	T312 H313 L314 L337 H373	T312-S339 PolarHBondContact O-N 3.09Å; H313-S339 WeakPolarHBondContact CA-O 3.43Å; H313-S339 WeakPolarHBondContact CD2-CB 3.35Å; L314-S339 PolarHBondContact N-O 2.74Å; L337-S339 WeakPolarHBondContact CD1-O 3.29Å; S339-H373 WeakPolarHBondContact CA-O 3.44Å
340	L	97.5	Very high	91.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.9	174.7	-177.1	58.7	0	0	0	110.4	L314 L331 L337 L342 F356 L371 H373 L374 S375	L314-L340 HydrophobicContact CB-CD1 4.01Å; L314-L340 HydrophobicContact CD2-CD1 3.88Å; L314-L340 HydrophobicContact CG-CD1 4.02Å; L314-L340 CarbonylContact O-C 3.54Å; L314-L340 WeakPolarHBondContact O-CA 3.4Å; L331-L340 HydrophobicContact CD1-CD2 4.19Å; L331-L340 HydrophobicContact CD2-CD2 4.4Å; L337-L340 HydrophobicContact CD2-CB 4.13Å; L337-L340 HydrophobicContact CD2-CD1 4.44Å; L337-L340 HydrophobicContact CD2-CD2 4.38Å; L340-L342 HydrophobicContact CD1-CD2 3.83Å; L340-L342 HydrophobicContact CD1-CG 4.39Å; L340-L342 HydrophobicContact CD2-CD1 4.48Å; L340-L342 HydrophobicContact CG-CD2 4.15Å; L340-L342 HydrophobicContact CG-CG 4.17Å; L340-F356 HydrophobicContact CD2-CE2 4.25Å; L340-F356 HydrophobicContact CD2-CZ 3.72Å; L340-L371 HydrophobicContact CB-CD1 4.01Å; L340-H373 PolarHBondContact N-O 2.84Å; L340-L374 HydrophobicContact CB-CD1 4.11Å; L340-L374 HydrophobicContact CD2-CD1 4.22Å; L340-L374 HydrophobicContact CG-CD1 4.28Å; L340-L374 CarbonylContact O-C 3.55Å; L340-L374 WeakPolarHBondContact O-CA 3.46Å; L340-S375 PolarHBondContact O-N 3.01Å
341	S	97.2	Very high	91.2	Very high	24 Å²	24	48.5 Å²	48.5	17%	0.168	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	119.4	176.7	-62.6	0	0	0	0	110.8	L314 E315 I316 S375	L314-S341 PolarHBondContact O-N 3.27Å; E315-S341 CarbonylContact C-O 3.41Å; E315-S341 WeakPolarHBondContact CA-O 3.4Å; I316-S341 PolarHBondContact N-O 3.1Å; S341-S375 CarbonylContact C-O 3.53Å; S341-S375 WeakPolarHBondContact CA-O 3.47Å
342	L	95.7	Very high	91.2	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	107.8	-178.3	-55.4	-178.7	0	0	0	109.1	I316 C319 L324 L327 L340 F348 F356 S375 I376 G377	I316-L342 HydrophobicContact CB-CD2 4.14Å; I316-L342 HydrophobicContact CD1-CD2 3.93Å; I316-L342 HydrophobicContact CG1-CD2 4.11Å; C319-L342 HydrophobicContact CB-CB 4.34Å; L324-L342 HydrophobicContact CD2-CD1 3.97Å; L327-L342 HydrophobicContact CD1-CD1 4.2Å; L327-L342 HydrophobicContact CD1-CD2 3.61Å; L340-L342 HydrophobicContact CD1-CD2 3.83Å; L340-L342 HydrophobicContact CD1-CG 4.39Å; L340-L342 HydrophobicContact CD2-CD1 4.48Å; L340-L342 HydrophobicContact CG-CD2 4.15Å; L340-L342 HydrophobicContact CG-CG 4.17Å; L342-F348 HydrophobicContact CB-CZ 4.49Å; L342-F356 HydrophobicContact CD1-CE1 4.05Å; L342-F356 HydrophobicContact CD1-CE2 3.97Å; L342-F356 HydrophobicContact CD1-CZ 3.64Å; L342-S375 PolarHBondContact N-O 3.04Å; L342-I376 CarbonylContact O-C 3.54Å; L342-G377 PolarHBondContact O-N 3.3Å
343	H	91.9	Very high	91.3	Very high	62 Å²	62	48.9 Å²	48.9	29%	0.287	24%	0.243	S	C	.	.			trans	-105.8	129.8	174.5	-54.3	-82.9	0	0	0	109.2	I316 R317 T318 C319	I316-H343 PolarHBondContact O-N 2.91Å; R317-H343 CarbonylContact C-O 3.57Å; R317-H343 VanDerWaalsContact C-O 3.27Å; T318-H343 PolarHBondContact N-O 3.32Å; C319-H343 VanDerWaalsContact CB-O 3.29Å; C319-H343 WeakPolarHBondContact CB-O 3.12Å; C319-H343 PolarHBondContact N-O 3.47Å
344	S	86.6	Confident	91.6	Very high	17 Å²	17	50.7 Å²	50.7	12%	0.119	25%	0.252	C	S	.	.			trans	-114.2	147.2	175.7	178.2	0	0	0	0	110.2	C319 S346 L378	C319-S344 WeakPolarHBondContact O-CB 3.4Å; C319-S344 PolarHBondContact O-OG 2.82Å; S344-S346 VanDerWaalsContact C-N 3.28Å; S344-S346 WeakPolarHBondContact CB-O 3.48Å; S344-S346 PolarHBondContact OG-N 3.42Å; S344-S346 VanDerWaalsContact OG-N 3.1Å; S344-S346 PolarHBondContact OG-O 3.13Å; S344-L378 WeakPolarHBondContact O-CD1 3.41Å
345	K	84.6	Confident	91.7	Very high	159 Å²	159	57.3 Å²	57.3	69%	0.691	28%	0.283	S	S	*	.	S	Bend	trans	-75.8	-20.8	170.7	-67.2	174.3	-179.6	158.7	0	112
346	S	86.9	Confident	91.9	Very high	77 Å²	77	55.3 Å²	55.3	54%	0.538	27%	0.274	S	S	.	.	S	Bend	trans	-129.5	162.5	-178.1	60	0	0	0	0	111.4	S344 F348	S344-S346 VanDerWaalsContact C-N 3.28Å; S344-S346 WeakPolarHBondContact CB-O 3.48Å; S344-S346 PolarHBondContact OG-N 3.42Å; S344-S346 VanDerWaalsContact OG-N 3.1Å; S344-S346 PolarHBondContact OG-O 3.13Å; S346-F348 PolarHBondContact O-N 3.34Å
347	I	88	Confident	92	Very high	51 Å²	51	54.2 Å²	54.2	26%	0.262	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-59.9	132.4	175.1	-50.7	168.4	0	0	0	109.2	L378 P380 Q403 A405	I347-L378 WeakPolarHBondContact CA-O 3.39Å; I347-P380 HydrophobicContact CG2-CB 3.92Å; I347-Q403 HydrophobicContact CD1-CB 4.22Å; I347-Q403 HydrophobicContact CD1-CG 3.87Å; I347-Q403 WeakPolarHBondContact CD1-O 3.33Å; I347-Q403 HydrophobicContact CG1-CB 4.03Å; I347-Q403 HydrophobicContact CG1-CG 4.07Å; I347-A405 HydrophobicContact CD1-CB 4.2Å
348	F	89.4	Confident	92	Very high	12 Å²	12	55.6 Å²	55.6	5%	0.053	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-66.4	145.4	172.4	-74.3	-69.6	0	0	0	110.7	C319 L324 L342 S346 V353 I376 G377 L378 L379 P380	C319-F348 HydrophobicContact CB-CE1 4.4Å; C319-F348 HydrophobicContact CB-CZ 4.05Å; L324-F348 HydrophobicContact CD1-CD1 3.75Å; L324-F348 HydrophobicContact CD1-CE1 3.74Å; L324-F348 HydrophobicContact CD2-CE1 4.47Å; L324-F348 HydrophobicContact CG-CE1 4.22Å; L342-F348 HydrophobicContact CB-CZ 4.49Å; S346-F348 PolarHBondContact O-N 3.34Å; F348-V353 HydrophobicContact CB-CG2 3.58Å; F348-V353 HydrophobicContact CG-CG2 4.26Å; F348-I376 HydrophobicContact CD2-CG2 4.19Å; F348-I376 HydrophobicContact CE2-CG2 3.89Å; F348-G377 VanDerWaalsContact CD2-O 3.31Å; F348-G377 WeakPolarHBondContact CD2-O 3.39Å; F348-G377 WeakPolarHBondContact CE2-O 3.45Å; F348-L378 PolarHBondContact N-O 2.97Å; F348-L379 HydrophobicContact CD2-CD2 4.48Å; F348-P380 WeakPolarHBondContact O-CD 3.22Å
349	R	89.5	Confident	91.9	Very high	165 Å²	165	52.4 Å²	52.4	62%	0.623	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-73.6	143	171.3	-50.4	178.8	-159.6	170.8	7.2	108.7	L351 D352 V353	R349-L351 VanDerWaalsContact C-N 3.31Å; R349-L351 PolarHBondContact O-N 3.28Å; R349-D352 HydrophobicContact CB-CB 4.37Å; R349-D352 WeakPolarHBondContact CB-OD2 3.45Å; R349-D352 WeakPolarHBondContact CD-OD2 3.48Å; R349-D352 WeakPolarHBondContact CG-OD2 3.44Å; R349-D352 IonicContact NE-OD2 3.97Å; R349-D352 PolarHBondContact O-N 3.05Å; R349-V353 WeakPolarHBondContact O-CG2 3.25Å; R349-V353 PolarHBondContact O-N 3.05Å; R349-V353 VanDerWaalsContact O-N 3.17Å
350	E	89.5	Confident	91.8	Very high	86 Å²	86	51.4 Å²	51.4	40%	0.402	26%	0.261	S	S	.	.	H	α-helix	trans	-56.7	-46	179.9	-171	179.8	168.6	0	0	111.9	D352 V353 L354 P380 H381 L384	E350-D352 PolarHBondContact O-N 2.91Å; E350-V353 PolarHBondContact O-N 3.14Å; E350-V353 VanDerWaalsContact O-N 3.14Å; E350-L354 HydrophobicContact CG-CD1 4.22Å; E350-L354 HydrophobicContact CG-CG 4.44Å; E350-L354 WeakPolarHBondContact O-CG 3.09Å; E350-L354 PolarHBondContact O-N 2.98Å; E350-P380 HydrophobicContact CB-CG 4.39Å; E350-H381 IonicContact OE1-NE2 3.13Å; E350-L384 HydrophobicContact CG-CD2 4.27Å
351	L	89.9	Confident	91.6	Very high	123 Å²	123	55.9 Å²	55.9	64%	0.644	28%	0.281	S	S	*	.	H	α-helix	trans	-57.4	-45.1	177.4	-66.7	175.9	0	0	0	112.5	R349 V353 L354 E355	R349-L351 VanDerWaalsContact C-N 3.31Å; R349-L351 PolarHBondContact O-N 3.28Å; L351-V353 VanDerWaalsContact C-N 3.27Å; L351-V353 PolarHBondContact O-N 3.02Å; L351-L354 PolarHBondContact O-N 3.27Å; L351-E355 WeakPolarHBondContact O-CG 3.13Å; L351-E355 PolarHBondContact O-N 2.62Å
352	D	90.4	Very high	91.4	Very high	27 Å²	27	60.3 Å²	60.3	14%	0.144	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-37	179.5	-56.1	-20.5	0	0	0	111.1	L324 R349 E350 F356	L324-D352 HydrophobicContact CD1-CB 3.76Å; R349-D352 HydrophobicContact CB-CB 4.37Å; R349-D352 WeakPolarHBondContact CB-OD2 3.45Å; R349-D352 WeakPolarHBondContact CD-OD2 3.48Å; R349-D352 WeakPolarHBondContact CG-OD2 3.44Å; R349-D352 IonicContact NE-OD2 3.97Å; R349-D352 PolarHBondContact O-N 3.05Å; E350-D352 PolarHBondContact O-N 2.91Å; D352-F356 VanDerWaalsContact O-CB 3.24Å; D352-F356 WeakPolarHBondContact O-CB 3.33Å; D352-F356 PolarHBondContact O-N 3.46Å
353	V	91.8	Very high	91.3	Very high	6 Å²	6	60.3 Å²	60.3	4%	0.036	30%	0.299	C	S	.	.	H	α-helix	trans	-71.7	-39.4	176.8	-179	0	0	0	0	111.6	F348 R349 E350 L351 F356 A357 L379 L384 L388	F348-V353 HydrophobicContact CB-CG2 3.58Å; F348-V353 HydrophobicContact CG-CG2 4.26Å; R349-V353 WeakPolarHBondContact O-CG2 3.25Å; R349-V353 PolarHBondContact O-N 3.05Å; R349-V353 VanDerWaalsContact O-N 3.17Å; E350-V353 PolarHBondContact O-N 3.14Å; E350-V353 VanDerWaalsContact O-N 3.14Å; L351-V353 VanDerWaalsContact C-N 3.27Å; L351-V353 PolarHBondContact O-N 3.02Å; V353-F356 PolarHBondContact O-N 3.22Å; V353-A357 WeakPolarHBondContact O-CB 3.21Å; V353-A357 PolarHBondContact O-N 3Å; V353-L379 HydrophobicContact CB-CD2 4.47Å; V353-L379 HydrophobicContact CG1-CD2 3.88Å; V353-L379 HydrophobicContact CG2-CD2 3.72Å; V353-L384 HydrophobicContact CB-CD1 4.16Å; V353-L384 HydrophobicContact CG1-CB 4.38Å; V353-L384 HydrophobicContact CG1-CD1 4.02Å; V353-L384 HydrophobicContact CG1-CD2 4.3Å; V353-L384 HydrophobicContact CG1-CG 4.47Å; V353-L384 HydrophobicContact CG2-CD1 4.38Å; V353-L388 HydrophobicContact CG1-CD2 4.35Å
354	L	92.9	Very high	91.2	Very high	69 Å²	69	57.9 Å²	57.9	36%	0.361	29%	0.289	S	S	.	.	H	α-helix	trans	-65.9	-43	176.7	-67.9	177.3	0	0	0	111.5	E350 L351 A357 G358 L384 T387	E350-L354 HydrophobicContact CG-CD1 4.22Å; E350-L354 HydrophobicContact CG-CG 4.44Å; E350-L354 WeakPolarHBondContact O-CG 3.09Å; E350-L354 PolarHBondContact O-N 2.98Å; L351-L354 PolarHBondContact O-N 3.27Å; L354-A357 PolarHBondContact O-N 2.67Å; L354-G358 PolarHBondContact O-N 2.97Å; L354-L384 HydrophobicContact CD2-CD2 3.82Å; L354-L384 HydrophobicContact CG-CD2 4.35Å; L354-T387 HydrophobicContact CD2-CG2 3.91Å
355	E	92.8	Very high	91.5	Very high	140 Å²	140	62.6 Å²	62.6	65%	0.654	31%	0.313	S	S	*	.	H	α-helix	trans	-60.1	-47	173	-74.2	-178.2	-175.1	0	0	110.8	L351 A357 G358 V359	L351-E355 WeakPolarHBondContact O-CG 3.13Å; L351-E355 PolarHBondContact O-N 2.62Å; E355-A357 VanDerWaalsContact C-N 3.33Å; E355-A357 PolarHBondContact O-N 2.83Å; E355-G358 WeakPolarHBondContact O-CA 3.39Å; E355-G358 PolarHBondContact O-N 3.07Å; E355-G358 VanDerWaalsContact O-N 3.1Å; E355-V359 WeakPolarHBondContact O-CG2 3.24Å; E355-V359 PolarHBondContact O-N 3.38Å
356	F	94.4	Very high	91.6	Very high	9 Å²	9	57.4 Å²	57.4	4%	0.039	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-39.7	175.9	178	-103.1	0	0	0	112.8	L324 L327 L331 L340 L342 D352 V353 G358 V359 L360 I376 L388	L324-F356 HydrophobicContact CD2-CB 4.44Å; L324-F356 HydrophobicContact CD2-CD2 3.92Å; L324-F356 HydrophobicContact CD2-CE2 4.44Å; L324-F356 HydrophobicContact CD2-CG 4.18Å; L327-F356 HydrophobicContact CD1-CE2 4.35Å; L331-F356 HydrophobicContact CD2-CD2 4.43Å; L331-F356 HydrophobicContact CD2-CE2 3.62Å; L331-F356 HydrophobicContact CD2-CZ 4.04Å; L340-F356 HydrophobicContact CD2-CE2 4.25Å; L340-F356 HydrophobicContact CD2-CZ 3.72Å; L342-F356 HydrophobicContact CD1-CE1 4.05Å; L342-F356 HydrophobicContact CD1-CE2 3.97Å; L342-F356 HydrophobicContact CD1-CZ 3.64Å; D352-F356 VanDerWaalsContact O-CB 3.24Å; D352-F356 WeakPolarHBondContact O-CB 3.33Å; D352-F356 PolarHBondContact O-N 3.46Å; V353-F356 PolarHBondContact O-N 3.22Å; F356-G358 VanDerWaalsContact C-N 3.32Å; F356-G358 PolarHBondContact O-N 3.26Å; F356-V359 WeakPolarHBondContact O-CB 3.44Å; F356-V359 PolarHBondContact O-N 3Å; F356-L360 HydrophobicContact CD1-CD1 3.91Å; F356-L360 HydrophobicContact CD1-CG 4.35Å; F356-L360 HydrophobicContact CE1-CD1 3.37Å; F356-L360 HydrophobicContact CE1-CD2 4.48Å; F356-L360 HydrophobicContact CE1-CG 3.85Å; F356-L360 HydrophobicContact CZ-CD1 3.94Å; F356-L360 HydrophobicContact CZ-CD2 4.23Å; F356-L360 HydrophobicContact CZ-CG 3.96Å; F356-L360 PolarHBondContact O-N 2.84Å; F356-I376 HydrophobicContact CD1-CD1 4.45Å; F356-I376 HydrophobicContact CE1-CD1 3.91Å; F356-L388 HydrophobicContact CD1-CD2 4.29Å; F356-L388 HydrophobicContact CE1-CD2 4.48Å
357	A	94.9	Very high	91.4	Very high	3 Å²	3	55.5 Å²	55.5	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-38.9	173.5	0	0	0	0	0	111.5	V353 L354 E355 V359 L360 Q361 T387 L388 A391	V353-A357 WeakPolarHBondContact O-CB 3.21Å; V353-A357 PolarHBondContact O-N 3Å; L354-A357 PolarHBondContact O-N 2.67Å; E355-A357 VanDerWaalsContact C-N 3.33Å; E355-A357 PolarHBondContact O-N 2.83Å; A357-V359 VanDerWaalsContact C-N 3.3Å; A357-V359 PolarHBondContact O-N 3.26Å; A357-L360 WeakPolarHBondContact O-CB 3.48Å; A357-L360 PolarHBondContact O-N 3.05Å; A357-Q361 WeakPolarHBondContact O-CB 3.47Å; A357-Q361 PolarHBondContact O-N 2.79Å; A357-T387 HydrophobicContact CB-CG2 3.89Å; A357-L388 HydrophobicContact CB-CD2 4.33Å; A357-A391 HydrophobicContact CB-CB 4.1Å; A357-A391 WeakPolarHBondContact O-CB 3.38Å
358	G	94.5	Very high	91.3	Very high	29 Å²	29	56.6 Å²	56.6	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-39.1	172.5	0	0	0	0	0	112.9	L354 E355 F356 Q361 Q362	L354-G358 PolarHBondContact O-N 2.97Å; E355-G358 WeakPolarHBondContact O-CA 3.39Å; E355-G358 PolarHBondContact O-N 3.07Å; E355-G358 VanDerWaalsContact O-N 3.1Å; F356-G358 VanDerWaalsContact C-N 3.32Å; F356-G358 PolarHBondContact O-N 3.26Å; G358-Q361 WeakPolarHBondContact O-CB 3.41Å; G358-Q361 PolarHBondContact O-N 2.78Å; G358-Q362 WeakPolarHBondContact O-CG 3.21Å; G358-Q362 PolarHBondContact O-N 2.58Å
359	V	93.6	Very high	91.3	Very high	20 Å²	20	56.7 Å²	56.7	12%	0.121	30%	0.303	C	S	.	.	H	α-helix	trans	-67.9	-41.7	175.9	175.9	0	0	0	0	111.4	L331 P332 E355 F356 A357 Q361 Q362 L363	L331-V359 HydrophobicContact CB-CG1 3.73Å; L331-V359 HydrophobicContact CD2-CG1 3.91Å; L331-V359 HydrophobicContact CG-CG1 4.22Å; P332-V359 HydrophobicContact CG-CG1 3.72Å; E355-V359 WeakPolarHBondContact O-CG2 3.24Å; E355-V359 PolarHBondContact O-N 3.38Å; F356-V359 WeakPolarHBondContact O-CB 3.44Å; F356-V359 PolarHBondContact O-N 3Å; A357-V359 VanDerWaalsContact C-N 3.3Å; A357-V359 PolarHBondContact O-N 3.26Å; V359-Q361 VanDerWaalsContact C-N 3.29Å; V359-Q361 PolarHBondContact O-N 3.27Å; V359-Q362 WeakPolarHBondContact O-CB 3.38Å; V359-Q362 PolarHBondContact O-N 3.46Å; V359-L363 PolarHBondContact O-N 3.1Å; V359-L363 VanDerWaalsContact O-N 3.07Å
360	L	95	Very high	91.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.2	-40.7	173	-81.4	175.9	0	0	0	111.9	L331 F356 A357 L363 S364 L371 L374 L388 A391	L331-L360 HydrophobicContact CD2-CD2 3.67Å; L331-L360 HydrophobicContact CD2-CG 4.07Å; F356-L360 HydrophobicContact CD1-CD1 3.91Å; F356-L360 HydrophobicContact CD1-CG 4.35Å; F356-L360 HydrophobicContact CE1-CD1 3.37Å; F356-L360 HydrophobicContact CE1-CD2 4.48Å; F356-L360 HydrophobicContact CE1-CG 3.85Å; F356-L360 HydrophobicContact CZ-CD1 3.94Å; F356-L360 HydrophobicContact CZ-CD2 4.23Å; F356-L360 HydrophobicContact CZ-CG 3.96Å; F356-L360 PolarHBondContact O-N 2.84Å; A357-L360 WeakPolarHBondContact O-CB 3.48Å; A357-L360 PolarHBondContact O-N 3.05Å; L360-L363 PolarHBondContact O-N 3.49Å; L360-S364 PolarHBondContact O-N 2.92Å; L360-L371 HydrophobicContact CD2-CD2 3.63Å; L360-L374 HydrophobicContact CD1-CD2 3.99Å; L360-L388 HydrophobicContact CD1-CD2 4.04Å; L360-A391 CarbonylContact C-O 3.26Å; L360-A391 HydrophobicContact CB-CB 4.07Å
361	Q	94.6	Very high	91.8	Very high	94 Å²	94	47.9 Å²	47.9	44%	0.439	28%	0.276	S	S	.	.	H	α-helix	trans	-61.6	-44.7	175.8	-173.3	172.5	14.6	0	0	111.2	A357 G358 V359 L363 S364 D365 A391	A357-Q361 WeakPolarHBondContact O-CB 3.47Å; A357-Q361 PolarHBondContact O-N 2.79Å; G358-Q361 WeakPolarHBondContact O-CB 3.41Å; G358-Q361 PolarHBondContact O-N 2.78Å; V359-Q361 VanDerWaalsContact C-N 3.29Å; V359-Q361 PolarHBondContact O-N 3.27Å; Q361-L363 VanDerWaalsContact C-N 3.33Å; Q361-L363 PolarHBondContact O-N 3.22Å; Q361-S364 PolarHBondContact O-N 2.76Å; Q361-S364 VanDerWaalsContact O-N 3.13Å; Q361-D365 WeakPolarHBondContact O-CB 3.4Å; Q361-D365 PolarHBondContact O-N 2.95Å; Q361-A391 VanDerWaalsContact CA-O 3.25Å; Q361-A391 WeakPolarHBondContact CA-O 3.49Å; Q361-A391 HydrophobicContact CB-CB 4.13Å; Q361-A391 PolarHBondContact N-O 2.92Å
362	Q	93.1	Very high	92.1	Very high	117 Å²	117	43.1 Å²	43.1	55%	0.547	25%	0.254	S	S	.	.	H	α-helix	trans	-58.4	-43.3	174.4	-69.5	174.2	8	0	0	112.7	P332 G358 V359 S366	P332-Q362 HydrophobicContact CB-CB 4.38Å; G358-Q362 WeakPolarHBondContact O-CG 3.21Å; G358-Q362 PolarHBondContact O-N 2.58Å; V359-Q362 WeakPolarHBondContact O-CB 3.38Å; V359-Q362 PolarHBondContact O-N 3.46Å; Q362-S366 PolarHBondContact O-N 3.36Å
363	L	92.1	Very high	92.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-45.1	175.1	173.4	60	0	0	0	110.9	L331 F335 V359 L360 Q361 S366	L331-L363 HydrophobicContact CD1-CD2 3.95Å; L331-L363 HydrophobicContact CG-CD2 4.02Å; L331-L363 WeakPolarHBondContact O-CD1 3.4Å; F335-L363 HydrophobicContact CD1-CD1 3.85Å; F335-L363 HydrophobicContact CE1-CD1 4.26Å; V359-L363 PolarHBondContact O-N 3.1Å; V359-L363 VanDerWaalsContact O-N 3.07Å; L360-L363 PolarHBondContact O-N 3.49Å; Q361-L363 VanDerWaalsContact C-N 3.33Å; Q361-L363 PolarHBondContact O-N 3.22Å; L363-S366 WeakPolarHBondContact O-CB 3.38Å; L363-S366 PolarHBondContact O-N 3.36Å; L363-S366 PolarHBondContact O-OG 3.35Å
364	S	91.7	Very high	92.8	Very high	11 Å²	11	45.2 Å²	45.2	8%	0.077	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-44.7	178.9	-177.4	0	0	0	0	112.6	L360 Q361 S366 G367 A391 P393	L360-S364 PolarHBondContact O-N 2.92Å; Q361-S364 PolarHBondContact O-N 2.76Å; Q361-S364 VanDerWaalsContact O-N 3.13Å; S364-S366 PolarHBondContact O-N 2.84Å; S364-G367 PolarHBondContact O-N 3.32Å; S364-A391 WeakPolarHBondContact CB-O 3.39Å; S364-P393 WeakPolarHBondContact OG-CD 3.37Å
365	D	91.4	Very high	93	Very high	117 Å²	117	42.9 Å²	42.9	63%	0.626	25%	0.252	S	S	*	.	H	α-helix	trans	-66.1	-23	-177.7	-70.6	-11.1	0	0	0	112.4	Q361 G367	Q361-D365 WeakPolarHBondContact O-CB 3.4Å; Q361-D365 PolarHBondContact O-N 2.95Å; D365-G367 PolarHBondContact O-N 3.43Å; D365-G367 VanDerWaalsContact O-N 3.14Å
366	S	87	Confident	93.1	Very high	50 Å²	50	36.5 Å²	36.5	35%	0.35	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.4	172	78.4	0	0	0	0	113.6	Q362 L363 S364 C368	Q362-S366 PolarHBondContact O-N 3.36Å; L363-S366 WeakPolarHBondContact O-CB 3.38Å; L363-S366 PolarHBondContact O-N 3.36Å; L363-S366 PolarHBondContact O-OG 3.35Å; S364-S366 PolarHBondContact O-N 2.84Å; S366-C368 PolarHBondContact O-N 3.15Å; S366-C368 PolarHBondContact OG-N 3.25Å
367	G	83.8	Confident	92.9	Very high	37 Å²	37	36.1 Å²	36.1	38%	0.381	22%	0.221	S	C	.	.	S	Bend	trans	74	-15.6	-175.4	0	0	0	0	0	114.6	S364 D365 R394	S364-G367 PolarHBondContact O-N 3.32Å; D365-G367 PolarHBondContact O-N 3.43Å; D365-G367 VanDerWaalsContact O-N 3.14Å; G367-R394 PolarHBondContact O-NH1 3.28Å
368	C	85.4	Confident	92.7	Very high	73 Å²	73	36.9 Å²	36.9	49%	0.493	23%	0.225	S	C	.	.			trans	-90.7	-0.7	-177.9	-64.2	0	0	0	0	113.9	F335 S366 S370	F335-C368 HydrophobicContact CB-CB 4.16Å; F335-C368 HydrophobicContact CD1-CB 3.55Å; F335-C368 HydrophobicContact CD2-CB 4.42Å; F335-C368 HydrophobicContact CE1-CB 3.99Å; F335-C368 HydrophobicContact CG-CB 3.79Å; S366-C368 PolarHBondContact O-N 3.15Å; S366-C368 PolarHBondContact OG-N 3.25Å; C368-S370 PolarHBondContact O-N 2.95Å
369	S	89.6	Confident	92.5	Very high	15 Å²	15	35.5 Å²	35.5	11%	0.105	21%	0.21	C	C	.	.			trans	-63.2	126.4	179.1	-175.4	0	0	0	0	111.7	L371	S369-L371 PolarHBondContact OG-N 3.05Å
370	S	92.8	Very high	92.2	Very high	60 Å²	60	35.6 Å²	35.6	42%	0.42	21%	0.211	S	C	.	.			trans	-98.7	5.3	169.8	-54	0	0	0	0	112.7	F335 L337 Q338 C368 A372	F335-S370 VanDerWaalsContact O-CB 3.25Å; F335-S370 WeakPolarHBondContact O-CB 3.35Å; F335-S370 PolarHBondContact O-N 3.31Å; F335-S370 PolarHBondContact O-OG 2.97Å; L337-S370 CarbonylContact O-C 3.52Å; Q338-S370 WeakPolarHBondContact CA-O 3.21Å; C368-S370 PolarHBondContact O-N 2.95Å; S370-A372 PolarHBondContact O-N 3.46Å; S370-A372 VanDerWaalsContact O-N 3.13Å
371	L	96	Very high	91.8	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.031	23%	0.225	C	C	.	.			trans	-69.5	111.5	-172.2	-174.3	70	0	0	0	110.3	L337 L340 L360 S369 L395	L337-L371 HydrophobicContact CD2-CD1 4.26Å; L337-L371 HydrophobicContact CG-CD1 4.21Å; L337-L371 WeakPolarHBondContact O-CA 3.36Å; L337-L371 PolarHBondContact O-N 3.35Å; L340-L371 HydrophobicContact CB-CD1 4.01Å; L360-L371 HydrophobicContact CD2-CD2 3.63Å; S369-L371 PolarHBondContact OG-N 3.05Å; L371-L395 HydrophobicContact CD2-CD2 4.31Å; L371-L395 HydrophobicContact CG-CD2 4.06Å
372	A	96.8	Very high	91.3	Very high	22 Å²	22	34.8 Å²	34.8	18%	0.182	21%	0.208	C	C	.	.			trans	-109.1	-28.7	-179.7	0	0	0	0	0	112.3	Q338 S370 T396 S397	Q338-A372 PolarHBondContact O-N 2.84Å; S370-A372 PolarHBondContact O-N 3.46Å; S370-A372 VanDerWaalsContact O-N 3.13Å; A372-T396 PolarHBondContact O-N 3.38Å; A372-T396 PolarHBondContact O-OG1 2.77Å; A372-S397 PolarHBondContact O-N 2.85Å
373	H	97.8	Very high	90.9	Very high	74 Å²	74	29.6 Å²	29.6	34%	0.343	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.3	-173.3	-52.1	-59.8	0	0	0	111.3	Q338 S339 L340 S397	Q338-H373 PolarHBondContact O-N 2.97Å; S339-H373 WeakPolarHBondContact CA-O 3.44Å; L340-H373 PolarHBondContact N-O 2.84Å; H373-S397 WeakPolarHBondContact ND1-CB 3.04Å
374	L	98.1	Very high	90.8	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.1	176.1	-176.7	61.7	0	0	0	110.3	L340 L360 I376 L395 S397 L398 C399	L340-L374 HydrophobicContact CB-CD1 4.11Å; L340-L374 HydrophobicContact CD2-CD1 4.22Å; L340-L374 HydrophobicContact CG-CD1 4.28Å; L340-L374 CarbonylContact O-C 3.55Å; L340-L374 WeakPolarHBondContact O-CA 3.46Å; L360-L374 HydrophobicContact CD1-CD2 3.99Å; L374-I376 HydrophobicContact CD1-CD1 4.02Å; L374-I376 HydrophobicContact CD1-CG1 3.97Å; L374-I376 HydrophobicContact CD2-CD1 3.85Å; L374-I376 HydrophobicContact CD2-CG1 4.48Å; L374-I376 HydrophobicContact CG-CD1 3.95Å; L374-I376 HydrophobicContact CG-CG1 4.03Å; L374-L395 HydrophobicContact CB-CD1 4.02Å; L374-L395 HydrophobicContact CB-CD2 3.86Å; L374-L395 HydrophobicContact CD2-CD1 3.93Å; L374-S397 PolarHBondContact N-O 2.85Å; L374-L398 HydrophobicContact CB-CD1 4.03Å; L374-L398 HydrophobicContact CD2-CD1 4.06Å; L374-L398 HydrophobicContact CG-CD1 4.1Å; L374-L398 CarbonylContact O-C 3.54Å; L374-L398 WeakPolarHBondContact O-CA 3.13Å; L374-C399 PolarHBondContact O-N 2.82Å
375	S	97.6	Very high	90.7	Very high	20 Å²	20	29.2 Å²	29.2	14%	0.14	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.3	171.5	-177.9	0	0	0	0	109.9	L340 S341 L342 C399	L340-S375 PolarHBondContact O-N 3.01Å; S341-S375 CarbonylContact C-O 3.53Å; S341-S375 WeakPolarHBondContact CA-O 3.47Å; L342-S375 PolarHBondContact N-O 3.04Å; S375-C399 CarbonylContact C-O 3.26Å; S375-C399 WeakPolarHBondContact CA-O 3.3Å
376	I	95.4	Very high	90.6	Very high	6 Å²	6	25.8 Å²	25.8	3%	0.031	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	122	179.2	-59.6	171.8	0	0	0	109.3	L342 F348 F356 L374 L379 L388 C399 V400 E401	L342-I376 CarbonylContact O-C 3.54Å; F348-I376 HydrophobicContact CD2-CG2 4.19Å; F348-I376 HydrophobicContact CE2-CG2 3.89Å; F356-I376 HydrophobicContact CD1-CD1 4.45Å; F356-I376 HydrophobicContact CE1-CD1 3.91Å; L374-I376 HydrophobicContact CD1-CD1 4.02Å; L374-I376 HydrophobicContact CD1-CG1 3.97Å; L374-I376 HydrophobicContact CD2-CD1 3.85Å; L374-I376 HydrophobicContact CD2-CG1 4.48Å; L374-I376 HydrophobicContact CG-CD1 3.95Å; L374-I376 HydrophobicContact CG-CG1 4.03Å; I376-L379 HydrophobicContact CG2-CD1 4.36Å; I376-L379 HydrophobicContact CG2-CD2 3.67Å; I376-L379 HydrophobicContact CG2-CG 3.92Å; I376-L388 HydrophobicContact CD1-CD1 3.66Å; I376-L388 HydrophobicContact CD1-CD2 3.68Å; I376-L388 HydrophobicContact CD1-CG 4.29Å; I376-C399 PolarHBondContact N-O 3.29Å; I376-V400 WeakPolarHBondContact O-CA 3.37Å; I376-E401 PolarHBondContact O-N 2.98Å; I376-E401 VanDerWaalsContact O-N 3.08Å
377	G	89.8	Confident	90.8	Very high	2 Å²	2	25.8 Å²	25.8	2%	0.021	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	173.6	175	0	0	0	0	0	113	L342 F348 L379 E401	L342-G377 PolarHBondContact O-N 3.3Å; F348-G377 VanDerWaalsContact CD2-O 3.31Å; F348-G377 WeakPolarHBondContact CD2-O 3.39Å; F348-G377 WeakPolarHBondContact CE2-O 3.45Å; G377-L379 PolarHBondContact O-N 3.23Å; G377-E401 CarbonylContact C-O 3.55Å
378	L	89.9	Confident	91.3	Very high	18 Å²	18	24 Å²	24	9%	0.094	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	17.1	63.1	170.8	-51.8	-176.8	0	0	0	117.4	S344 I347 F348 E401 Q403 I436	S344-L378 WeakPolarHBondContact O-CD1 3.41Å; I347-L378 WeakPolarHBondContact CA-O 3.39Å; F348-L378 PolarHBondContact N-O 2.97Å; L378-E401 CarbonylContact C-O 3.57Å; L378-E401 WeakPolarHBondContact CA-O 3.47Å; L378-E401 PolarHBondContact N-O 3.18Å; L378-E401 VanDerWaalsContact N-O 3.16Å; L378-Q403 HydrophobicContact CD2-CB 4.07Å; L378-I436 HydrophobicContact CD2-CD1 3.61Å
379	L	90.8	Very high	91.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	147.2	169.2	-70.2	176.6	0	0	0	110.9	F348 V353 I376 G377 L384 L388 V400 E401 F402 Q403	F348-L379 HydrophobicContact CD2-CD2 4.48Å; V353-L379 HydrophobicContact CB-CD2 4.47Å; V353-L379 HydrophobicContact CG1-CD2 3.88Å; V353-L379 HydrophobicContact CG2-CD2 3.72Å; I376-L379 HydrophobicContact CG2-CD1 4.36Å; I376-L379 HydrophobicContact CG2-CD2 3.67Å; I376-L379 HydrophobicContact CG2-CG 3.92Å; G377-L379 PolarHBondContact O-N 3.23Å; L379-L384 HydrophobicContact CD2-CD1 4.43Å; L379-L388 HydrophobicContact CD1-CD1 3.87Å; L379-V400 HydrophobicContact CD1-CB 4.08Å; L379-V400 HydrophobicContact CD1-CG1 3.76Å; L379-E401 PolarHBondContact N-O 3.48Å; L379-F402 HydrophobicContact CB-CD1 3.5Å; L379-F402 VanDerWaalsContact CB-CD1 3.5Å; L379-F402 HydrophobicContact CB-CE1 3.59Å; L379-F402 HydrophobicContact CD1-CD1 4.31Å; L379-F402 HydrophobicContact CD1-CE1 3.57Å; L379-F402 HydrophobicContact CD1-CZ 4.05Å; L379-F402 HydrophobicContact CG-CE1 4.22Å; L379-F402 WeakPolarHBondContact O-CA 3.46Å; L379-Q403 PolarHBondContact O-N 3.42Å
380	P	88	Confident	91.8	Very high	22 Å²	22	23.1 Å²	23.1	14%	0.143	13%	0.132	C	C	.	.	S	Bend	trans	-72.1	-30.5	-175.9	26.7	-35.5	0	0	0	114.3	I347 F348 E350 L384 T404	I347-P380 HydrophobicContact CG2-CB 3.92Å; F348-P380 WeakPolarHBondContact O-CD 3.22Å; E350-P380 HydrophobicContact CB-CG 4.39Å; P380-L384 HydrophobicContact CG-CD1 3.39Å; P380-T404 WeakPolarHBondContact O-CA 3.18Å
381	H	85.9	Confident	91.9	Very high	64 Å²	64	20.4 Å²	20.4	30%	0.296	11%	0.113	S	C	.	.			trans	-158.2	159.2	176.2	61.2	96.7	0	0	0	112.6	E350 G383 L384 F402	E350-H381 IonicContact OE1-NE2 3.13Å; H381-G383 VanDerWaalsContact C-N 3.26Å; H381-G383 PolarHBondContact ND1-N 2.9Å; H381-G383 PolarHBondContact O-N 3.13Å; H381-L384 PolarHBondContact O-N 3.27Å; H381-F402 VanDerWaalsContact C-CD1 3.47Å; H381-F402 WeakPolarHBondContact O-CD1 3.47Å; H381-F402 WeakPolarHBondContact O-CE1 3.42Å
382	V	85	Confident	91.7	Very high	13 Å²	13	20.4 Å²	20.4	8%	0.079	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-28.5	-174.7	-176.4	0	0	0	0	113.1	L384 M385 F402 F444	V382-L384 PolarHBondContact O-N 2.8Å; V382-M385 HydrophobicContact CG1-CE 4.24Å; V382-M385 WeakPolarHBondContact O-CB 3.32Å; V382-M385 PolarHBondContact O-N 2.91Å; V382-F402 VanDerWaalsContact CA-CE1 3.5Å; V382-F402 HydrophobicContact CG2-CD1 4.36Å; V382-F402 HydrophobicContact CG2-CD2 4.2Å; V382-F402 HydrophobicContact CG2-CE2 4.39Å; V382-F402 HydrophobicContact CG2-CG 4.19Å; V382-F444 HydrophobicContact CG1-CB 4.1Å
383	G	83.9	Confident	91.4	Very high	8 Å²	8	21.9 Å²	21.9	8%	0.082	12%	0.121	C	C	.	.	H	α-helix	trans	-56.8	-32.3	179.5	0	0	0	0	0	114.2	H381 M385 K386	H381-G383 VanDerWaalsContact C-N 3.26Å; H381-G383 PolarHBondContact ND1-N 2.9Å; H381-G383 PolarHBondContact O-N 3.13Å; G383-M385 PolarHBondContact O-N 3.06Å; G383-K386 WeakPolarHBondContact O-CB 3.42Å; G383-K386 PolarHBondContact O-N 3.25Å; G383-K386 VanDerWaalsContact O-N 3.09Å
384	L	89.5	Confident	91.1	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-64.7	-22.6	178.3	-67.9	172.3	0	0	0	113.5	E350 V353 L354 L379 P380 H381 V382 K386 T387 L388	E350-L384 HydrophobicContact CG-CD2 4.27Å; V353-L384 HydrophobicContact CB-CD1 4.16Å; V353-L384 HydrophobicContact CG1-CB 4.38Å; V353-L384 HydrophobicContact CG1-CD1 4.02Å; V353-L384 HydrophobicContact CG1-CD2 4.3Å; V353-L384 HydrophobicContact CG1-CG 4.47Å; V353-L384 HydrophobicContact CG2-CD1 4.38Å; L354-L384 HydrophobicContact CD2-CD2 3.82Å; L354-L384 HydrophobicContact CG-CD2 4.35Å; L379-L384 HydrophobicContact CD2-CD1 4.43Å; P380-L384 HydrophobicContact CG-CD1 3.39Å; H381-L384 PolarHBondContact O-N 3.27Å; V382-L384 PolarHBondContact O-N 2.8Å; L384-K386 PolarHBondContact O-N 2.95Å; L384-T387 WeakPolarHBondContact O-CB 3.34Å; L384-T387 PolarHBondContact O-N 3.3Å; L384-T387 VanDerWaalsContact O-N 3.16Å; L384-L388 WeakPolarHBondContact O-CG 3.46Å; L384-L388 PolarHBondContact O-N 3.41Å
385	M	90.9	Very high	91	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-56.6	-42.4	172.5	-173.3	170.5	68.9	0	0	111.6	V382 G383 T387 L388 L389 L398 V400 F402 L431 V433 L445 V448	V382-M385 HydrophobicContact CG1-CE 4.24Å; V382-M385 WeakPolarHBondContact O-CB 3.32Å; V382-M385 PolarHBondContact O-N 2.91Å; G383-M385 PolarHBondContact O-N 3.06Å; M385-T387 VanDerWaalsContact C-N 3.35Å; M385-L388 PolarHBondContact O-N 2.8Å; M385-L389 HydrophobicContact CG-CD1 4.11Å; M385-L389 WeakPolarHBondContact O-CG 3.34Å; M385-L389 PolarHBondContact O-N 3.01Å; M385-L398 HydrophobicContact CG-CD2 3.73Å; M385-L398 HydrophobicContact SD-CD2 4.46Å; M385-V400 HydrophobicContact CG-CG2 4.41Å; M385-V400 HydrophobicContact SD-CG2 3.97Å; M385-F402 HydrophobicContact CB-CZ 4.14Å; M385-L431 HydrophobicContact SD-CD1 4.11Å; M385-V433 HydrophobicContact SD-CG2 3.82Å; M385-L445 HydrophobicContact CE-CD1 3.93Å; M385-V448 HydrophobicContact CE-CB 3.88Å; M385-V448 HydrophobicContact CE-CG1 4.13Å; M385-V448 HydrophobicContact CE-CG2 3.68Å
386	K	89.1	Confident	91	Very high	45 Å²	45	25.4 Å²	25.4	20%	0.196	13%	0.132	C	C	.	.	H	α-helix	trans	-65	-42	178	-176.1	178.5	176.5	-178.7	0	110.6	G383 L384 L389 N390	G383-K386 WeakPolarHBondContact O-CB 3.42Å; G383-K386 PolarHBondContact O-N 3.25Å; G383-K386 VanDerWaalsContact O-N 3.09Å; L384-K386 PolarHBondContact O-N 2.95Å; K386-L389 PolarHBondContact O-N 2.85Å; K386-N390 WeakPolarHBondContact O-CB 3.21Å; K386-N390 PolarHBondContact O-N 2.88Å; K386-N390 PolarHBondContact O-ND2 3.35Å
387	T	91.5	Very high	91.1	Very high	50 Å²	50	26.4 Å²	26.4	31%	0.307	14%	0.14	S	C	.	.	H	α-helix	trans	-59.9	-47.1	176.3	-49.9	0	0	0	0	111.5	L354 A357 L384 M385 N390 A391	L354-T387 HydrophobicContact CD2-CG2 3.91Å; A357-T387 HydrophobicContact CB-CG2 3.89Å; L384-T387 WeakPolarHBondContact O-CB 3.34Å; L384-T387 PolarHBondContact O-N 3.3Å; L384-T387 VanDerWaalsContact O-N 3.16Å; M385-T387 VanDerWaalsContact C-N 3.35Å; T387-N390 PolarHBondContact O-N 3.37Å; T387-A391 WeakPolarHBondContact O-CB 3.39Å; T387-A391 PolarHBondContact O-N 2.9Å
388	L	94.1	Very high	91.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.7	-43.4	179.4	-68.5	164.5	0	0	0	112.5	V353 F356 A357 L360 I376 L379 L384 M385 N390 A391 S392	V353-L388 HydrophobicContact CG1-CD2 4.35Å; F356-L388 HydrophobicContact CD1-CD2 4.29Å; F356-L388 HydrophobicContact CE1-CD2 4.48Å; A357-L388 HydrophobicContact CB-CD2 4.33Å; L360-L388 HydrophobicContact CD1-CD2 4.04Å; I376-L388 HydrophobicContact CD1-CD1 3.66Å; I376-L388 HydrophobicContact CD1-CD2 3.68Å; I376-L388 HydrophobicContact CD1-CG 4.29Å; L379-L388 HydrophobicContact CD1-CD1 3.87Å; L384-L388 WeakPolarHBondContact O-CG 3.46Å; L384-L388 PolarHBondContact O-N 3.41Å; M385-L388 PolarHBondContact O-N 2.8Å; L388-N390 VanDerWaalsContact C-N 3.33Å; L388-N390 PolarHBondContact O-N 3.05Å; L388-A391 PolarHBondContact O-N 3.28Å; L388-S392 PolarHBondContact O-N 3.48Å; L388-S392 VanDerWaalsContact O-N 3.1Å
389	L	93.8	Very high	91.9	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-65.9	-36.3	176.8	-73.8	167.7	0	0	0	112.3	M385 K386 S392 L398 L426 L428 V448	M385-L389 HydrophobicContact CG-CD1 4.11Å; M385-L389 WeakPolarHBondContact O-CG 3.34Å; M385-L389 PolarHBondContact O-N 3.01Å; K386-L389 PolarHBondContact O-N 2.85Å; L389-S392 CarbonylContact O-C 3.58Å; L389-S392 VanDerWaalsContact O-C 3.26Å; L389-S392 PolarHBondContact O-N 2.9Å; L389-L398 HydrophobicContact CD1-CD2 4.07Å; L389-L398 HydrophobicContact CD2-CD2 3.81Å; L389-L398 HydrophobicContact CG-CD2 3.8Å; L389-L426 HydrophobicContact CB-CD1 4.23Å; L389-L426 HydrophobicContact CD1-CD1 4.01Å; L389-L426 HydrophobicContact CD2-CD1 4.37Å; L389-L426 HydrophobicContact CG-CD1 4.45Å; L389-L428 HydrophobicContact CD2-CD1 4.3Å; L389-L428 HydrophobicContact CD2-CD2 4.4Å; L389-V448 HydrophobicContact CD1-CB 4.29Å; L389-V448 HydrophobicContact CD1-CG1 3.47Å; L389-V448 VanDerWaalsContact CD1-CG1 3.47Å; L389-V448 HydrophobicContact CD1-CG2 3.77Å
390	N	91.9	Very high	92.1	Very high	68 Å²	68	26.8 Å²	26.8	36%	0.364	14%	0.143	S	C	.	.	H	α-helix	trans	-69.9	-34.2	175.1	-70.8	-12.1	0	0	0	112.1	K386 T387 L388 S392 R451	K386-N390 WeakPolarHBondContact O-CB 3.21Å; K386-N390 PolarHBondContact O-N 2.88Å; K386-N390 PolarHBondContact O-ND2 3.35Å; T387-N390 PolarHBondContact O-N 3.37Å; L388-N390 VanDerWaalsContact C-N 3.33Å; L388-N390 PolarHBondContact O-N 3.05Å; N390-S392 VanDerWaalsContact C-N 3.29Å; N390-S392 PolarHBondContact O-N 3.32Å; N390-R451 PolarHBondContact OD1-NH1 2.86Å; N390-R451 PolarHBondContact OD1-NH2 2.99Å; N390-R451 VanDerWaalsContact OD1-NH2 3.14Å
391	A	93.6	Very high	92.4	Very high	3 Å²	3	28 Å²	28	3%	0.025	15%	0.147	C	C	.	.	H	α-helix	trans	-71.8	-20.5	175	0	0	0	0	0	113.4	A357 L360 Q361 S364 T387 L388	A357-A391 HydrophobicContact CB-CB 4.1Å; A357-A391 WeakPolarHBondContact O-CB 3.38Å; L360-A391 CarbonylContact C-O 3.26Å; L360-A391 HydrophobicContact CB-CB 4.07Å; Q361-A391 VanDerWaalsContact CA-O 3.25Å; Q361-A391 WeakPolarHBondContact CA-O 3.49Å; Q361-A391 HydrophobicContact CB-CB 4.13Å; Q361-A391 PolarHBondContact N-O 2.92Å; S364-A391 WeakPolarHBondContact CB-O 3.39Å; T387-A391 WeakPolarHBondContact O-CB 3.39Å; T387-A391 PolarHBondContact O-N 2.9Å; L388-A391 PolarHBondContact O-N 3.28Å
392	S	92.8	Very high	92.5	Very high	6 Å²	6	25 Å²	25	4%	0.042	13%	0.133	C	C	.	.			trans	-141.1	73.9	179.9	-69.4	0	0	0	0	110.9	L388 L389 N390 R394 L395	L388-S392 PolarHBondContact O-N 3.48Å; L388-S392 VanDerWaalsContact O-N 3.1Å; L389-S392 CarbonylContact O-C 3.58Å; L389-S392 VanDerWaalsContact O-C 3.26Å; L389-S392 PolarHBondContact O-N 2.9Å; N390-S392 VanDerWaalsContact C-N 3.29Å; N390-S392 PolarHBondContact O-N 3.32Å; S392-R394 PolarHBondContact O-N 3.25Å; S392-R394 VanDerWaalsContact O-N 3.09Å; S392-L395 VanDerWaalsContact O-CG 3.32Å; S392-L395 WeakPolarHBondContact O-CG 3.4Å; S392-L395 PolarHBondContact O-N 2.97Å
393	P	90.6	Very high	92.5	Very high	53 Å²	53	26.7 Å²	26.7	34%	0.344	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-10.6	-173.9	27.4	-37.1	0	0	0	114.5	S364 P427	S364-P393 WeakPolarHBondContact OG-CD 3.37Å; P393-P427 WeakPolarHBondContact O-CD 3.5Å; P393-P427 WeakPolarHBondContact O-CG 3.38Å
394	R	91.8	Very high	91.7	Very high	134 Å²	134	28.4 Å²	28.4	51%	0.506	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	0.5	178.4	-63.9	-176	180	178.2	1.7	114.1	G367 S392 T396	G367-R394 PolarHBondContact O-NH1 3.28Å; S392-R394 PolarHBondContact O-N 3.25Å; S392-R394 VanDerWaalsContact O-N 3.09Å; R394-T396 PolarHBondContact O-N 3.14Å
395	L	95.6	Very high	90.2	Very high	3 Å²	3	31 Å²	31	2%	0.016	17%	0.171	C	C	.	.			trans	-63.6	130.9	-179.4	-74.4	171.8	0	0	0	111.6	L371 L374 S392	L371-L395 HydrophobicContact CD2-CD2 4.31Å; L371-L395 HydrophobicContact CG-CD2 4.06Å; L374-L395 HydrophobicContact CB-CD1 4.02Å; L374-L395 HydrophobicContact CB-CD2 3.86Å; L374-L395 HydrophobicContact CD2-CD1 3.93Å; S392-L395 VanDerWaalsContact O-CG 3.32Å; S392-L395 WeakPolarHBondContact O-CG 3.4Å; S392-L395 PolarHBondContact O-N 2.97Å
396	T	97.2	Very high	88.4	Confident	35 Å²	35	37.9 Å²	37.9	22%	0.215	21%	0.206	C	C	.	.	S	Bend	trans	-100.4	-19.9	173.7	62.4	0	0	0	0	111.9	A372 R394 E429 K430	A372-T396 PolarHBondContact O-N 3.38Å; A372-T396 PolarHBondContact O-OG1 2.77Å; R394-T396 PolarHBondContact O-N 3.14Å; T396-E429 PolarHBondContact O-N 2.88Å; T396-K430 PolarHBondContact O-N 3.05Å
397	S	98.2	Very high	85.9	Confident	26 Å²	26	47.2 Å²	47.2	18%	0.182	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	130.3	177	-171.8	0	0	0	0	112.4	A372 H373 L374 K430	A372-S397 PolarHBondContact O-N 2.85Å; H373-S397 WeakPolarHBondContact ND1-CB 3.04Å; L374-S397 PolarHBondContact N-O 2.85Å; S397-K430 WeakPolarHBondContact CA-O 3.19Å
398	L	98	Very high	83.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.8	173.2	-176.8	65.1	0	0	0	111.1	L374 M385 L389 V400 L428 K430 L431 T432	L374-L398 HydrophobicContact CB-CD1 4.03Å; L374-L398 HydrophobicContact CD2-CD1 4.06Å; L374-L398 HydrophobicContact CG-CD1 4.1Å; L374-L398 CarbonylContact O-C 3.54Å; L374-L398 WeakPolarHBondContact O-CA 3.13Å; M385-L398 HydrophobicContact CG-CD2 3.73Å; M385-L398 HydrophobicContact SD-CD2 4.46Å; L389-L398 HydrophobicContact CD1-CD2 4.07Å; L389-L398 HydrophobicContact CD2-CD2 3.81Å; L389-L398 HydrophobicContact CG-CD2 3.8Å; L398-V400 HydrophobicContact CD1-CG1 3.89Å; L398-V400 HydrophobicContact CD2-CG1 4.25Å; L398-V400 HydrophobicContact CG-CG1 3.99Å; L398-L428 HydrophobicContact CB-CD1 4.06Å; L398-K430 PolarHBondContact N-O 3Å; L398-L431 HydrophobicContact CB-CD1 4.13Å; L398-L431 HydrophobicContact CD2-CD1 4.18Å; L398-L431 HydrophobicContact CG-CD1 4.34Å; L398-L431 CarbonylContact O-C 3.5Å; L398-L431 WeakPolarHBondContact O-CA 3.42Å; L398-T432 PolarHBondContact O-N 3.08Å
399	C	97.6	Very high	80.5	Confident	29 Å²	29	52.6 Å²	52.6	20%	0.196	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	121.4	170.2	179.3	0	0	0	0	109.4	L374 S375 I376 T432	L374-C399 PolarHBondContact O-N 2.82Å; S375-C399 CarbonylContact C-O 3.26Å; S375-C399 WeakPolarHBondContact CA-O 3.3Å; I376-C399 PolarHBondContact N-O 3.29Å; C399-T432 CarbonylContact C-O 3.57Å; C399-T432 WeakPolarHBondContact CA-O 3.42Å
400	V	95.1	Very high	78.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.7	-177.9	-75.2	0	0	0	0	110.9	I376 L379 M385 L398 F402 T432 V433 K434	I376-V400 WeakPolarHBondContact O-CA 3.37Å; L379-V400 HydrophobicContact CD1-CB 4.08Å; L379-V400 HydrophobicContact CD1-CG1 3.76Å; M385-V400 HydrophobicContact CG-CG2 4.41Å; M385-V400 HydrophobicContact SD-CG2 3.97Å; L398-V400 HydrophobicContact CD1-CG1 3.89Å; L398-V400 HydrophobicContact CD2-CG1 4.25Å; L398-V400 HydrophobicContact CG-CG1 3.99Å; V400-F402 HydrophobicContact CB-CE2 3.83Å; V400-F402 HydrophobicContact CB-CZ 3.75Å; V400-F402 HydrophobicContact CG2-CE2 3.42Å; V400-F402 VanDerWaalsContact CG2-CE2 3.42Å; V400-F402 HydrophobicContact CG2-CZ 3.56Å; V400-T432 PolarHBondContact N-O 3.42Å; V400-V433 HydrophobicContact CG2-CG2 3.91Å; V400-V433 WeakPolarHBondContact O-CA 3.23Å; V400-K434 PolarHBondContact O-N 2.71Å
401	E	93.3	Very high	75.6	Confident	47 Å²	47	64.3 Å²	64.3	22%	0.22	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	135.3	173	-53.6	-170.4	160.3	0	0	109.1	I376 G377 L378 L379 K434	I376-E401 PolarHBondContact O-N 2.98Å; I376-E401 VanDerWaalsContact O-N 3.08Å; G377-E401 CarbonylContact C-O 3.55Å; L378-E401 CarbonylContact C-O 3.57Å; L378-E401 WeakPolarHBondContact CA-O 3.47Å; L378-E401 PolarHBondContact N-O 3.18Å; L378-E401 VanDerWaalsContact N-O 3.16Å; L379-E401 PolarHBondContact N-O 3.48Å; E401-K434 CarbonylContact C-O 3.58Å; E401-K434 WeakPolarHBondContact CA-O 3.25Å; E401-K434 HydrophobicContact CB-CB 4.42Å; E401-K434 HydrophobicContact CG-CB 4.11Å; E401-K434 HydrophobicContact CG-CD 4.15Å; E401-K434 HydrophobicContact CG-CG 4.33Å; E401-K434 WeakPolarHBondContact OE1-CD 3.37Å; E401-K434 IonicContact OE1-NZ 2.54Å; E401-K434 PolarHBondContact OE1-NZ 3.02Å
402	F	89	Confident	72.8	Confident	1 Å²	1	69.9 Å²	69.9	0%	0.004	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.7	-175.6	-60.8	-79	0	0	0	110.8	L379 H381 V382 M385 V400 V433 K434 I435 I436	L379-F402 HydrophobicContact CB-CD1 3.5Å; L379-F402 VanDerWaalsContact CB-CD1 3.5Å; L379-F402 HydrophobicContact CB-CE1 3.59Å; L379-F402 HydrophobicContact CD1-CD1 4.31Å; L379-F402 HydrophobicContact CD1-CE1 3.57Å; L379-F402 HydrophobicContact CD1-CZ 4.05Å; L379-F402 HydrophobicContact CG-CE1 4.22Å; L379-F402 WeakPolarHBondContact O-CA 3.46Å; H381-F402 VanDerWaalsContact C-CD1 3.47Å; H381-F402 WeakPolarHBondContact O-CD1 3.47Å; H381-F402 WeakPolarHBondContact O-CE1 3.42Å; V382-F402 VanDerWaalsContact CA-CE1 3.5Å; V382-F402 HydrophobicContact CG2-CD1 4.36Å; V382-F402 HydrophobicContact CG2-CD2 4.2Å; V382-F402 HydrophobicContact CG2-CE2 4.39Å; V382-F402 HydrophobicContact CG2-CG 4.19Å; M385-F402 HydrophobicContact CB-CZ 4.14Å; V400-F402 HydrophobicContact CB-CE2 3.83Å; V400-F402 HydrophobicContact CB-CZ 3.75Å; V400-F402 HydrophobicContact CG2-CE2 3.42Å; V400-F402 VanDerWaalsContact CG2-CE2 3.42Å; V400-F402 HydrophobicContact CG2-CZ 3.56Å; F402-V433 HydrophobicContact CD2-CG1 4.04Å; F402-V433 HydrophobicContact CE2-CG1 3.8Å; F402-K434 PolarHBondContact N-O 3.22Å; F402-I435 HydrophobicContact CB-CG1 4.25Å; F402-I435 HydrophobicContact CD2-CG1 4.06Å; F402-I436 PolarHBondContact O-N 2.91Å
403	Q	84.6	Confident	70.4	Confident	48 Å²	48	76 Å²	76	22%	0.224	40%	0.398	C	S	.	.			trans	-135.2	102.3	168	-176.8	178.9	2.5	0	0	108.1	I347 L378 L379 A405 I436 Q437	I347-Q403 HydrophobicContact CD1-CB 4.22Å; I347-Q403 HydrophobicContact CD1-CG 3.87Å; I347-Q403 WeakPolarHBondContact CD1-O 3.33Å; I347-Q403 HydrophobicContact CG1-CB 4.03Å; I347-Q403 HydrophobicContact CG1-CG 4.07Å; L378-Q403 HydrophobicContact CD2-CB 4.07Å; L379-Q403 PolarHBondContact O-N 3.42Å; Q403-A405 PolarHBondContact O-N 3.05Å; Q403-I436 HydrophobicContact CB-CB 4.42Å; Q403-I436 HydrophobicContact CB-CD1 4.47Å; Q403-I436 HydrophobicContact CG-CB 4.49Å; Q403-Q437 HydrophobicContact CG-CG 4.31Å
404	T	68.6	Low	67.9	Low	44 Å²	44	79 Å²	79	27%	0.27	41%	0.411	S	S	.	.			trans	-68.4	123.6	177.5	-39.5	0	0	0	0	109.2	P380 Q437	P380-T404 WeakPolarHBondContact O-CA 3.18Å; T404-Q437 PolarHBondContact O-OE1 3.18Å
405	A	57.4	Low	65.3	Low	57 Å²	57	83.8 Å²	83.8	47%	0.471	43%	0.429	S	S	.	.			trans	-69.6	135.8	173.2	0	0	0	0	0	110.1	I347 Q403 W407	I347-A405 HydrophobicContact CD1-CB 4.2Å; Q403-A405 PolarHBondContact O-N 3.05Å; A405-W407 PolarHBondContact O-N 3.1Å; A405-W407 VanDerWaalsContact O-N 3.1Å
406	I	51.8	Low	62.4	Low	145 Å²	145	86.6 Å²	86.6	74%	0.744	45%	0.453	S	S	*	.	S	Bend	trans	-65.6	-11.3	179.3	-62.7	167.3	0	0	0	112
407	W	37.3	Very low	59.4	Low	241 Å²	241	89.3 Å²	89.3	91%	0.913	49%	0.488	S	S	*	.			trans	-108.7	109.3	-168.5	-79	43.3	0	0	0	112.2	A405	A405-W407 PolarHBondContact O-N 3.1Å; A405-W407 VanDerWaalsContact O-N 3.1Å
408	G	35.8	Very low	56.3	Low	60 Å²	60	93.3 Å²	93.3	62%	0.619	51%	0.511	S	S	*	.	S	Bend	trans	136.1	145.3	161.4	0	0	0	0	0	112.9	Q410	G408-Q410 PolarHBondContact O-N 2.97Å
409	P	35.9	Very low	53.4	Low	103 Å²	103	97.6 Å²	97.6	67%	0.669	55%	0.547	S	S	*	.			trans	-55.4	136.1	172.4	27.1	-32	0	0	0	107.4	F411	P409-F411 VanDerWaalsContact C-N 3.3Å; P409-F411 PolarHBondContact O-N 2.66Å
410	Q	45.1	Very low	50.9	Low	149 Å²	149	102.1 Å²	102.1	70%	0.696	57%	0.565	S	S	*	*			trans	-47.7	102.6	168	-68.9	168.5	-11.2	0	0	106.6	G408 N412	G408-Q410 PolarHBondContact O-N 2.97Å; Q410-N412 PolarHBondContact O-N 3.47Å; Q410-N412 PolarHBondContact O-ND2 3.48Å
411	F	38.2	Very low	48.4	Very low	167 Å²	167	105.6 Å²	105.6	73%	0.732	59%	0.588	S	S	*	*			trans	-64.3	98.8	170.4	-83.8	-81.2	0	0	0	104	P409 L413	P409-F411 VanDerWaalsContact C-N 3.3Å; P409-F411 PolarHBondContact O-N 2.66Å; F411-L413 HydrophobicContact CB-CD1 4.26Å; F411-L413 HydrophobicContact CD1-CD1 4.46Å; F411-L413 PolarHBondContact O-N 3.44Å
412	N	36	Very low	46.6	Very low	119 Å²	119	111.5 Å²	111.5	64%	0.636	62%	0.621	S	S	*	*			trans	-66.7	59.5	167.8	-74.8	-78.1	0	0	0	108	Q410 D414	Q410-N412 PolarHBondContact O-N 3.47Å; Q410-N412 PolarHBondContact O-ND2 3.48Å; N412-D414 PolarHBondContact O-N 2.78Å; N412-D414 VanDerWaalsContact O-N 3.1Å
413	L	41.4	Very low	45.3	Very low	134 Å²	134	113.8 Å²	113.8	70%	0.702	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	75.8	155.6	-97.3	92.2	0	0	0	106.4	F411	F411-L413 HydrophobicContact CB-CD1 4.26Å; F411-L413 HydrophobicContact CD1-CD1 4.46Å; F411-L413 PolarHBondContact O-N 3.44Å
414	D	39	Very low	45	Very low	117 Å²	117	115.6 Å²	115.6	63%	0.626	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	158	50.6	152.2	-80.3	-11.4	0	0	0	110	N412 A416	N412-D414 PolarHBondContact O-N 2.78Å; N412-D414 VanDerWaalsContact O-N 3.1Å; D414-A416 VanDerWaalsContact C-N 3.26Å
415	R	37	Very low	46	Very low	234 Å²	234	118.7 Å²	118.7	88%	0.883	67%	0.668	S	S	*	*			trans	-99.8	52.4	146.4	-147.8	-177.7	-163.5	-169.6	5.3	108.9
416	A	32.9	Very low	47.7	Very low	62 Å²	62	116.1 Å²	116.1	51%	0.512	65%	0.646	S	S	.	*	S	Bend	trans	-120.7	108	164.7	0	0	0	0	0	106.7	D414 T418	D414-A416 VanDerWaalsContact C-N 3.26Å; A416-T418 PolarHBondContact O-N 2.76Å; A416-T418 PolarHBondContact O-OG1 3.16Å
417	G	34.9	Very low	49.7	Very low	92 Å²	92	111.7 Å²	111.7	95%	0.948	63%	0.627	S	S	*	*			trans	-60	83.4	170.1	0	0	0	0	0	110.4
418	T	33.5	Very low	52.6	Low	110 Å²	110	100.2 Å²	100.2	68%	0.675	58%	0.583	S	S	*	*			trans	-105.5	120.8	162.5	44.8	0	0	0	0	105.3	A416 E420	A416-T418 PolarHBondContact O-N 2.76Å; A416-T418 PolarHBondContact O-OG1 3.16Å; T418-E420 PolarHBondContact O-N 2.93Å
419	A	37	Very low	55.5	Low	91 Å²	91	102 Å²	102	75%	0.752	58%	0.576	S	S	*	*			trans	-38.2	136.5	173.7	0	0	0	0	0	109.9	P421	A419-P421 WeakPolarHBondContact O-CD 3.19Å
420	E	44.7	Very low	58.5	Low	123 Å²	123	102.4 Å²	102.4	58%	0.575	57%	0.567	S	S	*	*			trans	-42.9	109.4	172.2	-77.5	-161.2	158.3	0	0	107.3	T418 N422 R450	T418-E420 PolarHBondContact O-N 2.93Å; E420-N422 PolarHBondContact O-N 3.41Å; E420-N422 VanDerWaalsContact O-N 3.11Å; E420-R450 IonicContact OE1-NH1 3.39Å
421	P	42.8	Very low	61	Low	73 Å²	73	95.3 Å²	95.3	47%	0.474	53%	0.534	S	S	.	.			trans	-61.4	128.7	-177.6	20.4	-27.6	0	0	0	105.8	A419 T423	A419-P421 WeakPolarHBondContact O-CD 3.19Å; P421-T423 HydrophobicContact CB-CG2 4.27Å; P421-T423 HydrophobicContact CG-CG2 4.18Å; P421-T423 VanDerWaalsContact O-CB 3.28Å; P421-T423 WeakPolarHBondContact O-CB 3.43Å; P421-T423 WeakPolarHBondContact O-CG2 3.32Å; P421-T423 PolarHBondContact O-N 2.99Å; P421-T423 PolarHBondContact O-OG1 2.92Å
422	N	56.3	Low	63.8	Low	172 Å²	172	88.9 Å²	88.9	92%	0.92	51%	0.508	S	S	*	.			trans	-39.6	103.3	169.1	-70.3	-35.6	0	0	0	107.9	E420	E420-N422 PolarHBondContact O-N 3.41Å; E420-N422 VanDerWaalsContact O-N 3.11Å
423	T	60.8	Low	66.6	Low	48 Å²	48	83.2 Å²	83.2	29%	0.294	48%	0.478	S	S	.	.			trans	-129.9	102.6	-170.2	37.5	0	0	0	0	108	P421 R451	P421-T423 HydrophobicContact CB-CG2 4.27Å; P421-T423 HydrophobicContact CG-CG2 4.18Å; P421-T423 VanDerWaalsContact O-CB 3.28Å; P421-T423 WeakPolarHBondContact O-CB 3.43Å; P421-T423 WeakPolarHBondContact O-CG2 3.32Å; P421-T423 PolarHBondContact O-N 2.99Å; P421-T423 PolarHBondContact O-OG1 2.92Å; T423-R451 WeakPolarHBondContact OG1-CD 3.47Å; T423-R451 PolarHBondContact OG1-NE 3.25Å
424	S	79.1	Confident	69.1	Low	86 Å²	86	80.3 Å²	80.3	60%	0.601	46%	0.46	S	S	*	.			trans	-34.9	142.8	174.5	55.2	0	0	0	0	112.9	L426	S424-L426 PolarHBondContact O-N 3.2Å
425	D	89.8	Confident	71.5	Confident	109 Å²	109	75.1 Å²	75.1	58%	0.583	43%	0.432	S	S	*	.			trans	-51.6	134.3	171.3	-64.3	-14.8	0	0	0	110.5	P453	D425-P453 HydrophobicContact CB-CG 4.11Å
426	L	92.4	Very high	73.7	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.021	41%	0.413	C	S	.	.			trans	-84.7	136.5	174	-63.6	170.2	0	0	0	108.5	L389 S424 L428 R451	L389-L426 HydrophobicContact CB-CD1 4.23Å; L389-L426 HydrophobicContact CD1-CD1 4.01Å; L389-L426 HydrophobicContact CD2-CD1 4.37Å; L389-L426 HydrophobicContact CG-CD1 4.45Å; S424-L426 PolarHBondContact O-N 3.2Å; L426-L428 HydrophobicContact CB-CB 4.19Å; L426-L428 PolarHBondContact O-N 3.17Å; L426-R451 WeakPolarHBondContact CB-O 3.4Å; L426-R451 HydrophobicContact CD1-CB 4.05Å; L426-R451 HydrophobicContact CG-CB 4.23Å; L426-R451 PolarHBondContact N-O 3.14Å
427	P	94.3	Very high	75.6	Confident	51 Å²	51	68.5 Å²	68.5	33%	0.331	40%	0.402	S	S	.	.			trans	-75.9	23.2	174.3	35.4	-36.2	0	0	0	112.2	P393 E429	P393-P427 WeakPolarHBondContact O-CD 3.5Å; P393-P427 WeakPolarHBondContact O-CG 3.38Å; P427-E429 PolarHBondContact O-N 3.15Å
428	L	96.8	Very high	76.8	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	39%	0.393	C	S	.	.			trans	-70.7	117.9	-172	-168.1	72.3	0	0	0	110.1	L389 L398 L426 L431 H454 L455	L389-L428 HydrophobicContact CD2-CD1 4.3Å; L389-L428 HydrophobicContact CD2-CD2 4.4Å; L398-L428 HydrophobicContact CB-CD1 4.06Å; L426-L428 HydrophobicContact CB-CB 4.19Å; L426-L428 PolarHBondContact O-N 3.17Å; L428-L431 HydrophobicContact CD2-CB 4.08Å; L428-L431 HydrophobicContact CD2-CD1 4.29Å; L428-L431 HydrophobicContact CD2-CD2 4.46Å; L428-H454 CarbonylContact O-C 3.52Å; L428-L455 HydrophobicContact CD2-CD1 4.33Å; L428-L455 HydrophobicContact CG-CD1 4.26Å; L428-L455 WeakPolarHBondContact O-CA 3.06Å; L428-L455 PolarHBondContact O-N 3.34Å
429	E	97.4	Very high	78.2	Confident	98 Å²	98	70.2 Å²	70.2	46%	0.458	38%	0.382	S	S	.	.			trans	-99.4	-29.4	179	-62.5	-178.6	179.4	0	0	111.9	T396 P427 A456 S457	T396-E429 PolarHBondContact O-N 2.88Å; P427-E429 PolarHBondContact O-N 3.15Å; E429-A456 PolarHBondContact O-N 3.31Å; E429-S457 PolarHBondContact O-N 2.91Å
430	K	98.1	Very high	79.6	Confident	111 Å²	111	66.3 Å²	66.3	48%	0.483	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.6	-177.1	-56	-172.5	-179.1	176.2	0	111.9	T396 S397 L398 S457	T396-K430 PolarHBondContact O-N 3.05Å; S397-K430 WeakPolarHBondContact CA-O 3.19Å; L398-K430 PolarHBondContact N-O 3Å; K430-S457 WeakPolarHBondContact CA-O 3.41Å
431	L	98.1	Very high	80.8	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.6	175.8	-179.4	59.3	0	0	0	110.5	M385 L398 L428 V433 L445 V448 L449 L455 S457 L458 H459	M385-L431 HydrophobicContact SD-CD1 4.11Å; L398-L431 HydrophobicContact CB-CD1 4.13Å; L398-L431 HydrophobicContact CD2-CD1 4.18Å; L398-L431 HydrophobicContact CG-CD1 4.34Å; L398-L431 CarbonylContact O-C 3.5Å; L398-L431 WeakPolarHBondContact O-CA 3.42Å; L428-L431 HydrophobicContact CD2-CB 4.08Å; L428-L431 HydrophobicContact CD2-CD1 4.29Å; L428-L431 HydrophobicContact CD2-CD2 4.46Å; L431-V433 HydrophobicContact CD1-CG2 3.88Å; L431-V433 HydrophobicContact CD2-CG2 4.33Å; L431-V433 HydrophobicContact CG-CG2 3.97Å; L431-L445 HydrophobicContact CD2-CD1 4.35Å; L431-V448 HydrophobicContact CD2-CG1 4.22Å; L431-L449 HydrophobicContact CD2-CD2 4.19Å; L431-L455 HydrophobicContact CB-CD1 3.8Å; L431-S457 PolarHBondContact N-O 2.84Å; L431-L458 HydrophobicContact CB-CD1 3.97Å; L431-L458 HydrophobicContact CD2-CD1 3.95Å; L431-L458 HydrophobicContact CG-CD1 4.01Å; L431-L458 WeakPolarHBondContact O-CA 3.49Å; L431-H459 PolarHBondContact O-N 2.86Å
432	T	97.6	Very high	82.7	Confident	32 Å²	32	61.7 Å²	61.7	20%	0.196	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.5	170.1	-62	0	0	0	0	109.8	L398 C399 V400 K434 H459	L398-T432 PolarHBondContact O-N 3.08Å; C399-T432 CarbonylContact C-O 3.57Å; C399-T432 WeakPolarHBondContact CA-O 3.42Å; V400-T432 PolarHBondContact N-O 3.42Å; T432-K434 HydrophobicContact CG2-CG 4.27Å; T432-H459 CarbonylContact C-O 3.59Å; T432-H459 WeakPolarHBondContact CA-O 3.39Å; T432-H459 HydrophobicContact CG2-CB 4.14Å
433	V	95.1	Very high	84	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	114.4	-179.4	171.8	0	0	0	0	108.7	M385 V400 F402 L431 I435 L445 H459 I460 A461	M385-V433 HydrophobicContact SD-CG2 3.82Å; V400-V433 HydrophobicContact CG2-CG2 3.91Å; V400-V433 WeakPolarHBondContact O-CA 3.23Å; F402-V433 HydrophobicContact CD2-CG1 4.04Å; F402-V433 HydrophobicContact CE2-CG1 3.8Å; L431-V433 HydrophobicContact CD1-CG2 3.88Å; L431-V433 HydrophobicContact CD2-CG2 4.33Å; L431-V433 HydrophobicContact CG-CG2 3.97Å; V433-I435 HydrophobicContact CG1-CD1 3.97Å; V433-I435 HydrophobicContact CG1-CG1 4.17Å; V433-L445 HydrophobicContact CG2-CD1 4.29Å; V433-H459 PolarHBondContact N-O 2.95Å; V433-I460 CarbonylContact O-C 3.27Å; V433-I460 VanDerWaalsContact O-CA 3.27Å; V433-I460 WeakPolarHBondContact O-CA 3.41Å; V433-A461 PolarHBondContact O-N 2.95Å
434	K	93.6	Very high	85.1	Confident	72 Å²	72	57.2 Å²	57.2	31%	0.313	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.9	174.5	-52	-171.8	-164.3	154.5	0	110.4	V400 E401 F402 T432 A461	V400-K434 PolarHBondContact O-N 2.71Å; E401-K434 CarbonylContact C-O 3.58Å; E401-K434 WeakPolarHBondContact CA-O 3.25Å; E401-K434 HydrophobicContact CB-CB 4.42Å; E401-K434 HydrophobicContact CG-CB 4.11Å; E401-K434 HydrophobicContact CG-CD 4.15Å; E401-K434 HydrophobicContact CG-CG 4.33Å; E401-K434 WeakPolarHBondContact OE1-CD 3.37Å; E401-K434 IonicContact OE1-NZ 2.54Å; E401-K434 PolarHBondContact OE1-NZ 3.02Å; F402-K434 PolarHBondContact N-O 3.22Å; T432-K434 HydrophobicContact CG2-CG 4.27Å; K434-A461 HydrophobicContact CB-CB 4.34Å; K434-A461 HydrophobicContact CG-CB 4.12Å
435	I	89.6	Confident	85.6	Confident	9 Å²	9	53.3 Å²	53.3	5%	0.046	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.8	-177.1	-65.6	151.4	0	0	0	108.5	F402 V433 Q437 S440 A461 G462 M463	F402-I435 HydrophobicContact CB-CG1 4.25Å; F402-I435 HydrophobicContact CD2-CG1 4.06Å; V433-I435 HydrophobicContact CG1-CD1 3.97Å; V433-I435 HydrophobicContact CG1-CG1 4.17Å; I435-Q437 WeakPolarHBondContact CG2-O 3.31Å; I435-S440 WeakPolarHBondContact CD1-OG 3.41Å; I435-S440 WeakPolarHBondContact CG2-OG 3.48Å; I435-A461 PolarHBondContact N-O 3.09Å; I435-G462 CarbonylContact O-C 3.16Å; I435-G462 WeakPolarHBondContact O-CA 3.33Å; I435-M463 HydrophobicContact CD1-CB 3.71Å; I435-M463 HydrophobicContact CD1-CG 3.76Å; I435-M463 HydrophobicContact CD1-SD 4.29Å
436	I	83.8	Confident	85.6	Confident	96 Å²	96	48.1 Å²	48.1	49%	0.492	24%	0.239	S	C	.	.			trans	-95.8	-24.7	-172.9	-58.2	175	0	0	0	112.7	L378 F402 Q403	L378-I436 HydrophobicContact CD2-CD1 3.61Å; F402-I436 PolarHBondContact O-N 2.91Å; Q403-I436 HydrophobicContact CB-CB 4.42Å; Q403-I436 HydrophobicContact CB-CD1 4.47Å; Q403-I436 HydrophobicContact CG-CB 4.49Å
437	Q	71.9	Confident	85.5	Confident	60 Å²	60	48.4 Å²	48.4	28%	0.28	24%	0.241	S	C	.	.	S	Bend	trans	-132.3	168.1	-173.4	-68	-167.3	4.9	0	0	114.7	Q403 T404 I435	Q403-Q437 HydrophobicContact CG-CG 4.31Å; T404-Q437 PolarHBondContact O-OE1 3.18Å; I435-Q437 WeakPolarHBondContact CG2-O 3.31Å
438	L	61	Low	85.4	Confident	142 Å²	142	46 Å²	46	74%	0.743	23%	0.225	S	C	*	.	S	Bend	trans	-67.9	130.3	-165.8	-90.2	113.8	0	0	0	113.8
439	Q	62.1	Low	85.3	Confident	96 Å²	96	46 Å²	46	45%	0.449	23%	0.225	S	C	.	.			trans	83	104.4	171.2	-53.4	-175.4	-7.4	0	0	114.5	R464 P466	Q439-R464 VanDerWaalsContact CA-O 3.32Å; Q439-R464 WeakPolarHBondContact CA-O 3.27Å; Q439-R464 PolarHBondContact N-O 3.02Å; Q439-P466 HydrophobicContact CG-CG 4.18Å
440	S	66.3	Low	85.1	Confident	10 Å²	10	46.2 Å²	46.2	7%	0.07	22%	0.222	C	C	.	.			trans	-108.9	136.9	168.8	-53.4	0	0	0	0	109.9	I435 L442 R464	I435-S440 WeakPolarHBondContact CD1-OG 3.41Å; I435-S440 WeakPolarHBondContact CG2-OG 3.48Å; S440-L442 PolarHBondContact O-N 3.39Å; S440-R464 PolarHBondContact N-O 3.22Å
441	D	70.9	Confident	84.8	Confident	86 Å²	86	41.8 Å²	41.8	46%	0.46	20%	0.202	S	C	.	.			trans	-75.6	112.7	167.2	-175.8	-0.6	0	0	0	109.2	H443 F444	D441-H443 PolarHBondContact O-N 3.36Å; D441-H443 WeakPolarHBondContact OD1-CB 3.5Å; D441-H443 PolarHBondContact OD1-N 3.36Å; D441-F444 HydrophobicContact CB-CD2 4Å; D441-F444 HydrophobicContact CB-CE2 4.24Å; D441-F444 VanDerWaalsContact OD2-CE2 3.3Å; D441-F444 WeakPolarHBondContact OD2-CE2 3.14Å
442	L	82.2	Confident	84.7	Confident	12 Å²	12	41.8 Å²	41.8	6%	0.063	20%	0.202	C	C	.	.	H	α-helix	trans	-68.1	-20.6	-179.3	-171.6	63	0	0	0	112.4	S440 F444 L445 T446 M463 L465 Q473 L474	S440-L442 PolarHBondContact O-N 3.39Å; L442-F444 PolarHBondContact O-N 3.36Å; L442-L445 HydrophobicContact CD1-CD2 4.18Å; L442-L445 PolarHBondContact O-N 2.81Å; L442-T446 HydrophobicContact CD1-CG2 4.21Å; L442-T446 HydrophobicContact CG-CG2 3.89Å; L442-T446 WeakPolarHBondContact O-CG2 3.36Å; L442-T446 PolarHBondContact O-N 3.45Å; L442-T446 PolarHBondContact O-OG1 3.43Å; L442-M463 HydrophobicContact CD1-CE 4.19Å; L442-M463 HydrophobicContact CD1-SD 4.06Å; L442-L465 HydrophobicContact CB-CD2 4.1Å; L442-L465 HydrophobicContact CD2-CD1 4.41Å; L442-Q473 HydrophobicContact CD2-CB 3.79Å; L442-Q473 HydrophobicContact CD2-CG 4.17Å; L442-L474 HydrophobicContact CD1-CB 3.98Å; L442-L474 HydrophobicContact CD1-CD1 4.35Å; L442-L474 HydrophobicContact CD2-CB 4.44Å
443	H	84.1	Confident	84.5	Confident	92 Å²	92	41.9 Å²	41.9	43%	0.426	20%	0.203	S	C	.	.	H	α-helix	trans	-59.3	-46.4	-177.2	-179.8	-100.1	0	0	0	112.4	D441 L445 T446 S447	D441-H443 PolarHBondContact O-N 3.36Å; D441-H443 WeakPolarHBondContact OD1-CB 3.5Å; D441-H443 PolarHBondContact OD1-N 3.36Å; H443-L445 PolarHBondContact O-N 3.47Å; H443-T446 WeakPolarHBondContact CA-OG1 3.49Å; H443-T446 PolarHBondContact O-N 3.4Å; H443-T446 PolarHBondContact O-OG1 3.35Å; H443-S447 WeakPolarHBondContact O-CB 3.49Å; H443-S447 PolarHBondContact O-N 2.91Å
444	F	83.3	Confident	84.5	Confident	35 Å²	35	47.2 Å²	47.2	15%	0.154	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-42.2	-179.5	-66.4	-76.3	0	0	0	112.6	V382 D441 L442 S447 V448	V382-F444 HydrophobicContact CG1-CB 4.1Å; D441-F444 HydrophobicContact CB-CD2 4Å; D441-F444 HydrophobicContact CB-CE2 4.24Å; D441-F444 VanDerWaalsContact OD2-CE2 3.3Å; D441-F444 WeakPolarHBondContact OD2-CE2 3.14Å; L442-F444 PolarHBondContact O-N 3.36Å; F444-S447 PolarHBondContact O-N 3.47Å; F444-V448 WeakPolarHBondContact O-CG2 3.35Å; F444-V448 PolarHBondContact O-N 3.49Å; F444-V448 VanDerWaalsContact O-N 3.1Å
445	L	88.9	Confident	84.6	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-47.1	178.3	176.6	63.8	0	0	0	111.1	M385 L431 V433 L442 H443 S447 V448 L449 I460 M463 L474	M385-L445 HydrophobicContact CE-CD1 3.93Å; L431-L445 HydrophobicContact CD2-CD1 4.35Å; V433-L445 HydrophobicContact CG2-CD1 4.29Å; L442-L445 HydrophobicContact CD1-CD2 4.18Å; L442-L445 PolarHBondContact O-N 2.81Å; H443-L445 PolarHBondContact O-N 3.47Å; L445-S447 VanDerWaalsContact C-N 3.32Å; L445-S447 PolarHBondContact O-N 3.38Å; L445-V448 PolarHBondContact O-N 3.26Å; L445-L449 HydrophobicContact CD1-CD1 4.36Å; L445-L449 HydrophobicContact CD1-CG 4.37Å; L445-L449 HydrophobicContact CG-CD1 4.11Å; L445-L449 WeakPolarHBondContact O-CG 3.4Å; L445-L449 PolarHBondContact O-N 2.94Å; L445-I460 HydrophobicContact CD1-CD1 4.41Å; L445-I460 HydrophobicContact CD2-CD1 3.68Å; L445-M463 HydrophobicContact CD2-CE 4.4Å; L445-M463 HydrophobicContact CD2-SD 3.92Å; L445-L474 HydrophobicContact CD2-CD1 3.82Å; L445-L474 HydrophobicContact CG-CD1 4.31Å
446	T	90.6	Very high	85	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-64	-37	178.8	50.9	0	0	0	0	112.2	L442 H443 V448 L449 R450 Q473 T477	L442-T446 HydrophobicContact CD1-CG2 4.21Å; L442-T446 HydrophobicContact CG-CG2 3.89Å; L442-T446 WeakPolarHBondContact O-CG2 3.36Å; L442-T446 PolarHBondContact O-N 3.45Å; L442-T446 PolarHBondContact O-OG1 3.43Å; H443-T446 WeakPolarHBondContact CA-OG1 3.49Å; H443-T446 PolarHBondContact O-N 3.4Å; H443-T446 PolarHBondContact O-OG1 3.35Å; T446-V448 PolarHBondContact O-N 3.08Å; T446-L449 PolarHBondContact O-N 2.9Å; T446-R450 WeakPolarHBondContact O-CG 3.39Å; T446-R450 PolarHBondContact O-N 2.76Å; T446-Q473 HydrophobicContact CG2-CG 4.29Å; T446-T477 HydrophobicContact CG2-CG2 4.37Å
447	S	90	Very high	85.7	Confident	10 Å²	10	41.6 Å²	41.6	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-43.7	172.1	-178.5	0	0	0	0	112.4	H443 F444 L445 R451	H443-S447 WeakPolarHBondContact O-CB 3.49Å; H443-S447 PolarHBondContact O-N 2.91Å; F444-S447 PolarHBondContact O-N 3.47Å; L445-S447 VanDerWaalsContact C-N 3.32Å; L445-S447 PolarHBondContact O-N 3.38Å; S447-R451 WeakPolarHBondContact O-CG 3.32Å; S447-R451 PolarHBondContact O-N 3Å
448	V	91.7	Very high	86.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.9	-41.5	176.6	168.4	0	0	0	0	111.8	M385 L389 L431 F444 L445 T446 R451 S452	M385-V448 HydrophobicContact CE-CB 3.88Å; M385-V448 HydrophobicContact CE-CG1 4.13Å; M385-V448 HydrophobicContact CE-CG2 3.68Å; L389-V448 HydrophobicContact CD1-CB 4.29Å; L389-V448 HydrophobicContact CD1-CG1 3.47Å; L389-V448 VanDerWaalsContact CD1-CG1 3.47Å; L389-V448 HydrophobicContact CD1-CG2 3.77Å; L431-V448 HydrophobicContact CD2-CG1 4.22Å; F444-V448 WeakPolarHBondContact O-CG2 3.35Å; F444-V448 PolarHBondContact O-N 3.49Å; F444-V448 VanDerWaalsContact O-N 3.1Å; L445-V448 PolarHBondContact O-N 3.26Å; T446-V448 PolarHBondContact O-N 3.08Å; V448-R451 PolarHBondContact O-N 3.36Å; V448-S452 WeakPolarHBondContact O-CB 3.32Å; V448-S452 PolarHBondContact O-N 2.97Å; V448-S452 PolarHBondContact O-OG 3.12Å
449	L	94.1	Very high	88.6	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63	-42	178.7	-70.2	172	0	0	0	112.2	L431 L445 T446 R451 S452 L455 L458 L474 T477 L478 N482	L431-L449 HydrophobicContact CD2-CD2 4.19Å; L445-L449 HydrophobicContact CD1-CD1 4.36Å; L445-L449 HydrophobicContact CD1-CG 4.37Å; L445-L449 HydrophobicContact CG-CD1 4.11Å; L445-L449 WeakPolarHBondContact O-CG 3.4Å; L445-L449 PolarHBondContact O-N 2.94Å; T446-L449 PolarHBondContact O-N 2.9Å; L449-R451 PolarHBondContact O-N 2.84Å; L449-S452 PolarHBondContact O-N 2.95Å; L449-L455 HydrophobicContact CD2-CD2 3.77Å; L449-L458 HydrophobicContact CD2-CD1 4.27Å; L449-L458 HydrophobicContact CD2-CD2 4.13Å; L449-L474 HydrophobicContact CD1-CD1 3.44Å; L449-L474 VanDerWaalsContact CD1-CD1 3.44Å; L449-T477 HydrophobicContact CB-CG2 3.92Å; L449-L478 HydrophobicContact CD1-CD2 3.77Å; L449-L478 HydrophobicContact CD1-CG 4.26Å; L449-L478 HydrophobicContact CD2-CD2 3.84Å; L449-L478 HydrophobicContact CG-CD2 4.33Å; L449-N482 PolarHBondContact O-ND2 3.07Å
450	R	93.9	Very high	90.2	Very high	103 Å²	103	29.2 Å²	29.2	39%	0.389	15%	0.147	S	C	.	.	H	α-helix	trans	-60	-35.1	175.2	-73.2	175.2	-172.7	162.7	1.8	112.8	E420 T446 S452 T477	E420-R450 IonicContact OE1-NH1 3.39Å; T446-R450 WeakPolarHBondContact O-CG 3.39Å; T446-R450 PolarHBondContact O-N 2.76Å; R450-S452 VanDerWaalsContact C-N 3.27Å; R450-S452 PolarHBondContact O-N 2.86Å; R450-T477 HydrophobicContact CG-CG2 3.75Å
451	R	92.9	Very high	91.5	Very high	18 Å²	18	29.3 Å²	29.3	7%	0.068	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-0.1	177.1	-68.3	175.1	60.1	-163	2.9	113.7	N390 T423 L426 S447 V448 L449 P453	N390-R451 PolarHBondContact OD1-NH1 2.86Å; N390-R451 PolarHBondContact OD1-NH2 2.99Å; N390-R451 VanDerWaalsContact OD1-NH2 3.14Å; T423-R451 WeakPolarHBondContact OG1-CD 3.47Å; T423-R451 PolarHBondContact OG1-NE 3.25Å; L426-R451 WeakPolarHBondContact CB-O 3.4Å; L426-R451 HydrophobicContact CD1-CB 4.05Å; L426-R451 HydrophobicContact CG-CB 4.23Å; L426-R451 PolarHBondContact N-O 3.14Å; S447-R451 WeakPolarHBondContact O-CG 3.32Å; S447-R451 PolarHBondContact O-N 3Å; V448-R451 PolarHBondContact O-N 3.36Å; L449-R451 PolarHBondContact O-N 2.84Å; R451-P453 VanDerWaalsContact O-CD 3.31Å; R451-P453 WeakPolarHBondContact O-CD 3.34Å
452	S	94.8	Very high	92.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.			trans	-121.6	61.8	-172.5	-53.6	0	0	0	0	112.3	V448 L449 R450 H454 L455 N482	V448-S452 WeakPolarHBondContact O-CB 3.32Å; V448-S452 PolarHBondContact O-N 2.97Å; V448-S452 PolarHBondContact O-OG 3.12Å; L449-S452 PolarHBondContact O-N 2.95Å; R450-S452 VanDerWaalsContact C-N 3.27Å; R450-S452 PolarHBondContact O-N 2.86Å; S452-H454 PolarHBondContact O-N 3.27Å; S452-L455 VanDerWaalsContact O-CB 3.29Å; S452-L455 WeakPolarHBondContact O-CB 3.01Å; S452-L455 PolarHBondContact O-N 2.82Å; S452-L455 VanDerWaalsContact O-N 3.16Å; S452-N482 PolarHBondContact O-ND2 2.82Å
453	P	93.7	Very high	92.6	Very high	34 Å²	34	25.3 Å²	25.3	22%	0.221	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.2	-173.8	27.2	-35.5	0	0	0	114.2	D425 R451 L455 S481 S484	D425-P453 HydrophobicContact CB-CG 4.11Å; R451-P453 VanDerWaalsContact O-CD 3.31Å; R451-P453 WeakPolarHBondContact O-CD 3.34Å; P453-L455 VanDerWaalsContact C-N 3.33Å; P453-S481 WeakPolarHBondContact CA-O 3.32Å; P453-S484 PolarHBondContact O-OG 2.92Å; P453-S484 VanDerWaalsContact O-OG 3.12Å
454	H	94.5	Very high	92.5	Very high	112 Å²	112	23.8 Å²	23.8	52%	0.519	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	7.6	179.4	-58.5	-58.5	0	0	0	114.1	L428 S452 A456	L428-H454 CarbonylContact O-C 3.52Å; S452-H454 PolarHBondContact O-N 3.27Å; H454-A456 PolarHBondContact O-N 2.95Å; H454-A456 VanDerWaalsContact O-N 3.12Å
455	L	96.7	Very high	92.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.122	C	C	.	.			trans	-61.5	115.6	-178.2	-167.8	73.4	0	0	0	111.2	L428 L431 L449 S452 P453 L458 S484 L485	L428-L455 HydrophobicContact CD2-CD1 4.33Å; L428-L455 HydrophobicContact CG-CD1 4.26Å; L428-L455 WeakPolarHBondContact O-CA 3.06Å; L428-L455 PolarHBondContact O-N 3.34Å; L431-L455 HydrophobicContact CB-CD1 3.8Å; L449-L455 HydrophobicContact CD2-CD2 3.77Å; S452-L455 VanDerWaalsContact O-CB 3.29Å; S452-L455 WeakPolarHBondContact O-CB 3.01Å; S452-L455 PolarHBondContact O-N 2.82Å; S452-L455 VanDerWaalsContact O-N 3.16Å; P453-L455 VanDerWaalsContact C-N 3.33Å; L455-L458 HydrophobicContact CD2-CB 4.06Å; L455-L458 HydrophobicContact CD2-CD1 4.26Å; L455-S484 CarbonylContact O-C 3.54Å; L455-L485 HydrophobicContact CD2-CD1 4.42Å; L455-L485 HydrophobicContact CG-CD1 4.37Å; L455-L485 WeakPolarHBondContact O-CA 3.29Å; L455-L485 PolarHBondContact O-N 3.4Å
456	A	96.9	Very high	91.7	Very high	29 Å²	29	26 Å²	26	24%	0.24	14%	0.136	C	C	.	.			trans	-99.5	-28.1	-179.3	0	0	0	0	0	112.6	E429 H454 K486 V487	E429-A456 PolarHBondContact O-N 3.31Å; H454-A456 PolarHBondContact O-N 2.95Å; H454-A456 VanDerWaalsContact O-N 3.12Å; A456-K486 PolarHBondContact O-N 3.1Å; A456-V487 PolarHBondContact O-N 3.36Å
457	S	98.1	Very high	90.6	Very high	30 Å²	30	33.2 Å²	33.2	21%	0.21	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	126.5	-179.9	-176.7	0	0	0	0	111.7	E429 K430 L431 V487	E429-S457 PolarHBondContact O-N 2.91Å; K430-S457 WeakPolarHBondContact CA-O 3.41Å; L431-S457 PolarHBondContact N-O 2.84Å; S457-V487 WeakPolarHBondContact CA-O 3.17Å
458	L	98	Very high	89.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.4	175.3	179.5	62.5	0	0	0	111	L431 L449 L455 I460 L478 L485 V487 L488 T489 F490	L431-L458 HydrophobicContact CB-CD1 3.97Å; L431-L458 HydrophobicContact CD2-CD1 3.95Å; L431-L458 HydrophobicContact CG-CD1 4.01Å; L431-L458 WeakPolarHBondContact O-CA 3.49Å; L449-L458 HydrophobicContact CD2-CD1 4.27Å; L449-L458 HydrophobicContact CD2-CD2 4.13Å; L455-L458 HydrophobicContact CD2-CB 4.06Å; L455-L458 HydrophobicContact CD2-CD1 4.26Å; L458-I460 HydrophobicContact CD1-CD1 4.11Å; L458-I460 HydrophobicContact CD1-CG1 3.84Å; L458-I460 HydrophobicContact CD2-CD1 4.1Å; L458-I460 HydrophobicContact CD2-CG1 4.39Å; L458-I460 HydrophobicContact CG-CD1 4.27Å; L458-I460 HydrophobicContact CG-CG1 4.03Å; L458-L478 HydrophobicContact CD2-CD1 3.89Å; L458-L478 HydrophobicContact CD2-CD2 3.37Å; L458-L478 HydrophobicContact CD2-CG 4.27Å; L458-L485 HydrophobicContact CB-CD1 3.83Å; L458-V487 PolarHBondContact N-O 3.16Å; L458-L488 HydrophobicContact CB-CD1 4.14Å; L458-L488 HydrophobicContact CD2-CD1 3.99Å; L458-L488 HydrophobicContact CG-CD1 4.22Å; L458-T489 PolarHBondContact O-N 2.97Å; L458-F490 HydrophobicContact CD2-CE1 4.37Å
459	H	97.7	Very high	88.5	Confident	39 Å²	39	40.5 Å²	40.5	18%	0.181	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.1	170.2	179.8	-167.5	0	0	0	110	L431 T432 V433 T489 E491	L431-H459 PolarHBondContact O-N 2.86Å; T432-H459 CarbonylContact C-O 3.59Å; T432-H459 WeakPolarHBondContact CA-O 3.39Å; T432-H459 HydrophobicContact CG2-CB 4.14Å; V433-H459 PolarHBondContact N-O 2.95Å; H459-T489 CarbonylContact C-O 3.26Å; H459-T489 VanDerWaalsContact CA-O 3.29Å; H459-T489 WeakPolarHBondContact CA-O 3.4Å; H459-T489 VanDerWaalsContact CD2-CG2 3.45Å; H459-T489 WeakPolarHBondContact CD2-CG2 3.11Å; H459-T489 PolarHBondContact CD2-O 2.91Å; H459-E491 IonicContact NE2-OE2 2.99Å
460	I	95.3	Very high	87.7	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.2	172.5	-51.1	-177.9	0	0	0	109.5	V433 L445 L458 M463 L474 T489 F490 E491 I493	V433-I460 CarbonylContact O-C 3.27Å; V433-I460 VanDerWaalsContact O-CA 3.27Å; V433-I460 WeakPolarHBondContact O-CA 3.41Å; L445-I460 HydrophobicContact CD1-CD1 4.41Å; L445-I460 HydrophobicContact CD2-CD1 3.68Å; L458-I460 HydrophobicContact CD1-CD1 4.11Å; L458-I460 HydrophobicContact CD1-CG1 3.84Å; L458-I460 HydrophobicContact CD2-CD1 4.1Å; L458-I460 HydrophobicContact CD2-CG1 4.39Å; L458-I460 HydrophobicContact CG-CD1 4.27Å; L458-I460 HydrophobicContact CG-CG1 4.03Å; I460-M463 HydrophobicContact CG2-CB 4.06Å; I460-M463 HydrophobicContact CG2-CE 4.27Å; I460-M463 HydrophobicContact CG2-SD 4.46Å; I460-L474 HydrophobicContact CD1-CD1 4.15Å; I460-L474 HydrophobicContact CD1-CD2 3.89Å; I460-T489 PolarHBondContact N-O 2.96Å; I460-F490 HydrophobicContact CB-CD1 3.88Å; I460-F490 HydrophobicContact CB-CE1 4.02Å; I460-F490 HydrophobicContact CD1-CE1 3.81Å; I460-F490 HydrophobicContact CG1-CD1 4.29Å; I460-F490 HydrophobicContact CG1-CE1 3.96Å; I460-F490 WeakPolarHBondContact O-CA 3.34Å; I460-E491 PolarHBondContact O-N 2.93Å; I460-I493 HydrophobicContact CB-CD1 3.77Å; I460-I493 HydrophobicContact CG2-CD1 3.61Å
461	A	93.7	Very high	87.5	Confident	11 Å²	11	38.4 Å²	38.4	9%	0.091	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	140.3	180	0	0	0	0	0	112.7	V433 K434 I435 M463 E491	V433-A461 PolarHBondContact O-N 2.95Å; K434-A461 HydrophobicContact CB-CB 4.34Å; K434-A461 HydrophobicContact CG-CB 4.12Å; I435-A461 PolarHBondContact N-O 3.09Å; A461-M463 VanDerWaalsContact C-N 3.26Å; A461-M463 PolarHBondContact O-N 2.81Å; A461-E491 CarbonylContact C-O 3.37Å; A461-E491 WeakPolarHBondContact CA-O 3.4Å; A461-E491 HydrophobicContact CB-CB 4.05Å
462	G	88.9	Confident	87.2	Confident	12 Å²	12	39.4 Å²	39.4	12%	0.124	25%	0.253	C	S	.	.	S	Bend	trans	70.7	11	168.9	0	0	0	0	0	115.9	I435 R464 E491	I435-G462 CarbonylContact O-C 3.16Å; I435-G462 WeakPolarHBondContact O-CA 3.33Å; G462-R464 PolarHBondContact O-N 2.95Å; G462-E491 PolarHBondContact N-O 3.23Å
463	M	86.5	Confident	86.9	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	27%	0.273	C	S	.	.			trans	-69.7	117.2	-178.7	-172.1	172.1	59.4	0	0	111.8	I435 L442 L445 I460 A461 L474 I493	I435-M463 HydrophobicContact CD1-CB 3.71Å; I435-M463 HydrophobicContact CD1-CG 3.76Å; I435-M463 HydrophobicContact CD1-SD 4.29Å; L442-M463 HydrophobicContact CD1-CE 4.19Å; L442-M463 HydrophobicContact CD1-SD 4.06Å; L445-M463 HydrophobicContact CD2-CE 4.4Å; L445-M463 HydrophobicContact CD2-SD 3.92Å; I460-M463 HydrophobicContact CG2-CB 4.06Å; I460-M463 HydrophobicContact CG2-CE 4.27Å; I460-M463 HydrophobicContact CG2-SD 4.46Å; A461-M463 VanDerWaalsContact C-N 3.26Å; A461-M463 PolarHBondContact O-N 2.81Å; M463-L474 HydrophobicContact CE-CD2 3.41Å; M463-L474 VanDerWaalsContact CE-CD2 3.41Å; M463-I493 HydrophobicContact CB-CD1 4.33Å; M463-I493 HydrophobicContact CB-CG1 4.38Å; M463-I493 HydrophobicContact CE-CD1 4.31Å
464	R	82.6	Confident	86.8	Confident	61 Å²	61	41.9 Å²	41.9	23%	0.23	26%	0.262	C	S	.	.			trans	-116.4	122.5	175.2	-56.7	-57.6	-161.6	-168.4	6.5	110.8	Q439 S440 G462 D492	Q439-R464 VanDerWaalsContact CA-O 3.32Å; Q439-R464 WeakPolarHBondContact CA-O 3.27Å; Q439-R464 PolarHBondContact N-O 3.02Å; S440-R464 PolarHBondContact N-O 3.22Å; G462-R464 PolarHBondContact O-N 2.95Å; R464-D492 IonicContact CZ-OD1 3.17Å; R464-D492 IonicContact CZ-OD2 3.66Å; R464-D492 IonicContact NE-OD2 3.58Å; R464-D492 PolarHBondContact NH1-O 2.74Å; R464-D492 IonicContact NH1-OD1 3.88Å; R464-D492 PolarHBondContact NH1-OD1 2.92Å; R464-D492 IonicContact NH1-OD2 2.58Å; R464-D492 IonicContact NH2-OD1 3.8Å; R464-D492 PolarHBondContact NH2-OD1 2.98Å; R464-D492 IonicContact NH2-OD2 2.95Å; R464-D492 PolarHBondContact NH2-OD2 3.39Å
465	L	79.4	Confident	86.8	Confident	35 Å²	35	36.6 Å²	36.6	18%	0.183	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-88.4	157.1	172.7	-62.3	176.8	0	0	0	111.2	L442 C469 S470 Q471	L442-L465 HydrophobicContact CB-CD2 4.1Å; L442-L465 HydrophobicContact CD2-CD1 4.41Å; L465-C469 HydrophobicContact CB-CB 3.81Å; L465-C469 HydrophobicContact CD1-CB 4.14Å; L465-S470 WeakPolarHBondContact CD1-O 3.39Å; L465-Q471 VanDerWaalsContact CD1-CD 3.44Å; L465-Q471 HydrophobicContact CD1-CG 4.12Å
466	P	76.8	Confident	86.5	Confident	49 Å²	49	37.7 Å²	37.7	32%	0.318	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-55.1	154.7	171	-23.8	33.9	0	0	0	112.9	Q439 G468 C469	Q439-P466 HydrophobicContact CG-CG 4.18Å; P466-G468 PolarHBondContact O-N 2.81Å; P466-C469 WeakPolarHBondContact O-CB 3.47Å; P466-C469 PolarHBondContact O-N 3.09Å; P466-C469 VanDerWaalsContact O-N 3.08Å
467	T	67.6	Low	86.3	Confident	153 Å²	153	36.3 Å²	36.3	94%	0.939	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	126.6	178.4	-53.8	0	0	0	0	110.9
468	G	64.9	Low	86.1	Confident	82 Å²	82	34.9 Å²	34.9	85%	0.845	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	96.2	-11.7	-178.5	0	0	0	0	0	114.5	P466	P466-G468 PolarHBondContact O-N 2.81Å
469	C	72.3	Confident	85.9	Confident	80 Å²	80	35.3 Å²	35.3	54%	0.541	23%	0.227	S	C	.	.			trans	-85.9	146.8	171.4	-61.2	0	0	0	0	111.1	L465 P466	L465-C469 HydrophobicContact CB-CB 3.81Å; L465-C469 HydrophobicContact CD1-CB 4.14Å; P466-C469 WeakPolarHBondContact O-CB 3.47Å; P466-C469 PolarHBondContact O-N 3.09Å; P466-C469 VanDerWaalsContact O-N 3.08Å
470	S	77.8	Confident	85.6	Confident	54 Å²	54	38.5 Å²	38.5	38%	0.378	24%	0.242	S	C	.	.			trans	-113.9	149	177.9	176.5	0	0	0	0	110.9	L465 S472 C498	L465-S470 WeakPolarHBondContact CD1-O 3.39Å; S470-S472 PolarHBondContact O-N 2.99Å; S470-S472 WeakPolarHBondContact OG-CB 3.4Å; S470-S472 PolarHBondContact OG-N 2.83Å; S470-S472 VanDerWaalsContact OG-N 3.16Å; S470-C498 PolarHBondContact OG-SG 3.38Å; S470-C498 VanDerWaalsContact OG-SG 3.4Å
471	Q	87.7	Confident	85.4	Confident	6 Å²	6	39.8 Å²	39.8	3%	0.028	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	2.5	172.1	-60.9	-68.6	4.7	0	0	112.9	L465 Q473 L474 L475 I493 K494 L495	L465-Q471 VanDerWaalsContact CD1-CD 3.44Å; L465-Q471 HydrophobicContact CD1-CG 4.12Å; Q471-Q473 VanDerWaalsContact C-N 3.28Å; Q471-Q473 PolarHBondContact O-N 3.5Å; Q471-L474 WeakPolarHBondContact O-CB 3.4Å; Q471-L474 PolarHBondContact O-N 2.87Å; Q471-L475 PolarHBondContact O-N 2.85Å; Q471-I493 HydrophobicContact CG-CG2 3.84Å; Q471-K494 WeakPolarHBondContact CG-O 3.42Å; Q471-L495 HydrophobicContact CB-CD2 3.81Å; Q471-L495 HydrophobicContact CG-CD2 4.12Å
472	S	87.6	Confident	85.4	Confident	38 Å²	38	39.3 Å²	39.3	27%	0.266	25%	0.247	S	C	.	.	H	α-helix	trans	-50.9	-44.2	177.3	178.6	0	0	0	0	112.6	S470 L474 L475 S476 D501	S470-S472 PolarHBondContact O-N 2.99Å; S470-S472 WeakPolarHBondContact OG-CB 3.4Å; S470-S472 PolarHBondContact OG-N 2.83Å; S470-S472 VanDerWaalsContact OG-N 3.16Å; S472-L474 VanDerWaalsContact C-N 3.3Å; S472-L474 PolarHBondContact O-N 2.83Å; S472-L475 PolarHBondContact O-N 3.01Å; S472-S476 WeakPolarHBondContact O-CB 3.45Å; S472-S476 PolarHBondContact O-N 3.49Å; S472-S476 PolarHBondContact O-OG 2.89Å; S472-D501 WeakPolarHBondContact CB-OD2 3.34Å; S472-D501 PolarHBondContact OG-OD1 2.8Å; S472-D501 PolarHBondContact OG-OD2 3.46Å
473	Q	88.9	Confident	85.5	Confident	87 Å²	87	43.8 Å²	43.8	41%	0.407	26%	0.264	S	S	.	.	H	α-helix	trans	-63.8	-33.2	179.2	-178.2	-174.9	-5.9	0	0	113.1	L442 T446 Q471 S476 T477	L442-Q473 HydrophobicContact CD2-CB 3.79Å; L442-Q473 HydrophobicContact CD2-CG 4.17Å; T446-Q473 HydrophobicContact CG2-CG 4.29Å; Q471-Q473 VanDerWaalsContact C-N 3.28Å; Q471-Q473 PolarHBondContact O-N 3.5Å; Q473-S476 WeakPolarHBondContact CA-OG 3.4Å; Q473-S476 PolarHBondContact O-OG 2.82Å; Q473-S476 VanDerWaalsContact O-OG 3.05Å; Q473-T477 WeakPolarHBondContact O-CB 3.05Å; Q473-T477 PolarHBondContact O-N 3.1Å; Q473-T477 VanDerWaalsContact O-N 3.11Å; Q473-T477 PolarHBondContact O-OG1 2.94Å
474	L	91.8	Very high	85.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-52.6	174.2	176.5	60.2	0	0	0	109.8	L442 L445 L449 I460 M463 Q471 S472 S476 T477 L478 F490	L442-L474 HydrophobicContact CD1-CB 3.98Å; L442-L474 HydrophobicContact CD1-CD1 4.35Å; L442-L474 HydrophobicContact CD2-CB 4.44Å; L445-L474 HydrophobicContact CD2-CD1 3.82Å; L445-L474 HydrophobicContact CG-CD1 4.31Å; L449-L474 HydrophobicContact CD1-CD1 3.44Å; L449-L474 VanDerWaalsContact CD1-CD1 3.44Å; I460-L474 HydrophobicContact CD1-CD1 4.15Å; I460-L474 HydrophobicContact CD1-CD2 3.89Å; M463-L474 HydrophobicContact CE-CD2 3.41Å; M463-L474 VanDerWaalsContact CE-CD2 3.41Å; Q471-L474 WeakPolarHBondContact O-CB 3.4Å; Q471-L474 PolarHBondContact O-N 2.87Å; S472-L474 VanDerWaalsContact C-N 3.3Å; S472-L474 PolarHBondContact O-N 2.83Å; L474-S476 VanDerWaalsContact C-N 3.34Å; L474-S476 PolarHBondContact O-N 3.38Å; L474-T477 PolarHBondContact O-N 3.28Å; L474-L478 HydrophobicContact CD1-CD1 4.39Å; L474-L478 HydrophobicContact CD1-CG 4.5Å; L474-L478 HydrophobicContact CG-CD1 4.24Å; L474-L478 WeakPolarHBondContact O-CG 3.29Å; L474-L478 PolarHBondContact O-N 3.49Å; L474-F490 HydrophobicContact CD2-CE1 4.19Å; L474-F490 HydrophobicContact CD2-CZ 3.9Å; L474-F490 HydrophobicContact CG-CZ 4.48Å
475	L	93.3	Very high	86.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-39.7	-177.7	-67.6	166.6	0	0	0	111.9	Q471 S472 L478 S479 F490 L495 C498 D501 I502 L505	Q471-L475 PolarHBondContact O-N 2.85Å; S472-L475 PolarHBondContact O-N 3.01Å; L475-L478 PolarHBondContact O-N 3.45Å; L475-S479 WeakPolarHBondContact O-CB 3.49Å; L475-S479 PolarHBondContact O-N 3.02Å; L475-F490 HydrophobicContact CD2-CE2 3.78Å; L475-F490 HydrophobicContact CD2-CZ 4.45Å; L475-L495 HydrophobicContact CD1-CD2 4.37Å; L475-C498 HydrophobicContact CD1-CB 3.51Å; L475-D501 HydrophobicContact CB-CB 3.69Å; L475-D501 HydrophobicContact CD1-CB 3.75Å; L475-D501 HydrophobicContact CG-CB 4.39Å; L475-I502 HydrophobicContact CD1-CG1 3.84Å; L475-I502 HydrophobicContact CD2-CG1 4.34Å; L475-L505 HydrophobicContact CD2-CD2 3.81Å
476	S	91.3	Very high	87.3	Confident	24 Å²	24	46.4 Å²	46.4	17%	0.168	28%	0.283	C	S	.	.	H	α-helix	trans	-62.7	-44.8	176.3	76.1	0	0	0	0	110.8	S472 Q473 L474 L478 S479 E480	S472-S476 WeakPolarHBondContact O-CB 3.45Å; S472-S476 PolarHBondContact O-N 3.49Å; S472-S476 PolarHBondContact O-OG 2.89Å; Q473-S476 WeakPolarHBondContact CA-OG 3.4Å; Q473-S476 PolarHBondContact O-OG 2.82Å; Q473-S476 VanDerWaalsContact O-OG 3.05Å; L474-S476 VanDerWaalsContact C-N 3.34Å; L474-S476 PolarHBondContact O-N 3.38Å; S476-L478 PolarHBondContact O-N 2.96Å; S476-S479 WeakPolarHBondContact CA-OG 3.38Å; S476-S479 PolarHBondContact O-N 2.6Å; S476-S479 PolarHBondContact O-OG 2.99Å; S476-E480 WeakPolarHBondContact O-CB 3.45Å; S476-E480 VanDerWaalsContact O-CG 3.32Å; S476-E480 WeakPolarHBondContact O-CG 3.21Å; S476-E480 PolarHBondContact O-N 3.15Å
477	T	92.6	Very high	88.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-45.1	177.1	-57.8	0	0	0	0	111.2	T446 L449 R450 Q473 L474 S479 E480 S481	T446-T477 HydrophobicContact CG2-CG2 4.37Å; L449-T477 HydrophobicContact CB-CG2 3.92Å; R450-T477 HydrophobicContact CG-CG2 3.75Å; Q473-T477 WeakPolarHBondContact O-CB 3.05Å; Q473-T477 PolarHBondContact O-N 3.1Å; Q473-T477 VanDerWaalsContact O-N 3.11Å; Q473-T477 PolarHBondContact O-OG1 2.94Å; L474-T477 PolarHBondContact O-N 3.28Å; T477-S479 VanDerWaalsContact C-N 3.32Å; T477-S479 PolarHBondContact O-N 3.38Å; T477-E480 PolarHBondContact O-N 3.12Å; T477-S481 WeakPolarHBondContact O-CB 3.44Å; T477-S481 PolarHBondContact O-N 3.22Å
478	L	94.5	Very high	89.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.2	-43.1	176	-68	172.2	0	0	0	112	L449 L458 L474 L475 S476 E480 N482 F490 L505	L449-L478 HydrophobicContact CD1-CD2 3.77Å; L449-L478 HydrophobicContact CD1-CG 4.26Å; L449-L478 HydrophobicContact CD2-CD2 3.84Å; L449-L478 HydrophobicContact CG-CD2 4.33Å; L458-L478 HydrophobicContact CD2-CD1 3.89Å; L458-L478 HydrophobicContact CD2-CD2 3.37Å; L458-L478 HydrophobicContact CD2-CG 4.27Å; L474-L478 HydrophobicContact CD1-CD1 4.39Å; L474-L478 HydrophobicContact CD1-CG 4.5Å; L474-L478 HydrophobicContact CG-CD1 4.24Å; L474-L478 WeakPolarHBondContact O-CG 3.29Å; L474-L478 PolarHBondContact O-N 3.49Å; L475-L478 PolarHBondContact O-N 3.45Å; S476-L478 PolarHBondContact O-N 2.96Å; L478-E480 PolarHBondContact O-N 3.31Å; L478-N482 HydrophobicContact CD2-CB 4.38Å; L478-N482 PolarHBondContact O-N 3.25Å; L478-N482 VanDerWaalsContact O-N 3.08Å; L478-F490 HydrophobicContact CD1-CZ 3.69Å; L478-L505 HydrophobicContact CB-CD1 3.61Å
479	S	92.4	Very high	91.3	Very high	8 Å²	8	35.7 Å²	35.7	6%	0.056	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-23.9	179.4	75.4	0	0	0	0	113.7	L475 S476 T477 H483 K504	L475-S479 WeakPolarHBondContact O-CB 3.49Å; L475-S479 PolarHBondContact O-N 3.02Å; S476-S479 WeakPolarHBondContact CA-OG 3.38Å; S476-S479 PolarHBondContact O-N 2.6Å; S476-S479 PolarHBondContact O-OG 2.99Å; T477-S479 VanDerWaalsContact C-N 3.32Å; T477-S479 PolarHBondContact O-N 3.38Å; S479-H483 PolarHBondContact O-CE1 3.01Å; S479-K504 WeakPolarHBondContact OG-CE 3.45Å
480	E	92.2	Very high	92.5	Very high	106 Å²	106	31.9 Å²	31.9	50%	0.495	17%	0.174	S	C	.	.	H	α-helix	trans	-99.9	-28.6	-174.7	-74.7	163.4	-162.7	0	0	113.2	S476 T477 L478 H483 K504	S476-E480 WeakPolarHBondContact O-CB 3.45Å; S476-E480 VanDerWaalsContact O-CG 3.32Å; S476-E480 WeakPolarHBondContact O-CG 3.21Å; S476-E480 PolarHBondContact O-N 3.15Å; T477-E480 PolarHBondContact O-N 3.12Å; L478-E480 PolarHBondContact O-N 3.31Å; E480-H483 PolarHBondContact O-NE2 3.27Å; E480-K504 IonicContact OE1-NZ 2.74Å; E480-K504 PolarHBondContact OE1-NZ 3.48Å
481	S	91.4	Very high	93.3	Very high	28 Å²	28	33.1 Å²	33.1	20%	0.196	17%	0.174	C	C	.	.	H	α-helix	trans	-117.6	-21.2	-171.5	-56.4	0	0	0	0	114.3	P453 T477	P453-S481 WeakPolarHBondContact CA-O 3.32Å; T477-S481 WeakPolarHBondContact O-CB 3.44Å; T477-S481 PolarHBondContact O-N 3.22Å
482	N	94.1	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.184	C	C	.	.			trans	-121	56.1	-168.4	-51.7	106.7	0	0	0	112.2	L449 S452 L478 S484 L485	L449-N482 PolarHBondContact O-ND2 3.07Å; S452-N482 PolarHBondContact O-ND2 2.82Å; L478-N482 HydrophobicContact CD2-CB 4.38Å; L478-N482 PolarHBondContact O-N 3.25Å; L478-N482 VanDerWaalsContact O-N 3.08Å; N482-S484 PolarHBondContact O-N 2.88Å; N482-L485 VanDerWaalsContact O-CB 3.26Å; N482-L485 WeakPolarHBondContact O-CB 3.37Å; N482-L485 PolarHBondContact O-N 3.2Å
483	H	90.8	Very high	93.6	Very high	106 Å²	106	33.1 Å²	33.1	49%	0.491	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.4	-179.5	-60.5	-62.7	0	0	0	114.2	S479 E480 L485 G508	S479-H483 PolarHBondContact O-CE1 3.01Å; E480-H483 PolarHBondContact O-NE2 3.27Å; H483-L485 PolarHBondContact O-N 3.12Å; H483-G508 PolarHBondContact ND1-O 3.18Å
484	S	92.9	Very high	93.6	Very high	57 Å²	57	32.9 Å²	32.9	40%	0.399	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-1.2	178.8	-50.6	0	0	0	0	113.7	P453 L455 N482 K486	P453-S484 PolarHBondContact O-OG 2.92Å; P453-S484 VanDerWaalsContact O-OG 3.12Å; L455-S484 CarbonylContact O-C 3.54Å; N482-S484 PolarHBondContact O-N 2.88Å; S484-K486 PolarHBondContact O-N 3.05Å
485	L	95.9	Very high	93.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.			trans	-66.6	124.5	-173.6	-166.4	70.4	0	0	0	111.3	L455 L458 N482 H483 L488 L511	L455-L485 HydrophobicContact CD2-CD1 4.42Å; L455-L485 HydrophobicContact CG-CD1 4.37Å; L455-L485 WeakPolarHBondContact O-CA 3.29Å; L455-L485 PolarHBondContact O-N 3.4Å; L458-L485 HydrophobicContact CB-CD1 3.83Å; N482-L485 VanDerWaalsContact O-CB 3.26Å; N482-L485 WeakPolarHBondContact O-CB 3.37Å; N482-L485 PolarHBondContact O-N 3.2Å; H483-L485 PolarHBondContact O-N 3.12Å; L485-L488 HydrophobicContact CD2-CB 4.04Å; L485-L488 HydrophobicContact CD2-CD1 4.15Å; L485-L488 HydrophobicContact CD2-CD2 4.35Å; L485-L488 HydrophobicContact CD2-CG 4.41Å; L485-L511 HydrophobicContact CB-CD2 4.37Å; L485-L511 HydrophobicContact CD2-CD2 4.09Å; L485-L511 HydrophobicContact CG-CD2 3.96Å
486	K	96.4	Very high	93.2	Very high	97 Å²	97	33.3 Å²	33.3	42%	0.422	17%	0.172	S	C	.	.			trans	-110.5	-37	178.7	-67	176	168.3	-130.6	0	112.1	A456 S484 E512 E513	A456-K486 PolarHBondContact O-N 3.1Å; S484-K486 PolarHBondContact O-N 3.05Å; K486-E512 HydrophobicContact CB-CB 4.47Å; K486-E512 HydrophobicContact CB-CG 4.27Å; K486-E512 WeakPolarHBondContact CD-OE1 3.34Å; K486-E512 WeakPolarHBondContact CE-OE1 3.36Å; K486-E512 HydrophobicContact CG-CG 4.44Å; K486-E512 IonicContact NZ-OE1 3.44Å; K486-E512 PolarHBondContact NZ-OE1 3.03Å; K486-E512 PolarHBondContact O-N 3.28Å; K486-E513 PolarHBondContact O-N 3.44Å
487	V	97.9	Very high	92.9	Very high	33 Å²	33	37.1 Å²	37.1	20%	0.2	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	121	-178.2	-179	0	0	0	0	109	A456 S457 L458 E513	A456-V487 PolarHBondContact O-N 3.36Å; S457-V487 WeakPolarHBondContact CA-O 3.17Å; L458-V487 PolarHBondContact N-O 3.16Å; V487-E513 WeakPolarHBondContact CA-O 3.43Å; V487-E513 HydrophobicContact CB-CB 4.49Å; V487-E513 HydrophobicContact CG1-CB 4.2Å; V487-E513 HydrophobicContact CG2-CB 4.17Å; V487-E513 HydrophobicContact CG2-CG 4.28Å
488	L	97.9	Very high	92.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.3	175.9	178.4	59.4	0	0	0	110.7	L458 L485 F490 L505 L511 E513 L514 S515 F516	L458-L488 HydrophobicContact CB-CD1 4.14Å; L458-L488 HydrophobicContact CD2-CD1 3.99Å; L458-L488 HydrophobicContact CG-CD1 4.22Å; L485-L488 HydrophobicContact CD2-CB 4.04Å; L485-L488 HydrophobicContact CD2-CD1 4.15Å; L485-L488 HydrophobicContact CD2-CD2 4.35Å; L485-L488 HydrophobicContact CD2-CG 4.41Å; L488-F490 HydrophobicContact CD1-CD1 4.11Å; L488-F490 HydrophobicContact CD1-CE1 3.61Å; L488-F490 HydrophobicContact CD1-CE2 4.21Å; L488-F490 HydrophobicContact CD1-CZ 3.69Å; L488-F490 HydrophobicContact CD2-CE2 4.29Å; L488-F490 HydrophobicContact CD2-CZ 4.45Å; L488-F490 HydrophobicContact CG-CZ 4.47Å; L488-L505 HydrophobicContact CD2-CD2 3.57Å; L488-L511 HydrophobicContact CB-CD2 3.91Å; L488-E513 PolarHBondContact N-O 3.19Å; L488-L514 HydrophobicContact CB-CD1 3.96Å; L488-L514 HydrophobicContact CD2-CD1 3.86Å; L488-L514 HydrophobicContact CG-CD1 4.01Å; L488-L514 CarbonylContact O-C 3.48Å; L488-L514 WeakPolarHBondContact O-CA 3.43Å; L488-S515 PolarHBondContact O-N 2.97Å; L488-F516 HydrophobicContact CD2-CE1 4.36Å
489	T	97.8	Very high	92.5	Very high	26 Å²	26	38.9 Å²	38.9	16%	0.16	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.1	176.4	-58.7	0	0	0	0	110.2	L458 H459 I460 S515	L458-T489 PolarHBondContact O-N 2.97Å; H459-T489 CarbonylContact C-O 3.26Å; H459-T489 VanDerWaalsContact CA-O 3.29Å; H459-T489 WeakPolarHBondContact CA-O 3.4Å; H459-T489 VanDerWaalsContact CD2-CG2 3.45Å; H459-T489 WeakPolarHBondContact CD2-CG2 3.11Å; H459-T489 PolarHBondContact CD2-O 2.91Å; I460-T489 PolarHBondContact N-O 2.96Å; T489-S515 CarbonylContact C-O 3.58Å; T489-S515 WeakPolarHBondContact CA-O 3.48Å
490	F	96.8	Very high	92.4	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.2	164.4	-65.6	-28.8	0	0	0	109.9	L458 I460 L474 L475 L478 L488 I493 L495 S515 F516 N517 C519	L458-F490 HydrophobicContact CD2-CE1 4.37Å; I460-F490 HydrophobicContact CB-CD1 3.88Å; I460-F490 HydrophobicContact CB-CE1 4.02Å; I460-F490 HydrophobicContact CD1-CE1 3.81Å; I460-F490 HydrophobicContact CG1-CD1 4.29Å; I460-F490 HydrophobicContact CG1-CE1 3.96Å; I460-F490 WeakPolarHBondContact O-CA 3.34Å; L474-F490 HydrophobicContact CD2-CE1 4.19Å; L474-F490 HydrophobicContact CD2-CZ 3.9Å; L474-F490 HydrophobicContact CG-CZ 4.48Å; L475-F490 HydrophobicContact CD2-CE2 3.78Å; L475-F490 HydrophobicContact CD2-CZ 4.45Å; L478-F490 HydrophobicContact CD1-CZ 3.69Å; L488-F490 HydrophobicContact CD1-CD1 4.11Å; L488-F490 HydrophobicContact CD1-CE1 3.61Å; L488-F490 HydrophobicContact CD1-CE2 4.21Å; L488-F490 HydrophobicContact CD1-CZ 3.69Å; L488-F490 HydrophobicContact CD2-CE2 4.29Å; L488-F490 HydrophobicContact CD2-CZ 4.45Å; L488-F490 HydrophobicContact CG-CZ 4.47Å; F490-I493 HydrophobicContact CB-CB 4.46Å; F490-I493 HydrophobicContact CB-CD1 3.86Å; F490-I493 HydrophobicContact CB-CG1 4.3Å; F490-I493 HydrophobicContact CD1-CD1 3.69Å; F490-I493 HydrophobicContact CE1-CD1 4.39Å; F490-I493 HydrophobicContact CG-CD1 3.84Å; F490-L495 HydrophobicContact CD2-CD1 3.92Å; F490-S515 PolarHBondContact N-O 3.37Å; F490-F516 HydrophobicContact CB-CD1 4.08Å; F490-F516 AromaticContact CD2-CD1 3.92Å; F490-F516 HydrophobicContact CD2-CD1 3.92Å; F490-F516 AromaticContact CD2-CE1 3.55Å; F490-F516 HydrophobicContact CD2-CE1 3.55Å; F490-F516 HydrophobicContact CE2-CE1 4.18Å; F490-F516 HydrophobicContact CG-CD1 4.39Å; F490-F516 HydrophobicContact CG-CE1 4.36Å; F490-N517 PolarHBondContact O-N 2.86Å; F490-C519 PolarHBondContact O-SG 3.46Å; F490-C519 VanDerWaalsContact O-SG 3.4Å
491	E	94.9	Very high	92.4	Very high	79 Å²	79	39.3 Å²	39.3	37%	0.369	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	129	178.6	-173.5	169.7	-171.4	0	0	110.2	H459 I460 A461 G462 I493 N517	H459-E491 IonicContact NE2-OE2 2.99Å; I460-E491 PolarHBondContact O-N 2.93Å; A461-E491 CarbonylContact C-O 3.37Å; A461-E491 WeakPolarHBondContact CA-O 3.4Å; A461-E491 HydrophobicContact CB-CB 4.05Å; G462-E491 PolarHBondContact N-O 3.23Å; E491-I493 VanDerWaalsContact C-N 3.27Å; E491-I493 WeakPolarHBondContact O-CG1 3.48Å; E491-I493 PolarHBondContact O-N 2.83Å; E491-N517 CarbonylContact C-O 3.49Å; E491-N517 VanDerWaalsContact CA-O 3.28Å; E491-N517 WeakPolarHBondContact CA-O 3.36Å; E491-N517 HydrophobicContact CB-CB 4.42Å; E491-N517 HydrophobicContact CG-CB 4.21Å
492	D	91.6	Very high	92.5	Very high	45 Å²	45	38.1 Å²	38.1	24%	0.241	20%	0.201	C	C	.	.	S	Bend	trans	55.1	37.7	-179.5	-167.4	27.7	0	0	0	114.5	R464 N517 D518	R464-D492 IonicContact CZ-OD1 3.17Å; R464-D492 IonicContact CZ-OD2 3.66Å; R464-D492 IonicContact NE-OD2 3.58Å; R464-D492 PolarHBondContact NH1-O 2.74Å; R464-D492 IonicContact NH1-OD1 3.88Å; R464-D492 PolarHBondContact NH1-OD1 2.92Å; R464-D492 IonicContact NH1-OD2 2.58Å; R464-D492 IonicContact NH2-OD1 3.8Å; R464-D492 PolarHBondContact NH2-OD1 2.98Å; R464-D492 IonicContact NH2-OD2 2.95Å; R464-D492 PolarHBondContact NH2-OD2 3.39Å; D492-N517 PolarHBondContact N-O 3.4Å; D492-D518 WeakPolarHBondContact CA-O 3.36Å
493	I	90.4	Very high	92.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.205	C	C	.	.			trans	-108.1	129.7	177.3	-57.2	-171.4	0	0	0	110.1	I460 M463 Q471 F490 E491 L495 C519	I460-I493 HydrophobicContact CB-CD1 3.77Å; I460-I493 HydrophobicContact CG2-CD1 3.61Å; M463-I493 HydrophobicContact CB-CD1 4.33Å; M463-I493 HydrophobicContact CB-CG1 4.38Å; M463-I493 HydrophobicContact CE-CD1 4.31Å; Q471-I493 HydrophobicContact CG-CG2 3.84Å; F490-I493 HydrophobicContact CB-CB 4.46Å; F490-I493 HydrophobicContact CB-CD1 3.86Å; F490-I493 HydrophobicContact CB-CG1 4.3Å; F490-I493 HydrophobicContact CD1-CD1 3.69Å; F490-I493 HydrophobicContact CE1-CD1 4.39Å; F490-I493 HydrophobicContact CG-CD1 3.84Å; E491-I493 VanDerWaalsContact C-N 3.27Å; E491-I493 WeakPolarHBondContact O-CG1 3.48Å; E491-I493 PolarHBondContact O-N 2.83Å; I493-L495 HydrophobicContact CG2-CD2 3.85Å; I493-L495 HydrophobicContact CG2-CG 4.17Å; I493-L495 PolarHBondContact O-N 2.85Å; I493-L495 VanDerWaalsContact O-N 3.16Å; I493-C519 CarbonylContact O-C 3.21Å; I493-C519 WeakPolarHBondContact O-CA 3.25Å
494	K	89.8	Confident	92.5	Very high	81 Å²	81	38.1 Å²	38.1	35%	0.352	20%	0.201	S	C	.	.			trans	-76.6	105.4	179.5	-173.6	179.1	-179.4	178.4	0	111.8	Q471 C496	Q471-K494 WeakPolarHBondContact CG-O 3.42Å; K494-C496 WeakPolarHBondContact CE-SG 3.42Å
495	L	89.9	Confident	92.5	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	18%	0.182	C	C	.	.			trans	-112.6	12.4	-177.3	-62.3	-179.1	0	0	0	114.8	Q471 L475 F490 I493 D497 C498 I502 F516 C519 L521	Q471-L495 HydrophobicContact CB-CD2 3.81Å; Q471-L495 HydrophobicContact CG-CD2 4.12Å; L475-L495 HydrophobicContact CD1-CD2 4.37Å; F490-L495 HydrophobicContact CD2-CD1 3.92Å; I493-L495 HydrophobicContact CG2-CD2 3.85Å; I493-L495 HydrophobicContact CG2-CG 4.17Å; I493-L495 PolarHBondContact O-N 2.85Å; I493-L495 VanDerWaalsContact O-N 3.16Å; L495-D497 PolarHBondContact O-N 3.33Å; L495-D497 VanDerWaalsContact O-N 3.07Å; L495-C498 HydrophobicContact CD2-CB 4.49Å; L495-C498 PolarHBondContact O-N 3.36Å; L495-C498 VanDerWaalsContact O-N 3.09Å; L495-I502 HydrophobicContact CB-CD1 4.35Å; L495-I502 HydrophobicContact CD1-CD1 4.36Å; L495-F516 HydrophobicContact CD1-CD1 4.2Å; L495-F516 HydrophobicContact CD1-CE1 4.28Å; L495-C519 HydrophobicContact CB-CB 4.49Å; L495-C519 HydrophobicContact CD1-CB 3.89Å; L495-C519 HydrophobicContact CG-CB 4.24Å; L495-C519 PolarHBondContact N-O 3.3Å; L495-L521 HydrophobicContact CB-CD2 3.87Å; L495-L521 HydrophobicContact CD1-CD2 4.1Å
496	C	85.8	Confident	92.3	Very high	8 Å²	8	35.8 Å²	35.8	5%	0.054	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-30.1	-173.2	51	0	0	0	0	116.1	K494 R520 E523	K494-C496 WeakPolarHBondContact CE-SG 3.42Å; C496-R520 WeakPolarHBondContact CB-O 3.42Å; C496-E523 HydrophobicContact CB-CB 4.1Å; C496-E523 WeakPolarHBondContact CB-O 3.41Å
497	D	84.3	Confident	91.9	Very high	104 Å²	104	40.8 Å²	40.8	56%	0.556	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111	17.8	-175.7	-56	-55.2	0	0	0	112.2	L495	L495-D497 PolarHBondContact O-N 3.33Å; L495-D497 VanDerWaalsContact O-N 3.07Å
498	C	89.3	Confident	91.3	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.014	21%	0.206	C	C	.	.			trans	-114.4	12.4	-169.7	-60.8	0	0	0	0	114.3	S470 L475 L495 D501 I502	S470-C498 PolarHBondContact OG-SG 3.38Å; S470-C498 VanDerWaalsContact OG-SG 3.4Å; L475-C498 HydrophobicContact CD1-CB 3.51Å; L495-C498 HydrophobicContact CD2-CB 4.49Å; L495-C498 PolarHBondContact O-N 3.36Å; L495-C498 VanDerWaalsContact O-N 3.09Å; C498-D501 PolarHBondContact O-N 2.86Å; C498-D501 VanDerWaalsContact O-N 3.14Å; C498-I502 HydrophobicContact CB-CD1 4.43Å; C498-I502 WeakPolarHBondContact O-CG1 3.22Å; C498-I502 PolarHBondContact O-N 3.31Å
499	L	89.7	Confident	90.7	Very high	35 Å²	35	40.9 Å²	40.9	18%	0.183	21%	0.207	C	C	.	.	H	α-helix	trans	-53.4	-47.3	-177.8	-179.4	65.5	0	0	0	113.2	D501 I502 L503 L535	L499-D501 VanDerWaalsContact C-N 3.28Å; L499-D501 PolarHBondContact O-N 3.33Å; L499-I502 PolarHBondContact O-N 3.49Å; L499-L503 HydrophobicContact CD1-CD1 4.34Å; L499-L503 HydrophobicContact CD1-CD2 4.34Å; L499-L503 HydrophobicContact CD1-CG 4.11Å; L499-L503 HydrophobicContact CG-CD1 4.11Å; L499-L503 HydrophobicContact CG-CG 4.31Å; L499-L503 VanDerWaalsContact O-CG 3.27Å; L499-L503 WeakPolarHBondContact O-CG 3.27Å; L499-L503 PolarHBondContact O-N 3.12Å; L499-L535 HydrophobicContact CD1-CB 4.24Å
500	P	90	Very high	90.3	Very high	93 Å²	93	45.7 Å²	45.7	60%	0.604	23%	0.23	S	C	*	.	H	α-helix	trans	-57.9	-39.5	178.8	-24.9	35.7	0	0	0	113.3	L503 K504	P500-L503 PolarHBondContact O-N 3.25Å; P500-K504 PolarHBondContact O-N 3.1Å
501	D	92.2	Very high	90.2	Very high	30 Å²	30	45.7 Å²	45.7	16%	0.16	23%	0.23	C	C	.	.	H	α-helix	trans	-74.1	-36.6	-179.9	-57.5	-64	0	0	0	112.1	S472 L475 C498 L499 L503 K504 L505	S472-D501 WeakPolarHBondContact CB-OD2 3.34Å; S472-D501 PolarHBondContact OG-OD1 2.8Å; S472-D501 PolarHBondContact OG-OD2 3.46Å; L475-D501 HydrophobicContact CB-CB 3.69Å; L475-D501 HydrophobicContact CD1-CB 3.75Å; L475-D501 HydrophobicContact CG-CB 4.39Å; C498-D501 PolarHBondContact O-N 2.86Å; C498-D501 VanDerWaalsContact O-N 3.14Å; L499-D501 VanDerWaalsContact C-N 3.28Å; L499-D501 PolarHBondContact O-N 3.33Å; D501-L503 VanDerWaalsContact C-N 3.33Å; D501-K504 PolarHBondContact O-N 3.32Å; D501-L505 WeakPolarHBondContact O-CB 3.43Å; D501-L505 PolarHBondContact O-N 3.4Å
502	I	93.4	Very high	90.3	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-60	-46.4	171	-66.7	167.7	0	0	0	109.5	L475 L495 C498 L499 K504 L505 L506 F516 L521 L535	L475-I502 HydrophobicContact CD1-CG1 3.84Å; L475-I502 HydrophobicContact CD2-CG1 4.34Å; L495-I502 HydrophobicContact CB-CD1 4.35Å; L495-I502 HydrophobicContact CD1-CD1 4.36Å; C498-I502 HydrophobicContact CB-CD1 4.43Å; C498-I502 WeakPolarHBondContact O-CG1 3.22Å; C498-I502 PolarHBondContact O-N 3.31Å; L499-I502 PolarHBondContact O-N 3.49Å; I502-K504 VanDerWaalsContact C-N 3.32Å; I502-K504 PolarHBondContact O-N 3.1Å; I502-L505 WeakPolarHBondContact O-CB 3.14Å; I502-L505 PolarHBondContact O-N 2.92Å; I502-L506 HydrophobicContact CG2-CD1 4Å; I502-L506 HydrophobicContact CG2-CG 4.29Å; I502-L506 VanDerWaalsContact O-CG 3.31Å; I502-L506 WeakPolarHBondContact O-CG 3.32Å; I502-L506 PolarHBondContact O-N 2.76Å; I502-F516 HydrophobicContact CD1-CE2 4.46Å; I502-F516 HydrophobicContact CG2-CE2 3.92Å; I502-F516 HydrophobicContact CG2-CZ 4.16Å; I502-L521 HydrophobicContact CD1-CD2 3.82Å; I502-L535 HydrophobicContact CG2-CD1 3.87Å
503	L	92.9	Very high	90.6	Very high	17 Å²	17	47.4 Å²	47.4	9%	0.089	24%	0.236	C	C	.	.	H	α-helix	trans	-63.2	-37.7	177.9	-64.1	175.2	0	0	0	111.9	L499 P500 D501 R507 E534 A538	L499-L503 HydrophobicContact CD1-CD1 4.34Å; L499-L503 HydrophobicContact CD1-CD2 4.34Å; L499-L503 HydrophobicContact CD1-CG 4.11Å; L499-L503 HydrophobicContact CG-CD1 4.11Å; L499-L503 HydrophobicContact CG-CG 4.31Å; L499-L503 VanDerWaalsContact O-CG 3.27Å; L499-L503 WeakPolarHBondContact O-CG 3.27Å; L499-L503 PolarHBondContact O-N 3.12Å; P500-L503 PolarHBondContact O-N 3.25Å; D501-L503 VanDerWaalsContact C-N 3.33Å; L503-R507 VanDerWaalsContact O-CG 3.28Å; L503-R507 WeakPolarHBondContact O-CG 3.42Å; L503-R507 PolarHBondContact O-N 3.29Å; L503-E534 HydrophobicContact CD1-CB 4.45Å; L503-A538 HydrophobicContact CD2-CB 3.49Å; L503-A538 VanDerWaalsContact CD2-CB 3.49Å
504	K	92	Very high	90.9	Very high	90 Å²	90	47.5 Å²	47.5	39%	0.391	24%	0.236	S	C	.	.	H	α-helix	trans	-62.5	-45.5	173.4	-174	-174.4	173.8	-166.1	0	111	S479 E480 P500 D501 I502 R507 G508	S479-K504 WeakPolarHBondContact OG-CE 3.45Å; E480-K504 IonicContact OE1-NZ 2.74Å; E480-K504 PolarHBondContact OE1-NZ 3.48Å; P500-K504 PolarHBondContact O-N 3.1Å; D501-K504 PolarHBondContact O-N 3.32Å; I502-K504 VanDerWaalsContact C-N 3.32Å; I502-K504 PolarHBondContact O-N 3.1Å; K504-R507 PolarHBondContact O-N 3.35Å; K504-G508 PolarHBondContact O-N 3.25Å
505	L	93.4	Very high	91.3	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-61.2	-48.5	178.3	-178.8	67.9	0	0	0	112.2	L475 L478 L488 D501 I502 R507 G508 C509	L475-L505 HydrophobicContact CD2-CD2 3.81Å; L478-L505 HydrophobicContact CB-CD1 3.61Å; L488-L505 HydrophobicContact CD2-CD2 3.57Å; D501-L505 WeakPolarHBondContact O-CB 3.43Å; D501-L505 PolarHBondContact O-N 3.4Å; I502-L505 WeakPolarHBondContact O-CB 3.14Å; I502-L505 PolarHBondContact O-N 2.92Å; L505-R507 PolarHBondContact O-N 3.26Å; L505-G508 PolarHBondContact O-N 3.16Å; L505-C509 PolarHBondContact O-N 2.8Å; L505-C509 VanDerWaalsContact O-N 3.13Å
506	L	91.9	Very high	91.6	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.037	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-28.3	-180	-67.4	177	0	0	0	113	I502 L511 L514 L535 A538 L539	I502-L506 HydrophobicContact CG2-CD1 4Å; I502-L506 HydrophobicContact CG2-CG 4.29Å; I502-L506 VanDerWaalsContact O-CG 3.31Å; I502-L506 WeakPolarHBondContact O-CG 3.32Å; I502-L506 PolarHBondContact O-N 2.76Å; L506-L511 HydrophobicContact CD2-CD1 3.9Å; L506-L514 HydrophobicContact CD2-CD2 3.78Å; L506-L535 HydrophobicContact CD1-CD1 3.91Å; L506-A538 HydrophobicContact CB-CB 4.3Å; L506-A538 HydrophobicContact CD1-CB 3.77Å; L506-L539 HydrophobicContact CD1-CD2 3.97Å; L506-L539 HydrophobicContact CD1-CG 4.31Å; L506-L539 HydrophobicContact CD2-CD2 4.25Å
507	R	88.8	Confident	92	Very high	201 Å²	201	44.9 Å²	44.9	76%	0.758	23%	0.227	S	C	*	.	H	α-helix	trans	-78.8	-25.4	174.5	-69.3	172.3	-168.6	162.8	5.2	113.2	L503 K504 L505	L503-R507 VanDerWaalsContact O-CG 3.28Å; L503-R507 WeakPolarHBondContact O-CG 3.42Å; L503-R507 PolarHBondContact O-N 3.29Å; K504-R507 PolarHBondContact O-N 3.35Å; L505-R507 PolarHBondContact O-N 3.26Å
508	G	84.1	Confident	92.5	Very high	33 Å²	33	42 Å²	42	34%	0.34	21%	0.212	S	C	.	.	H	α-helix	trans	-96.8	-13.4	-173.1	0	0	0	0	0	115.3	H483 K504 L505	H483-G508 PolarHBondContact ND1-O 3.18Å; K504-G508 PolarHBondContact O-N 3.25Å; L505-G508 PolarHBondContact O-N 3.16Å
509	C	86.5	Confident	92.6	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.02	21%	0.211	C	C	.	.			trans	-122.3	146.1	-176.2	-62.8	0	0	0	0	111.6	L505 L511 M541	L505-C509 PolarHBondContact O-N 2.8Å; L505-C509 VanDerWaalsContact O-N 3.13Å; C509-L511 VanDerWaalsContact C-N 3.34Å; C509-L511 HydrophobicContact CB-CD2 4.44Å; C509-L511 HydrophobicContact CB-CG 4Å; C509-L511 PolarHBondContact O-N 3.4Å; C509-M541 VanDerWaalsContact O-CE 3.25Å; C509-M541 WeakPolarHBondContact O-CE 3.34Å
510	M	88.9	Confident	92.5	Very high	127 Å²	127	44 Å²	44	63%	0.626	22%	0.217	S	C	*	.			trans	-94.9	62.2	175.1	-65.9	-65.4	-72.5	0	0	110.5	E512	M510-E512 PolarHBondContact O-N 2.75Å
511	L	95.1	Very high	92.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.192	C	C	.	.			trans	-63.9	134.8	-177	-66.5	169.4	0	0	0	111.5	L485 L488 L506 C509 L514 M541 S543 L544	L485-L511 HydrophobicContact CB-CD2 4.37Å; L485-L511 HydrophobicContact CD2-CD2 4.09Å; L485-L511 HydrophobicContact CG-CD2 3.96Å; L488-L511 HydrophobicContact CB-CD2 3.91Å; L506-L511 HydrophobicContact CD2-CD1 3.9Å; C509-L511 VanDerWaalsContact C-N 3.34Å; C509-L511 HydrophobicContact CB-CD2 4.44Å; C509-L511 HydrophobicContact CB-CG 4Å; C509-L511 PolarHBondContact O-N 3.4Å; L511-L514 HydrophobicContact CD1-CD1 4.21Å; L511-M541 HydrophobicContact CB-CE 4Å; L511-M541 HydrophobicContact CB-SD 4.37Å; L511-S543 CarbonylContact O-C 3.59Å; L511-S543 VanDerWaalsContact O-C 3.26Å; L511-S543 WeakPolarHBondContact O-CB 3.48Å; L511-S543 PolarHBondContact O-OG 3.09Å; L511-L544 HydrophobicContact CB-CD1 4.32Å; L511-L544 WeakPolarHBondContact O-CA 3.44Å; L511-L544 PolarHBondContact O-N 3.16Å
512	E	96.1	Very high	91.7	Very high	69 Å²	69	40.1 Å²	40.1	32%	0.322	19%	0.191	S	C	.	.	S	Bend	trans	-98.7	-33.9	172.3	-62.9	178.7	-160.8	0	0	111.1	K486 M510 S543 H545 S546	K486-E512 HydrophobicContact CB-CB 4.47Å; K486-E512 HydrophobicContact CB-CG 4.27Å; K486-E512 WeakPolarHBondContact CD-OE1 3.34Å; K486-E512 WeakPolarHBondContact CE-OE1 3.36Å; K486-E512 HydrophobicContact CG-CG 4.44Å; K486-E512 IonicContact NZ-OE1 3.44Å; K486-E512 PolarHBondContact NZ-OE1 3.03Å; K486-E512 PolarHBondContact O-N 3.28Å; M510-E512 PolarHBondContact O-N 2.75Å; E512-S543 WeakPolarHBondContact CA-O 3.27Å; E512-H545 PolarHBondContact O-N 2.91Å; E512-S546 PolarHBondContact O-N 3.24Å
513	E	97.4	Very high	91	Very high	91 Å²	91	43.1 Å²	43.1	43%	0.425	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	130.5	178.2	-54.3	-173.5	-173	0	0	111.2	K486 V487 L488 S546	K486-E513 PolarHBondContact O-N 3.44Å; V487-E513 WeakPolarHBondContact CA-O 3.43Å; V487-E513 HydrophobicContact CB-CB 4.49Å; V487-E513 HydrophobicContact CG1-CB 4.2Å; V487-E513 HydrophobicContact CG2-CB 4.17Å; V487-E513 HydrophobicContact CG2-CG 4.28Å; L488-E513 PolarHBondContact N-O 3.19Å; E513-S546 WeakPolarHBondContact CA-O 3.2Å
514	L	97.6	Very high	90	Very high	1 Å²	1	49 Å²	49	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	125.7	177.2	-179.4	63.7	0	0	0	110.7	L488 L506 L511 F516 L539 L544 S546 L547 S548	L488-L514 HydrophobicContact CB-CD1 3.96Å; L488-L514 HydrophobicContact CD2-CD1 3.86Å; L488-L514 HydrophobicContact CG-CD1 4.01Å; L488-L514 CarbonylContact O-C 3.48Å; L488-L514 WeakPolarHBondContact O-CA 3.43Å; L506-L514 HydrophobicContact CD2-CD2 3.78Å; L511-L514 HydrophobicContact CD1-CD1 4.21Å; L514-F516 HydrophobicContact CD1-CD1 4.17Å; L514-F516 HydrophobicContact CD1-CE1 3.65Å; L514-F516 HydrophobicContact CD1-CE2 4.19Å; L514-F516 HydrophobicContact CD1-CZ 3.68Å; L514-F516 HydrophobicContact CD2-CD2 4.43Å; L514-F516 HydrophobicContact CD2-CE2 3.98Å; L514-F516 HydrophobicContact CD2-CZ 4.23Å; L514-F516 HydrophobicContact CG-CE1 4.48Å; L514-F516 HydrophobicContact CG-CE2 4.33Å; L514-F516 HydrophobicContact CG-CZ 4.32Å; L514-L539 HydrophobicContact CD2-CD2 3.58Å; L514-L544 HydrophobicContact CB-CD1 3.85Å; L514-S546 PolarHBondContact N-O 3.36Å; L514-L547 HydrophobicContact CB-CD1 4.23Å; L514-L547 HydrophobicContact CD2-CD1 4.07Å; L514-L547 HydrophobicContact CG-CD1 4.25Å; L514-L547 CarbonylContact O-C 3.1Å; L514-L547 VanDerWaalsContact O-CA 3.27Å; L514-L547 WeakPolarHBondContact O-CA 3.42Å; L514-S548 PolarHBondContact O-N 3.38Å
515	S	97.5	Very high	89.2	Confident	19 Å²	19	46.2 Å²	46.2	13%	0.133	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	115.6	175.9	-67.6	0	0	0	0	110.3	L488 T489 F490	L488-S515 PolarHBondContact O-N 2.97Å; T489-S515 CarbonylContact C-O 3.58Å; T489-S515 WeakPolarHBondContact CA-O 3.48Å; F490-S515 PolarHBondContact N-O 3.37Å
516	F	96.8	Very high	88.4	Confident	1 Å²	1	54.7 Å²	54.7	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	90.4	167.5	-66.5	-30.4	0	0	0	108.2	L488 F490 L495 I502 L514 C519 L521 S548 L549 N552	L488-F516 HydrophobicContact CD2-CE1 4.36Å; F490-F516 HydrophobicContact CB-CD1 4.08Å; F490-F516 AromaticContact CD2-CD1 3.92Å; F490-F516 HydrophobicContact CD2-CD1 3.92Å; F490-F516 AromaticContact CD2-CE1 3.55Å; F490-F516 HydrophobicContact CD2-CE1 3.55Å; F490-F516 HydrophobicContact CE2-CE1 4.18Å; F490-F516 HydrophobicContact CG-CD1 4.39Å; F490-F516 HydrophobicContact CG-CE1 4.36Å; L495-F516 HydrophobicContact CD1-CD1 4.2Å; L495-F516 HydrophobicContact CD1-CE1 4.28Å; I502-F516 HydrophobicContact CD1-CE2 4.46Å; I502-F516 HydrophobicContact CG2-CE2 3.92Å; I502-F516 HydrophobicContact CG2-CZ 4.16Å; L514-F516 HydrophobicContact CD1-CD1 4.17Å; L514-F516 HydrophobicContact CD1-CE1 3.65Å; L514-F516 HydrophobicContact CD1-CE2 4.19Å; L514-F516 HydrophobicContact CD1-CZ 3.68Å; L514-F516 HydrophobicContact CD2-CD2 4.43Å; L514-F516 HydrophobicContact CD2-CE2 3.98Å; L514-F516 HydrophobicContact CD2-CZ 4.23Å; L514-F516 HydrophobicContact CG-CE1 4.48Å; L514-F516 HydrophobicContact CG-CE2 4.33Å; L514-F516 HydrophobicContact CG-CZ 4.32Å; F516-C519 HydrophobicContact CB-CB 4.05Å; F516-L521 HydrophobicContact CB-CD1 3.94Å; F516-L521 HydrophobicContact CD2-CD1 3.99Å; F516-L521 HydrophobicContact CD2-CD2 4.15Å; F516-L521 HydrophobicContact CG-CD1 4.39Å; F516-S548 PolarHBondContact N-O 3.26Å; F516-L549 HydrophobicContact CB-CD2 4.2Å; F516-L549 HydrophobicContact CD2-CD2 4.37Å; F516-N552 PolarHBondContact O-ND2 2.77Å
517	N	94.8	Very high	88	Confident	16 Å²	16	58.1 Å²	58.1	9%	0.086	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	127.5	-176.5	-65	-27.9	0	0	0	110.1	F490 E491 D492 C519 S548 A550	F490-N517 PolarHBondContact O-N 2.86Å; E491-N517 CarbonylContact C-O 3.49Å; E491-N517 VanDerWaalsContact CA-O 3.28Å; E491-N517 WeakPolarHBondContact CA-O 3.36Å; E491-N517 HydrophobicContact CB-CB 4.42Å; E491-N517 HydrophobicContact CG-CB 4.21Å; D492-N517 PolarHBondContact N-O 3.4Å; N517-C519 PolarHBondContact O-N 2.98Å; N517-C519 VanDerWaalsContact O-N 3.13Å; N517-C519 PolarHBondContact O-SG 2.82Å; N517-C519 VanDerWaalsContact O-SG 3.33Å; N517-S548 PolarHBondContact OD1-OG 3.1Å; N517-A550 WeakPolarHBondContact CA-O 3.48Å; N517-A550 WeakPolarHBondContact OD1-CB 3.46Å
518	D	93.2	Very high	87.9	Confident	44 Å²	44	50.4 Å²	50.4	24%	0.235	26%	0.259	C	S	.	.	S	Bend	trans	48.3	40.8	-176.4	-165.6	16	0	0	0	112.8	D492 R520 A550 Q551	D492-D518 WeakPolarHBondContact CA-O 3.36Å; D518-R520 VanDerWaalsContact C-N 3.32Å; D518-A550 PolarHBondContact N-O 2.98Å; D518-Q551 HydrophobicContact CB-CB 3.87Å
519	C	92.2	Very high	88	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.			trans	-90.5	3	-173.2	-76.8	0	0	0	0	113.8	F490 I493 L495 F516 N517 L521 N552	F490-C519 PolarHBondContact O-SG 3.46Å; F490-C519 VanDerWaalsContact O-SG 3.4Å; I493-C519 CarbonylContact O-C 3.21Å; I493-C519 WeakPolarHBondContact O-CA 3.25Å; L495-C519 HydrophobicContact CB-CB 4.49Å; L495-C519 HydrophobicContact CD1-CB 3.89Å; L495-C519 HydrophobicContact CG-CB 4.24Å; L495-C519 PolarHBondContact N-O 3.3Å; F516-C519 HydrophobicContact CB-CB 4.05Å; N517-C519 PolarHBondContact O-N 2.98Å; N517-C519 VanDerWaalsContact O-N 3.13Å; N517-C519 PolarHBondContact O-SG 2.82Å; N517-C519 VanDerWaalsContact O-SG 3.33Å; C519-L521 HydrophobicContact CB-CD2 4.33Å; C519-L521 HydrophobicContact CB-CG 4.04Å; C519-L521 PolarHBondContact O-N 3.22Å; C519-N552 PolarHBondContact N-OD1 2.76Å; C519-N552 VanDerWaalsContact N-OD1 3.13Å
520	R	88.1	Confident	88.1	Confident	80 Å²	80	59 Å²	59	30%	0.302	29%	0.288	S	S	.	.			trans	50.2	34.2	179.6	-61.7	163.1	176.8	-130.9	14	112.7	C496 D518 L522 E523 N552	C496-R520 WeakPolarHBondContact CB-O 3.42Å; D518-R520 VanDerWaalsContact C-N 3.32Å; R520-L522 PolarHBondContact O-N 3.48Å; R520-E523 HydrophobicContact CB-CB 4Å; R520-E523 WeakPolarHBondContact CB-OE2 3.24Å; R520-E523 WeakPolarHBondContact CD-OE2 3.36Å; R520-E523 VanDerWaalsContact CG-OE2 3.29Å; R520-E523 WeakPolarHBondContact CG-OE2 3.46Å; R520-E523 IonicContact CZ-OE2 3.72Å; R520-E523 IonicContact NE-OE2 2.85Å; R520-E523 IonicContact NH1-OE1 3.52Å; R520-E523 IonicContact NH1-OE2 3.97Å; R520-E523 PolarHBondContact NH1-OE2 2.92Å; R520-E523 VanDerWaalsContact NH1-OE2 3.17Å; R520-E523 WeakPolarHBondContact O-CB 3.35Å; R520-E523 PolarHBondContact O-N 3.04Å; R520-N552 PolarHBondContact N-OD1 3.49Å
521	L	84.2	Confident	88.1	Confident	16 Å²	16	54 Å²	54	8%	0.084	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-34.6	-171.1	-71.4	168.3	0	0	0	113.5	L495 I502 F516 C519 L549 N552	L495-L521 HydrophobicContact CB-CD2 3.87Å; L495-L521 HydrophobicContact CD1-CD2 4.1Å; I502-L521 HydrophobicContact CD1-CD2 3.82Å; F516-L521 HydrophobicContact CB-CD1 3.94Å; F516-L521 HydrophobicContact CD2-CD1 3.99Å; F516-L521 HydrophobicContact CD2-CD2 4.15Å; F516-L521 HydrophobicContact CG-CD1 4.39Å; C519-L521 HydrophobicContact CB-CD2 4.33Å; C519-L521 HydrophobicContact CB-CG 4.04Å; C519-L521 PolarHBondContact O-N 3.22Å; L521-L549 HydrophobicContact CD1-CD2 3.93Å; L521-N552 WeakPolarHBondContact CG-OD1 3.37Å; L521-N552 PolarHBondContact N-OD1 2.95Å
522	L	81.7	Confident	87.9	Confident	25 Å²	25	54.1 Å²	54.1	13%	0.131	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	2	-175.2	-51.9	179.1	0	0	0	113.2	R520 K524 C525 P528 L532 L554	R520-L522 PolarHBondContact O-N 3.48Å; L522-K524 PolarHBondContact O-N 3.48Å; L522-C525 PolarHBondContact O-N 3.14Å; L522-P528 HydrophobicContact CB-CB 4.22Å; L522-P528 HydrophobicContact CD1-CB 4.41Å; L522-P528 HydrophobicContact CD2-CB 4.45Å; L522-L532 HydrophobicContact CD1-CD1 3.64Å; L522-L532 HydrophobicContact CD1-CD2 4.13Å; L522-L532 HydrophobicContact CD1-CG 3.87Å; L522-L532 HydrophobicContact CD2-CD1 4.43Å; L522-L532 HydrophobicContact CD2-CD2 3.98Å; L522-L532 HydrophobicContact CD2-CG 3.76Å; L522-L532 HydrophobicContact CG-CG 4.44Å; L522-L554 HydrophobicContact CD1-CD2 3.73Å
523	E	78.2	Confident	87.7	Confident	64 Å²	64	53.4 Å²	53.4	30%	0.299	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	138	174.1	-157.9	-175.4	139.7	0	0	108	C496 R520 C525	C496-E523 HydrophobicContact CB-CB 4.1Å; C496-E523 WeakPolarHBondContact CB-O 3.41Å; R520-E523 HydrophobicContact CB-CB 4Å; R520-E523 WeakPolarHBondContact CB-OE2 3.24Å; R520-E523 WeakPolarHBondContact CD-OE2 3.36Å; R520-E523 VanDerWaalsContact CG-OE2 3.29Å; R520-E523 WeakPolarHBondContact CG-OE2 3.46Å; R520-E523 IonicContact CZ-OE2 3.72Å; R520-E523 IonicContact NE-OE2 2.85Å; R520-E523 IonicContact NH1-OE1 3.52Å; R520-E523 IonicContact NH1-OE2 3.97Å; R520-E523 PolarHBondContact NH1-OE2 2.92Å; R520-E523 VanDerWaalsContact NH1-OE2 3.17Å; R520-E523 WeakPolarHBondContact O-CB 3.35Å; R520-E523 PolarHBondContact O-N 3.04Å; E523-C525 PolarHBondContact O-N 3.37Å
524	K	70.9	Confident	87.4	Confident	142 Å²	142	53 Å²	53	62%	0.617	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	1.8	-179.9	-51.9	-176.1	175.6	-168	0	117.4	L522 I526	L522-K524 PolarHBondContact O-N 3.48Å; K524-I526 PolarHBondContact O-N 3.32Å
525	C	75.8	Confident	87.2	Confident	31 Å²	31	53.3 Å²	53.3	21%	0.209	27%	0.266	C	S	.	.			trans	-66.2	124.9	172.1	-84.1	0	0	0	0	111	L522 E523 N527 P528	L522-C525 PolarHBondContact O-N 3.14Å; E523-C525 PolarHBondContact O-N 3.37Å; C525-N527 VanDerWaalsContact C-N 3.29Å; C525-N527 PolarHBondContact O-N 3.01Å; C525-P528 HydrophobicContact CB-CB 4.33Å
526	I	76.6	Confident	87	Confident	179 Å²	179	52.4 Å²	52.4	92%	0.918	26%	0.26	S	S	*	.	S	Bend	trans	-62.2	-39	177.2	-60.2	173.1	0	0	0	110.9	K524	K524-I526 PolarHBondContact O-N 3.32Å
527	N	84.3	Confident	86.8	Confident	79 Å²	79	55.4 Å²	55.4	42%	0.422	28%	0.284	S	S	.	.	S	Bend	trans	-132.8	88.9	175.5	-171.8	-17.6	0	0	0	110.1	C525 E529 K530 S531	C525-N527 VanDerWaalsContact C-N 3.29Å; C525-N527 PolarHBondContact O-N 3.01Å; N527-E529 VanDerWaalsContact C-N 3.26Å; N527-E529 PolarHBondContact O-N 3.32Å; N527-E529 PolarHBondContact OD1-N 2.99Å; N527-K530 HydrophobicContact CB-CB 4.1Å; N527-K530 PolarHBondContact O-N 2.8Å; N527-K530 PolarHBondContact OD1-N 2.82Å; N527-K530 VanDerWaalsContact OD1-N 3.15Å; N527-S531 PolarHBondContact O-N 3.4Å; N527-S531 VanDerWaalsContact O-N 3.14Å; N527-S531 PolarHBondContact O-OG 3.44Å
528	P	85.2	Confident	86.7	Confident	39 Å²	39	55.7 Å²	55.7	25%	0.253	29%	0.289	S	S	.	.	H	α-helix	trans	-65.8	-28.3	-175.4	26.8	-35	0	0	0	113.1	L522 C525 L532	L522-P528 HydrophobicContact CB-CB 4.22Å; L522-P528 HydrophobicContact CD1-CB 4.41Å; L522-P528 HydrophobicContact CD2-CB 4.45Å; C525-P528 HydrophobicContact CB-CB 4.33Å; P528-L532 WeakPolarHBondContact O-CB 3.38Å; P528-L532 WeakPolarHBondContact O-CG 3.39Å; P528-L532 PolarHBondContact O-N 3Å
529	E	87.2	Confident	86.7	Confident	93 Å²	93	53.7 Å²	53.7	44%	0.435	28%	0.278	S	S	.	.	H	α-helix	trans	-66.7	-49	176.6	-173.2	173.8	179.3	0	0	110.5	N527 S531 L532 V533 V560	N527-E529 VanDerWaalsContact C-N 3.26Å; N527-E529 PolarHBondContact O-N 3.32Å; N527-E529 PolarHBondContact OD1-N 2.99Å; E529-S531 PolarHBondContact O-N 2.85Å; E529-L532 PolarHBondContact O-N 3.38Å; E529-V533 WeakPolarHBondContact O-CG2 3.38Å; E529-V533 PolarHBondContact O-N 3.17Å; E529-V560 HydrophobicContact CG-CG2 3.85Å
530	K	88.4	Confident	86.7	Confident	123 Å²	123	56 Å²	56	54%	0.535	29%	0.288	S	S	.	.	H	α-helix	trans	-60.7	-44.3	176.7	-173.3	-177.9	176.3	-171.9	0	112.1	N527 L532 V533 E534	N527-K530 HydrophobicContact CB-CB 4.1Å; N527-K530 PolarHBondContact O-N 2.8Å; N527-K530 PolarHBondContact OD1-N 2.82Å; N527-K530 VanDerWaalsContact OD1-N 3.15Å; K530-L532 VanDerWaalsContact C-N 3.29Å; K530-L532 PolarHBondContact O-N 3.07Å; K530-V533 PolarHBondContact O-N 3.03Å; K530-E534 WeakPolarHBondContact CE-OE1 3.26Å; K530-E534 PolarHBondContact O-N 2.88Å
531	S	88.5	Confident	86.7	Confident	23 Å²	23	53 Å²	53	16%	0.161	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-40.5	176.4	-63.6	0	0	0	0	112.2	N527 E529 E534 L535	N527-S531 PolarHBondContact O-N 3.4Å; N527-S531 VanDerWaalsContact O-N 3.14Å; N527-S531 PolarHBondContact O-OG 3.44Å; E529-S531 PolarHBondContact O-N 2.85Å; S531-E534 PolarHBondContact O-N 3.13Å; S531-L535 WeakPolarHBondContact O-CB 3.45Å; S531-L535 PolarHBondContact O-N 2.98Å
532	L	90.9	Very high	86.9	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-67.7	-38.3	175.4	-81.6	174.3	0	0	0	112.7	L522 P528 E529 K530 E534 L535 V536 L554 N557 V560	L522-L532 HydrophobicContact CD1-CD1 3.64Å; L522-L532 HydrophobicContact CD1-CD2 4.13Å; L522-L532 HydrophobicContact CD1-CG 3.87Å; L522-L532 HydrophobicContact CD2-CD1 4.43Å; L522-L532 HydrophobicContact CD2-CD2 3.98Å; L522-L532 HydrophobicContact CD2-CG 3.76Å; L522-L532 HydrophobicContact CG-CG 4.44Å; P528-L532 WeakPolarHBondContact O-CB 3.38Å; P528-L532 WeakPolarHBondContact O-CG 3.39Å; P528-L532 PolarHBondContact O-N 3Å; E529-L532 PolarHBondContact O-N 3.38Å; K530-L532 VanDerWaalsContact C-N 3.29Å; K530-L532 PolarHBondContact O-N 3.07Å; L532-E534 VanDerWaalsContact C-N 3.32Å; L532-E534 PolarHBondContact O-N 3.24Å; L532-L535 HydrophobicContact CD2-CD2 4.37Å; L532-L535 PolarHBondContact O-N 3.28Å; L532-V536 WeakPolarHBondContact O-CB 3.4Å; L532-V536 VanDerWaalsContact O-CG2 3.27Å; L532-V536 WeakPolarHBondContact O-CG2 3.26Å; L532-V536 PolarHBondContact O-N 3.32Å; L532-L554 HydrophobicContact CD1-CD2 4.3Å; L532-L554 HydrophobicContact CD2-CD2 4.13Å; L532-N557 HydrophobicContact CD1-CB 3.45Å; L532-N557 VanDerWaalsContact CD1-CB 3.45Å; L532-V560 HydrophobicContact CB-CB 4.38Å; L532-V560 HydrophobicContact CB-CG1 4.01Å
533	V	91.9	Very high	87.4	Confident	54 Å²	54	56.4 Å²	56.4	33%	0.327	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-45.4	175.3	170.9	0	0	0	0	110.4	E529 K530 L535 V536 A537 V560	E529-V533 WeakPolarHBondContact O-CG2 3.38Å; E529-V533 PolarHBondContact O-N 3.17Å; K530-V533 PolarHBondContact O-N 3.03Å; V533-L535 PolarHBondContact O-N 2.95Å; V533-V536 PolarHBondContact O-N 3.45Å; V533-A537 WeakPolarHBondContact O-CB 3.32Å; V533-A537 PolarHBondContact O-N 3.18Å; V533-V560 HydrophobicContact CB-CG1 4.46Å; V533-V560 HydrophobicContact CG2-CG1 3.64Å
534	E	92.1	Very high	88.2	Confident	83 Å²	83	53.4 Å²	53.4	39%	0.388	29%	0.289	S	S	.	.	H	α-helix	trans	-62.5	-41.9	176.7	-69.9	178.5	-161.8	0	0	111.9	L503 K530 S531 L532 A537 A538	L503-E534 HydrophobicContact CD1-CB 4.45Å; K530-E534 WeakPolarHBondContact CE-OE1 3.26Å; K530-E534 PolarHBondContact O-N 2.88Å; S531-E534 PolarHBondContact O-N 3.13Å; L532-E534 VanDerWaalsContact C-N 3.32Å; L532-E534 PolarHBondContact O-N 3.24Å; E534-A537 PolarHBondContact O-N 2.91Å; E534-A538 PolarHBondContact O-N 3.13Å
535	L	92.9	Very high	89.3	Confident	6 Å²	6	50 Å²	50	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-48	175.8	-178.1	63.1	0	0	0	111.9	L499 I502 L506 S531 L532 V533 A537 A538 L539	L499-L535 HydrophobicContact CD1-CB 4.24Å; I502-L535 HydrophobicContact CG2-CD1 3.87Å; L506-L535 HydrophobicContact CD1-CD1 3.91Å; S531-L535 WeakPolarHBondContact O-CB 3.45Å; S531-L535 PolarHBondContact O-N 2.98Å; L532-L535 HydrophobicContact CD2-CD2 4.37Å; L532-L535 PolarHBondContact O-N 3.28Å; V533-L535 PolarHBondContact O-N 2.95Å; L535-A537 VanDerWaalsContact C-N 3.28Å; L535-A537 PolarHBondContact O-N 3.13Å; L535-A538 PolarHBondContact O-N 2.9Å; L535-A538 VanDerWaalsContact O-N 3.07Å; L535-L539 HydrophobicContact CD1-CD1 4.3Å; L535-L539 HydrophobicContact CD1-CG 4.37Å; L535-L539 HydrophobicContact CD2-CD1 4.43Å; L535-L539 HydrophobicContact CG-CD1 3.83Å; L535-L539 HydrophobicContact CG-CG 4.34Å; L535-L539 VanDerWaalsContact O-CG 3.27Å; L535-L539 WeakPolarHBondContact O-CG 3.31Å; L535-L539 PolarHBondContact O-N 3.33Å
536	V	93.9	Very high	90.3	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-59.3	-40	178.4	164.4	0	0	0	0	111.1	L532 V533 A538 L539 K540 V560 L561 E563 L564	L532-V536 WeakPolarHBondContact O-CB 3.4Å; L532-V536 VanDerWaalsContact O-CG2 3.27Å; L532-V536 WeakPolarHBondContact O-CG2 3.26Å; L532-V536 PolarHBondContact O-N 3.32Å; V533-V536 PolarHBondContact O-N 3.45Å; V536-A538 VanDerWaalsContact C-N 3.31Å; V536-A538 PolarHBondContact O-N 2.7Å; V536-L539 PolarHBondContact O-N 2.83Å; V536-K540 WeakPolarHBondContact O-CG 3.29Å; V536-K540 PolarHBondContact O-N 3.4Å; V536-V560 HydrophobicContact CG2-CG1 4.32Å; V536-L561 HydrophobicContact CG2-CD2 3.69Å; V536-E563 HydrophobicContact CG1-CB 3.94Å; V536-L564 HydrophobicContact CB-CD2 4.45Å; V536-L564 HydrophobicContact CG1-CD2 3.88Å; V536-L564 HydrophobicContact CG1-CG 3.9Å; V536-L564 HydrophobicContact CG2-CD2 4.49Å; V536-L564 HydrophobicContact CG2-CG 4.43Å
537	A	92.6	Very high	91.3	Very high	63 Å²	63	41 Å²	41	52%	0.521	23%	0.228	S	C	.	.	H	α-helix	trans	-60.5	-40.2	175.4	0	0	0	0	0	112.2	V533 E534 L535	V533-A537 WeakPolarHBondContact O-CB 3.32Å; V533-A537 PolarHBondContact O-N 3.18Å; E534-A537 PolarHBondContact O-N 2.91Å; L535-A537 VanDerWaalsContact C-N 3.28Å; L535-A537 PolarHBondContact O-N 3.13Å
538	A	92.1	Very high	91.9	Very high	23 Å²	23	37.4 Å²	37.4	19%	0.19	21%	0.21	C	C	.	.	H	α-helix	trans	-73.7	-28.7	176.7	0	0	0	0	0	113.6	L503 L506 E534 L535 V536 K540	L503-A538 HydrophobicContact CD2-CB 3.49Å; L503-A538 VanDerWaalsContact CD2-CB 3.49Å; L506-A538 HydrophobicContact CB-CB 4.3Å; L506-A538 HydrophobicContact CD1-CB 3.77Å; E534-A538 PolarHBondContact O-N 3.13Å; L535-A538 PolarHBondContact O-N 2.9Å; L535-A538 VanDerWaalsContact O-N 3.07Å; V536-A538 VanDerWaalsContact C-N 3.31Å; V536-A538 PolarHBondContact O-N 2.7Å; A538-K540 PolarHBondContact O-N 3.26Å
539	L	93.4	Very high	92.5	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-75.7	-8	178.3	-68.8	169.4	0	0	0	113.9	L506 L514 L535 V536 M541 L544 L547 L564	L506-L539 HydrophobicContact CD1-CD2 3.97Å; L506-L539 HydrophobicContact CD1-CG 4.31Å; L506-L539 HydrophobicContact CD2-CD2 4.25Å; L514-L539 HydrophobicContact CD2-CD2 3.58Å; L535-L539 HydrophobicContact CD1-CD1 4.3Å; L535-L539 HydrophobicContact CD1-CG 4.37Å; L535-L539 HydrophobicContact CD2-CD1 4.43Å; L535-L539 HydrophobicContact CG-CD1 3.83Å; L535-L539 HydrophobicContact CG-CG 4.34Å; L535-L539 VanDerWaalsContact O-CG 3.27Å; L535-L539 WeakPolarHBondContact O-CG 3.31Å; L535-L539 PolarHBondContact O-N 3.33Å; V536-L539 PolarHBondContact O-N 2.83Å; L539-M541 PolarHBondContact O-N 2.85Å; L539-L544 HydrophobicContact CD2-CD2 3.94Å; L539-L547 HydrophobicContact CD1-CD1 4.39Å; L539-L547 HydrophobicContact CD1-CD2 3.84Å; L539-L547 HydrophobicContact CD2-CD1 4.2Å; L539-L564 HydrophobicContact CB-CD2 3.76Å
540	K	91.6	Very high	92.7	Very high	48 Å²	48	31.2 Å²	31.2	21%	0.209	18%	0.177	C	C	.	.			trans	-74.1	41.5	172.8	-70.2	172.3	177.7	-165.9	0	112.6	V536 A538 E563 S566 S569	V536-K540 WeakPolarHBondContact O-CG 3.29Å; V536-K540 PolarHBondContact O-N 3.4Å; A538-K540 PolarHBondContact O-N 3.26Å; K540-E563 WeakPolarHBondContact CE-O 3.43Å; K540-E563 PolarHBondContact NZ-O 3Å; K540-S566 PolarHBondContact NZ-O 3Å; K540-S569 WeakPolarHBondContact CD-O 3.47Å
541	M	88.8	Confident	92.9	Very high	18 Å²	18	29 Å²	29	9%	0.089	17%	0.169	C	C	.	.			trans	-89.2	138.5	177.3	65.9	-166.2	-62.3	0	0	110.3	C509 L511 L539 S543 L544	C509-M541 VanDerWaalsContact O-CE 3.25Å; C509-M541 WeakPolarHBondContact O-CE 3.34Å; L511-M541 HydrophobicContact CB-CE 4Å; L511-M541 HydrophobicContact CB-SD 4.37Å; L539-M541 PolarHBondContact O-N 2.85Å; M541-S543 VanDerWaalsContact C-N 3.27Å; M541-S543 WeakPolarHBondContact CE-OG 3.4Å; M541-S543 PolarHBondContact O-N 2.96Å; M541-L544 HydrophobicContact CG-CB 3.38Å; M541-L544 HydrophobicContact CG-CD2 4.31Å; M541-L544 HydrophobicContact CG-CG 4.42Å; M541-L544 PolarHBondContact O-N 3.03Å; M541-L544 HydrophobicContact SD-CB 3.92Å; M541-L544 HydrophobicContact SD-CD2 4.32Å
542	P	88.1	Confident	93.1	Very high	94 Å²	94	28.1 Å²	28.1	61%	0.61	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-23	-172	27	-35	0	0	0	113.6	S572	P542-S572 VanDerWaalsContact O-CB 3.24Å; P542-S572 WeakPolarHBondContact O-CB 3.4Å; P542-S572 PolarHBondContact O-OG 3.08Å
543	S	92.5	Very high	93.1	Very high	18 Å²	18	36.6 Å²	36.6	13%	0.126	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-17.4	-179.6	59.4	0	0	0	0	113.9	L511 E512 M541 H545	L511-S543 CarbonylContact O-C 3.59Å; L511-S543 VanDerWaalsContact O-C 3.26Å; L511-S543 WeakPolarHBondContact O-CB 3.48Å; L511-S543 PolarHBondContact O-OG 3.09Å; E512-S543 WeakPolarHBondContact CA-O 3.27Å; M541-S543 VanDerWaalsContact C-N 3.27Å; M541-S543 WeakPolarHBondContact CE-OG 3.4Å; M541-S543 PolarHBondContact O-N 2.96Å; S543-H545 PolarHBondContact O-CE1 2.93Å; S543-H545 PolarHBondContact O-N 3.19Å; S543-H545 PolarHBondContact O-ND1 2.58Å
544	L	94.8	Very high	93.1	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.179	C	C	.	.			trans	-83	118.3	-172.2	-173.6	72.2	0	0	0	111	L511 L514 L539 M541 S546 S572 L573	L511-L544 HydrophobicContact CB-CD1 4.32Å; L511-L544 WeakPolarHBondContact O-CA 3.44Å; L511-L544 PolarHBondContact O-N 3.16Å; L514-L544 HydrophobicContact CB-CD1 3.85Å; L539-L544 HydrophobicContact CD2-CD2 3.94Å; M541-L544 HydrophobicContact CG-CB 3.38Å; M541-L544 HydrophobicContact CG-CD2 4.31Å; M541-L544 HydrophobicContact CG-CG 4.42Å; M541-L544 PolarHBondContact O-N 3.03Å; M541-L544 HydrophobicContact SD-CB 3.92Å; M541-L544 HydrophobicContact SD-CD2 4.32Å; L544-S546 WeakPolarHBondContact CD1-O 3.49Å; L544-S572 CarbonylContact O-C 3.57Å; L544-L573 HydrophobicContact CD2-CD1 4.47Å; L544-L573 HydrophobicContact CG-CD1 4.27Å
545	H	94.4	Very high	93	Very high	70 Å²	70	31.8 Å²	31.8	32%	0.324	17%	0.174	S	C	.	.			trans	-110.4	-25.1	-177.3	-52.2	104.7	0	0	0	113	E512 S543 K574 Q575	E512-H545 PolarHBondContact O-N 2.91Å; S543-H545 PolarHBondContact O-CE1 2.93Å; S543-H545 PolarHBondContact O-N 3.19Å; S543-H545 PolarHBondContact O-ND1 2.58Å; H545-K574 PolarHBondContact O-N 3.11Å; H545-Q575 PolarHBondContact O-N 3.31Å
546	S	96	Very high	93	Very high	20 Å²	20	38.3 Å²	38.3	14%	0.14	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.8	-180	-169.6	0	0	0	0	111.5	E512 E513 L514 L544	E512-S546 PolarHBondContact O-N 3.24Å; E513-S546 WeakPolarHBondContact CA-O 3.2Å; L514-S546 PolarHBondContact N-O 3.36Å; L544-S546 WeakPolarHBondContact CD1-O 3.49Å
547	L	97.6	Very high	92.9	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	123.5	178.1	176.4	63.1	0	0	0	109.3	L514 L539 L549 L564 L573 Q575 L576 D577	L514-L547 HydrophobicContact CB-CD1 4.23Å; L514-L547 HydrophobicContact CD2-CD1 4.07Å; L514-L547 HydrophobicContact CG-CD1 4.25Å; L514-L547 CarbonylContact O-C 3.1Å; L514-L547 VanDerWaalsContact O-CA 3.27Å; L514-L547 WeakPolarHBondContact O-CA 3.42Å; L539-L547 HydrophobicContact CD1-CD1 4.39Å; L539-L547 HydrophobicContact CD1-CD2 3.84Å; L539-L547 HydrophobicContact CD2-CD1 4.2Å; L547-L549 HydrophobicContact CD1-CD2 4.19Å; L547-L549 HydrophobicContact CD1-CG 4.19Å; L547-L549 HydrophobicContact CD2-CD1 4.27Å; L547-L549 HydrophobicContact CD2-CG 4.44Å; L547-L549 HydrophobicContact CG-CG 4.2Å; L547-L564 HydrophobicContact CD2-CD1 4.29Å; L547-L573 HydrophobicContact CB-CD1 3.6Å; L547-L573 HydrophobicContact CB-CD2 4.01Å; L547-L573 HydrophobicContact CB-CG 4.45Å; L547-L573 HydrophobicContact CD2-CD2 4.43Å; L547-Q575 PolarHBondContact N-O 3.27Å; L547-L576 HydrophobicContact CB-CD1 4.31Å; L547-L576 HydrophobicContact CD2-CD1 3.95Å; L547-L576 HydrophobicContact CG-CD1 4.15Å; L547-L576 CarbonylContact O-C 3.49Å; L547-L576 WeakPolarHBondContact O-CA 2.85Å; L547-D577 PolarHBondContact O-N 2.97Å
548	S	97.1	Very high	93	Very high	5 Å²	5	36.1 Å²	36.1	4%	0.035	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	127.4	168.2	-169.8	0	0	0	0	111	L514 F516 N517 D577	L514-S548 PolarHBondContact O-N 3.38Å; F516-S548 PolarHBondContact N-O 3.26Å; N517-S548 PolarHBondContact OD1-OG 3.1Å; S548-D577 WeakPolarHBondContact CA-O 3.25Å; S548-D577 WeakPolarHBondContact OG-CB 3.49Å; S548-D577 VanDerWaalsContact OG-CG 3.24Å; S548-D577 PolarHBondContact OG-OD2 3.1Å
549	L	96.6	Very high	93	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.177	C	C	.	.			trans	-122.7	30.9	172.7	-62.6	176.6	0	0	0	109.8	F516 L521 L547 N552 L554 L561 D577 N581	F516-L549 HydrophobicContact CB-CD2 4.2Å; F516-L549 HydrophobicContact CD2-CD2 4.37Å; L521-L549 HydrophobicContact CD1-CD2 3.93Å; L547-L549 HydrophobicContact CD1-CD2 4.19Å; L547-L549 HydrophobicContact CD1-CG 4.19Å; L547-L549 HydrophobicContact CD2-CD1 4.27Å; L547-L549 HydrophobicContact CD2-CG 4.44Å; L547-L549 HydrophobicContact CG-CG 4.2Å; L549-N552 PolarHBondContact O-ND2 2.86Å; L549-L554 HydrophobicContact CB-CD1 4.21Å; L549-L561 HydrophobicContact CD1-CD1 4.12Å; L549-L561 HydrophobicContact CD1-CD2 3.92Å; L549-D577 PolarHBondContact N-O 3.5Å; L549-N581 PolarHBondContact O-ND2 3.16Å; L549-N581 PolarHBondContact O-OD1 3Å
550	A	93.4	Very high	93	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	144.3	-176.9	0	0	0	0	0	111.8	N517 D518 N552 R579	N517-A550 WeakPolarHBondContact CA-O 3.48Å; N517-A550 WeakPolarHBondContact OD1-CB 3.46Å; D518-A550 PolarHBondContact N-O 2.98Å; A550-N552 VanDerWaalsContact C-N 3.26Å; A550-N552 PolarHBondContact O-N 3.03Å; A550-N552 PolarHBondContact O-ND2 3.3Å; A550-N552 VanDerWaalsContact O-ND2 3.13Å; A550-R579 WeakPolarHBondContact CA-O 3.36Å; A550-R579 HydrophobicContact CB-CG 3.62Å
551	Q	92.5	Very high	93.2	Very high	77 Å²	77	33.3 Å²	33.3	36%	0.36	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	21.6	172.8	-59.4	-179	72.2	0	0	116	D518 R579 S580	D518-Q551 HydrophobicContact CB-CB 3.87Å; Q551-R579 PolarHBondContact N-O 2.94Å; Q551-R579 VanDerWaalsContact N-O 3.12Å; Q551-S580 WeakPolarHBondContact CA-O 3.35Å; Q551-S580 VanDerWaalsContact CG-CB 3.44Å
552	N	92.6	Very high	93.4	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.027	16%	0.164	C	C	.	.	S	Bend	trans	-90.7	5.8	176.8	-74.2	-78.5	0	0	0	114.7	F516 C519 R520 L521 L549 A550 L554 N581	F516-N552 PolarHBondContact O-ND2 2.77Å; C519-N552 PolarHBondContact N-OD1 2.76Å; C519-N552 VanDerWaalsContact N-OD1 3.13Å; R520-N552 PolarHBondContact N-OD1 3.49Å; L521-N552 WeakPolarHBondContact CG-OD1 3.37Å; L521-N552 PolarHBondContact N-OD1 2.95Å; L549-N552 PolarHBondContact O-ND2 2.86Å; A550-N552 VanDerWaalsContact C-N 3.26Å; A550-N552 PolarHBondContact O-N 3.03Å; A550-N552 PolarHBondContact O-ND2 3.3Å; A550-N552 VanDerWaalsContact O-ND2 3.13Å; N552-L554 VanDerWaalsContact C-N 3.3Å; N552-L554 HydrophobicContact CB-CD2 4.33Å; N552-L554 HydrophobicContact CB-CG 4.41Å; N552-L554 PolarHBondContact O-N 3.22Å; N552-N581 PolarHBondContact N-OD1 3.33Å
553	R	90.5	Very high	93.7	Very high	180 Å²	180	31.1 Å²	31.1	68%	0.679	15%	0.149	S	C	*	.			trans	55.8	42	-177.7	-52.2	177.5	-179.4	-175.8	-2.2	112.6	A555 N581	R553-A555 PolarHBondContact O-N 3.31Å; R553-N581 PolarHBondContact N-OD1 3.22Å
554	L	91.6	Very high	93.7	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	14%	0.143	C	C	.	.			trans	-56.3	-34.9	179.9	-63	175.2	0	0	0	112.8	L522 L532 L549 N552 K556 N557 L561 I578 N581	L522-L554 HydrophobicContact CD1-CD2 3.73Å; L532-L554 HydrophobicContact CD1-CD2 4.3Å; L532-L554 HydrophobicContact CD2-CD2 4.13Å; L549-L554 HydrophobicContact CB-CD1 4.21Å; N552-L554 VanDerWaalsContact C-N 3.3Å; N552-L554 HydrophobicContact CB-CD2 4.33Å; N552-L554 HydrophobicContact CB-CG 4.41Å; N552-L554 PolarHBondContact O-N 3.22Å; L554-K556 PolarHBondContact O-N 3.06Å; L554-N557 WeakPolarHBondContact O-CB 3.45Å; L554-N557 PolarHBondContact O-N 3.17Å; L554-L561 HydrophobicContact CD1-CD1 3.88Å; L554-I578 HydrophobicContact CD1-CG2 4.18Å; L554-N581 HydrophobicContact CB-CB 4.14Å; L554-N581 HydrophobicContact CG-CB 4.41Å; L554-N581 WeakPolarHBondContact CG-OD1 3.33Å; L554-N581 PolarHBondContact N-OD1 3.07Å; L554-N581 VanDerWaalsContact N-OD1 3.17Å
555	A	90.1	Very high	93.6	Very high	35 Å²	35	30.3 Å²	30.3	29%	0.289	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	45.2	-127.3	178.9	0	0	0	0	0	111.9	R553 N557 V558 N581	R553-A555 PolarHBondContact O-N 3.31Å; A555-N557 PolarHBondContact O-N 2.79Å; A555-N557 VanDerWaalsContact O-N 3.16Å; A555-V558 WeakPolarHBondContact O-CG1 3.5Å; A555-V558 PolarHBondContact O-N 2.71Å; A555-N581 PolarHBondContact N-O 3.2Å
556	K	91.9	Very high	93.2	Very high	142 Å²	142	27.9 Å²	27.9	62%	0.617	13%	0.134	S	C	*	.	G	3₁₀ helix	trans	-60.3	-23.1	-179.4	69.3	176.3	-175.6	173.8	0	115.1	L554 V558 C559 D587	L554-K556 PolarHBondContact O-N 3.06Å; K556-V558 PolarHBondContact O-N 3.37Å; K556-C559 PolarHBondContact O-SG 2.96Å; K556-C559 VanDerWaalsContact O-SG 3.35Å; K556-D587 WeakPolarHBondContact CB-OD1 3.46Å
557	N	92.4	Very high	92.6	Very high	18 Å²	18	29.4 Å²	29.4	10%	0.096	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-79.9	-3	-176.2	-52.7	-41.2	0	0	0	112.7	L532 L554 A555 C559 V560	L532-N557 HydrophobicContact CD1-CB 3.45Å; L532-N557 VanDerWaalsContact CD1-CB 3.45Å; L554-N557 WeakPolarHBondContact O-CB 3.45Å; L554-N557 PolarHBondContact O-N 3.17Å; A555-N557 PolarHBondContact O-N 2.79Å; A555-N557 VanDerWaalsContact O-N 3.16Å; N557-C559 PolarHBondContact O-N 3.38Å; N557-C559 VanDerWaalsContact O-N 3.11Å; N557-V560 WeakPolarHBondContact O-CB 3.37Å; N557-V560 WeakPolarHBondContact O-CG2 3.38Å; N557-V560 PolarHBondContact O-N 3.42Å; N557-V560 VanDerWaalsContact O-N 3.08Å
558	V	94.2	Very high	91.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-54.6	-29.4	175.4	68.2	0	0	0	0	112.5	A555 K556 V560 L561 I578 I583 D587 F591	A555-V558 WeakPolarHBondContact O-CG1 3.5Å; A555-V558 PolarHBondContact O-N 2.71Å; K556-V558 PolarHBondContact O-N 3.37Å; V558-V560 PolarHBondContact O-N 3.13Å; V558-L561 HydrophobicContact CG2-CD1 4.35Å; V558-L561 WeakPolarHBondContact O-CB 3.36Å; V558-L561 PolarHBondContact O-N 3.35Å; V558-I578 HydrophobicContact CG2-CD1 3.79Å; V558-I583 HydrophobicContact CB-CD1 4.22Å; V558-I583 HydrophobicContact CB-CG1 4.16Å; V558-I583 HydrophobicContact CG1-CG1 4.23Å; V558-I583 HydrophobicContact CG1-CG2 3.93Å; V558-I583 HydrophobicContact CG2-CD1 3.75Å; V558-I583 HydrophobicContact CG2-CG1 4.25Å; V558-D587 HydrophobicContact CG1-CB 4.25Å; V558-F591 HydrophobicContact CG1-CB 4.24Å; V558-F591 HydrophobicContact CG2-CD2 4.36Å; V558-F591 HydrophobicContact CG2-CG 4.48Å; V558-F591 VanDerWaalsContact O-CD2 3.27Å; V558-F591 WeakPolarHBondContact O-CD2 3.14Å
559	C	93	Very high	90.5	Very high	12 Å²	12	42.8 Å²	42.8	8%	0.081	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-60	-26	179.2	64.9	0	0	0	0	113.4	K556 N557 L561 A562 E590	K556-C559 PolarHBondContact O-SG 2.96Å; K556-C559 VanDerWaalsContact O-SG 3.35Å; N557-C559 PolarHBondContact O-N 3.38Å; N557-C559 VanDerWaalsContact O-N 3.11Å; C559-L561 VanDerWaalsContact C-N 3.27Å; C559-L561 PolarHBondContact O-N 3.24Å; C559-A562 WeakPolarHBondContact O-CB 3.39Å; C559-A562 PolarHBondContact O-N 3.28Å; C559-E590 HydrophobicContact CB-CG 4.06Å
560	V	94.2	Very high	89.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-65.3	-31	175.3	-178.1	0	0	0	0	111.4	E529 L532 V533 V536 N557 V558 A562 E563	E529-V560 HydrophobicContact CG-CG2 3.85Å; L532-V560 HydrophobicContact CB-CB 4.38Å; L532-V560 HydrophobicContact CB-CG1 4.01Å; V533-V560 HydrophobicContact CB-CG1 4.46Å; V533-V560 HydrophobicContact CG2-CG1 3.64Å; V536-V560 HydrophobicContact CG2-CG1 4.32Å; N557-V560 WeakPolarHBondContact O-CB 3.37Å; N557-V560 WeakPolarHBondContact O-CG2 3.38Å; N557-V560 PolarHBondContact O-N 3.42Å; N557-V560 VanDerWaalsContact O-N 3.08Å; V558-V560 PolarHBondContact O-N 3.13Å; V560-A562 PolarHBondContact O-N 3.08Å; V560-A562 VanDerWaalsContact O-N 3.13Å; V560-E563 VanDerWaalsContact O-CB 3.24Å; V560-E563 WeakPolarHBondContact O-CB 3.48Å; V560-E563 WeakPolarHBondContact O-CG 3.36Å; V560-E563 PolarHBondContact O-N 3.3Å
561	L	95.1	Very high	89.6	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-64.9	-19.5	179.4	-61.4	-177.4	0	0	0	113	V536 L549 L554 V558 C559 E563 L564 I578 F591	V536-L561 HydrophobicContact CG2-CD2 3.69Å; L549-L561 HydrophobicContact CD1-CD1 4.12Å; L549-L561 HydrophobicContact CD1-CD2 3.92Å; L554-L561 HydrophobicContact CD1-CD1 3.88Å; V558-L561 HydrophobicContact CG2-CD1 4.35Å; V558-L561 WeakPolarHBondContact O-CB 3.36Å; V558-L561 PolarHBondContact O-N 3.35Å; C559-L561 VanDerWaalsContact C-N 3.27Å; C559-L561 PolarHBondContact O-N 3.24Å; L561-E563 PolarHBondContact O-N 3.42Å; L561-L564 HydrophobicContact CB-CD1 4.43Å; L561-L564 VanDerWaalsContact O-CB 3.31Å; L561-L564 WeakPolarHBondContact O-CB 3.42Å; L561-L564 WeakPolarHBondContact O-CD1 3.4Å; L561-L564 VanDerWaalsContact O-CG 3.3Å; L561-L564 WeakPolarHBondContact O-CG 3.37Å; L561-L564 PolarHBondContact O-N 3.32Å; L561-L564 VanDerWaalsContact O-N 3.17Å; L561-I578 HydrophobicContact CD1-CG2 3.71Å; L561-F591 HydrophobicContact CB-CE2 4.1Å
562	A	93.1	Very high	89.5	Confident	4 Å²	4	45.5 Å²	45.5	3%	0.033	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-62	-24.6	172.5	0	0	0	0	0	111.7	C559 V560 L564 F565 F591 R594 L595	C559-A562 WeakPolarHBondContact O-CB 3.39Å; C559-A562 PolarHBondContact O-N 3.28Å; V560-A562 PolarHBondContact O-N 3.08Å; V560-A562 VanDerWaalsContact O-N 3.13Å; A562-L564 PolarHBondContact O-N 2.95Å; A562-F565 PolarHBondContact O-N 3.13Å; A562-F591 HydrophobicContact CB-CD2 4.05Å; A562-F591 HydrophobicContact CB-CE2 4.08Å; A562-R594 HydrophobicContact CB-CB 3.58Å; A562-L595 HydrophobicContact CB-CB 4.4Å; A562-L595 HydrophobicContact CB-CD1 4.36Å
563	E	93.1	Very high	89.5	Confident	63 Å²	63	45.4 Å²	45.4	29%	0.294	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-66.8	-16.6	178.4	-63.9	179.7	-173.6	0	0	112.9	V536 K540 V560 L561 F565 S566	V536-E563 HydrophobicContact CG1-CB 3.94Å; K540-E563 WeakPolarHBondContact CE-O 3.43Å; K540-E563 PolarHBondContact NZ-O 3Å; V560-E563 VanDerWaalsContact O-CB 3.24Å; V560-E563 WeakPolarHBondContact O-CB 3.48Å; V560-E563 WeakPolarHBondContact O-CG 3.36Å; V560-E563 PolarHBondContact O-N 3.3Å; L561-E563 PolarHBondContact O-N 3.42Å; E563-F565 PolarHBondContact O-N 3.34Å; E563-S566 WeakPolarHBondContact CA-OG 3.28Å; E563-S566 PolarHBondContact O-N 3.31Å; E563-S566 PolarHBondContact O-OG 2.98Å
564	L	93.4	Very high	89.5	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-51.3	-30.7	173.1	-75	167.9	0	0	0	112.7	V536 L539 L547 L561 A562 S571 L573	V536-L564 HydrophobicContact CB-CD2 4.45Å; V536-L564 HydrophobicContact CG1-CD2 3.88Å; V536-L564 HydrophobicContact CG1-CG 3.9Å; V536-L564 HydrophobicContact CG2-CD2 4.49Å; V536-L564 HydrophobicContact CG2-CG 4.43Å; L539-L564 HydrophobicContact CB-CD2 3.76Å; L547-L564 HydrophobicContact CD2-CD1 4.29Å; L561-L564 HydrophobicContact CB-CD1 4.43Å; L561-L564 VanDerWaalsContact O-CB 3.31Å; L561-L564 WeakPolarHBondContact O-CB 3.42Å; L561-L564 WeakPolarHBondContact O-CD1 3.4Å; L561-L564 VanDerWaalsContact O-CG 3.3Å; L561-L564 WeakPolarHBondContact O-CG 3.37Å; L561-L564 PolarHBondContact O-N 3.32Å; L561-L564 VanDerWaalsContact O-N 3.17Å; A562-L564 PolarHBondContact O-N 2.95Å; L564-S571 VanDerWaalsContact O-CB 3.26Å; L564-S571 WeakPolarHBondContact O-CB 3.38Å; L564-S571 PolarHBondContact O-N 2.8Å; L564-L573 HydrophobicContact CD1-CD2 4.33Å
565	F	92.1	Very high	89.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-104.7	5.9	-176.7	-51.9	-72.9	0	0	0	113.3	A562 E563 L573 L595 H598 P600 L604	A562-F565 PolarHBondContact O-N 3.13Å; E563-F565 PolarHBondContact O-N 3.34Å; F565-L573 HydrophobicContact CE1-CB 4.21Å; F565-L573 HydrophobicContact CZ-CB 4.28Å; F565-L573 HydrophobicContact CZ-CD2 4.42Å; F565-L595 HydrophobicContact CD2-CD1 3.42Å; F565-L595 VanDerWaalsContact CD2-CD1 3.42Å; F565-L595 HydrophobicContact CE2-CD1 3.86Å; F565-L595 HydrophobicContact CG-CD1 4.4Å; F565-H598 WeakPolarHBondContact CB-O 3.46Å; F565-P600 HydrophobicContact CD1-CB 3.78Å; F565-P600 HydrophobicContact CD1-CG 4.02Å; F565-P600 HydrophobicContact CD2-CG 3.88Å; F565-P600 HydrophobicContact CE1-CB 3.77Å; F565-P600 HydrophobicContact CE1-CG 4.03Å; F565-P600 HydrophobicContact CE2-CG 3.88Å; F565-P600 HydrophobicContact CG-CB 4.15Å; F565-P600 HydrophobicContact CG-CG 3.93Å; F565-P600 HydrophobicContact CZ-CB 4.15Å; F565-P600 HydrophobicContact CZ-CG 3.95Å; F565-L604 HydrophobicContact CE2-CD2 4.08Å; F565-L604 HydrophobicContact CZ-CD1 4.18Å; F565-L604 HydrophobicContact CZ-CD2 3.94Å
566	S	87.6	Confident	89.9	Confident	20 Å²	20	44.6 Å²	44.6	14%	0.14	24%	0.237	C	C	.	.			trans	-99.3	158	179	71.9	0	0	0	0	112.9	K540 E563 H598	K540-S566 PolarHBondContact NZ-O 3Å; E563-S566 WeakPolarHBondContact CA-OG 3.28Å; E563-S566 PolarHBondContact O-N 3.31Å; E563-S566 PolarHBondContact O-OG 2.98Å; S566-H598 WeakPolarHBondContact CB-CD2 3.45Å
567	G	82.9	Confident	90.1	Very high	52 Å²	52	39 Å²	39	54%	0.536	21%	0.214	S	C	.	.	S	Bend	trans	84.1	-169.8	175.1	0	0	0	0	0	114.7
568	Q	71.7	Confident	90.2	Very high	205 Å²	205	38.1 Å²	38.1	96%	0.958	21%	0.209	S	C	*	.	S	Bend	trans	-75	-29.7	-173.6	-67.3	-178.1	-5.8	0	0	113.6
569	S	78.8	Confident	90.2	Very high	82 Å²	82	41.9 Å²	41.9	57%	0.573	22%	0.223	S	C	*	.	S	Bend	trans	-108.2	89.6	176.5	-54.9	0	0	0	0	109.5	K540	K540-S569 WeakPolarHBondContact CD-O 3.47Å
570	Q	83.4	Confident	90.1	Very high	95 Å²	95	42.3 Å²	42.3	44%	0.444	23%	0.226	S	C	.	.			trans	-76.1	144.6	176.9	-63.8	-176.2	-10.2	0	0	110.9
571	S	88.3	Confident	90.1	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.014	23%	0.226	C	C	.	.			trans	-69.5	141.4	175.3	-174	0	0	0	0	112.3	L564 L573	L564-S571 VanDerWaalsContact O-CB 3.26Å; L564-S571 WeakPolarHBondContact O-CB 3.38Å; L564-S571 PolarHBondContact O-N 2.8Å; S571-L573 PolarHBondContact O-N 2.83Å; S571-L573 WeakPolarHBondContact OG-CB 3.43Å; S571-L573 PolarHBondContact OG-N 3.35Å
572	S	88.7	Confident	89.9	Confident	38 Å²	38	47 Å²	47	27%	0.266	25%	0.247	S	C	.	.			trans	-81.2	9	172.5	-57.4	0	0	0	0	113.6	P542 L544 K574	P542-S572 VanDerWaalsContact O-CB 3.24Å; P542-S572 WeakPolarHBondContact O-CB 3.4Å; P542-S572 PolarHBondContact O-OG 3.08Å; L544-S572 CarbonylContact O-C 3.57Å; S572-K574 PolarHBondContact O-N 3.17Å
573	L	92.8	Very high	89.9	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	25%	0.245	C	C	.	.			trans	-59.7	128	-170	-163.3	73.3	0	0	0	112.4	L544 L547 L564 F565 S571 Q575 L576 L604	L544-L573 HydrophobicContact CD2-CD1 4.47Å; L544-L573 HydrophobicContact CG-CD1 4.27Å; L547-L573 HydrophobicContact CB-CD1 3.6Å; L547-L573 HydrophobicContact CB-CD2 4.01Å; L547-L573 HydrophobicContact CB-CG 4.45Å; L547-L573 HydrophobicContact CD2-CD2 4.43Å; L564-L573 HydrophobicContact CD1-CD2 4.33Å; F565-L573 HydrophobicContact CE1-CB 4.21Å; F565-L573 HydrophobicContact CZ-CB 4.28Å; F565-L573 HydrophobicContact CZ-CD2 4.42Å; S571-L573 PolarHBondContact O-N 2.83Å; S571-L573 WeakPolarHBondContact OG-CB 3.43Å; S571-L573 PolarHBondContact OG-N 3.35Å; L573-Q575 WeakPolarHBondContact CD1-O 3.3Å; L573-Q575 WeakPolarHBondContact CG-O 3.33Å; L573-L576 HydrophobicContact CD2-CB 3.86Å; L573-L576 HydrophobicContact CD2-CD1 4.14Å; L573-L576 HydrophobicContact CD2-CG 4.45Å; L573-L604 HydrophobicContact CD2-CD1 4.36Å; L573-L604 HydrophobicContact CG-CD1 4.37Å
574	K	90.9	Very high	90	Very high	107 Å²	107	46.4 Å²	46.4	47%	0.465	24%	0.243	S	C	.	.			trans	-104.9	-24.8	176.6	-63.5	178.2	-177.4	169.6	0	112.3	H545 S572 T605	H545-K574 PolarHBondContact O-N 3.11Å; S572-K574 PolarHBondContact O-N 3.17Å; K574-T605 PolarHBondContact O-N 3.2Å
575	Q	93.8	Very high	90	Very high	91 Å²	91	46.6 Å²	46.6	43%	0.425	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.5	-179.6	-56.1	-173.2	-4.2	0	0	110.5	H545 L547 L573 T605	H545-Q575 PolarHBondContact O-N 3.31Å; L547-Q575 PolarHBondContact N-O 3.27Å; L573-Q575 WeakPolarHBondContact CD1-O 3.3Å; L573-Q575 WeakPolarHBondContact CG-O 3.33Å; Q575-T605 CarbonylContact C-O 3.56Å; Q575-T605 WeakPolarHBondContact CA-O 3.31Å
576	L	96.4	Very high	90.2	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	112.5	172.9	179.5	57.6	0	0	0	109.2	L547 L573 I578 L604 T605 L606 D607	L547-L576 HydrophobicContact CB-CD1 4.31Å; L547-L576 HydrophobicContact CD2-CD1 3.95Å; L547-L576 HydrophobicContact CG-CD1 4.15Å; L547-L576 CarbonylContact O-C 3.49Å; L547-L576 WeakPolarHBondContact O-CA 2.85Å; L573-L576 HydrophobicContact CD2-CB 3.86Å; L573-L576 HydrophobicContact CD2-CD1 4.14Å; L573-L576 HydrophobicContact CD2-CG 4.45Å; L576-I578 HydrophobicContact CD1-CG2 3.94Å; L576-I578 HydrophobicContact CD2-CG2 4.48Å; L576-I578 HydrophobicContact CG-CG2 4.02Å; L576-L604 HydrophobicContact CB-CD1 4.07Å; L576-L604 HydrophobicContact CB-CD2 4.21Å; L576-L604 HydrophobicContact CB-CG 4.43Å; L576-L604 HydrophobicContact CD2-CD2 4.44Å; L576-T605 PolarHBondContact N-O 2.94Å; L576-L606 HydrophobicContact CB-CD1 3.93Å; L576-L606 HydrophobicContact CD2-CD1 3.79Å; L576-L606 HydrophobicContact CG-CD1 3.85Å; L576-L606 WeakPolarHBondContact O-CA 3.42Å; L576-D607 PolarHBondContact O-N 3.34Å
577	D	95.3	Very high	90.6	Very high	25 Å²	25	50.6 Å²	50.6	13%	0.134	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	111.7	174.1	175.1	16	0	0	0	110.6	L547 S548 L549 R579 D607	L547-D577 PolarHBondContact O-N 2.97Å; S548-D577 WeakPolarHBondContact CA-O 3.25Å; S548-D577 WeakPolarHBondContact OG-CB 3.49Å; S548-D577 VanDerWaalsContact OG-CG 3.24Å; S548-D577 PolarHBondContact OG-OD2 3.1Å; L549-D577 PolarHBondContact N-O 3.5Å; D577-R579 VanDerWaalsContact OD1-CB 3.29Å; D577-R579 WeakPolarHBondContact OD1-CB 3.45Å; D577-R579 WeakPolarHBondContact OD1-CD 3.44Å; D577-R579 WeakPolarHBondContact OD1-CG 3.38Å; D577-R579 PolarHBondContact OD1-N 3.18Å; D577-R579 IonicContact OD1-NE 2.91Å; D577-R579 IonicContact OD2-CZ 3.03Å; D577-R579 IonicContact OD2-NE 3.87Å; D577-R579 PolarHBondContact OD2-NE 3.42Å; D577-R579 VanDerWaalsContact OD2-NE 3.09Å; D577-D607 HydrophobicContact CB-CB 4.13Å
578	I	95.9	Very high	91.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.248	C	C	.	.			trans	-125	28.8	176.9	54.2	171.6	0	0	0	110.8	L554 V558 L561 L576 N581 I583 L606 D607 L608 N611	L554-I578 HydrophobicContact CD1-CG2 4.18Å; V558-I578 HydrophobicContact CG2-CD1 3.79Å; L561-I578 HydrophobicContact CD1-CG2 3.71Å; L576-I578 HydrophobicContact CD1-CG2 3.94Å; L576-I578 HydrophobicContact CD2-CG2 4.48Å; L576-I578 HydrophobicContact CG-CG2 4.02Å; I578-N581 VanDerWaalsContact C-ND2 3.32Å; I578-N581 PolarHBondContact O-ND2 3.47Å; I578-I583 HydrophobicContact CB-CD1 4.36Å; I578-I583 HydrophobicContact CD1-CD1 3.92Å; I578-I583 HydrophobicContact CG1-CD1 4.3Å; I578-L606 HydrophobicContact CD1-CD1 3.87Å; I578-L606 HydrophobicContact CG1-CD1 3.99Å; I578-D607 CarbonylContact C-O 3.52Å; I578-D607 WeakPolarHBondContact CG1-O 3.37Å; I578-D607 PolarHBondContact N-O 3.28Å; I578-L608 HydrophobicContact CD1-CD2 3.65Å; I578-L608 HydrophobicContact CG1-CD2 3.9Å; I578-N611 PolarHBondContact O-ND2 3.42Å
579	R	93.4	Very high	92.4	Very high	79 Å²	79	39.7 Å²	39.7	30%	0.298	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	153.1	176.9	75.1	-164.8	171.8	159.2	5.6	112.2	A550 Q551 D577 N581 D607 R609	A550-R579 WeakPolarHBondContact CA-O 3.36Å; A550-R579 HydrophobicContact CB-CG 3.62Å; Q551-R579 PolarHBondContact N-O 2.94Å; Q551-R579 VanDerWaalsContact N-O 3.12Å; D577-R579 VanDerWaalsContact OD1-CB 3.29Å; D577-R579 WeakPolarHBondContact OD1-CB 3.45Å; D577-R579 WeakPolarHBondContact OD1-CD 3.44Å; D577-R579 WeakPolarHBondContact OD1-CG 3.38Å; D577-R579 PolarHBondContact OD1-N 3.18Å; D577-R579 IonicContact OD1-NE 2.91Å; D577-R579 IonicContact OD2-CZ 3.03Å; D577-R579 IonicContact OD2-NE 3.87Å; D577-R579 PolarHBondContact OD2-NE 3.42Å; D577-R579 VanDerWaalsContact OD2-NE 3.09Å; R579-N581 VanDerWaalsContact C-N 3.3Å; R579-N581 PolarHBondContact O-N 2.96Å; R579-N581 PolarHBondContact O-ND2 3.43Å; R579-D607 PolarHBondContact N-O 3.49Å; R579-R609 WeakPolarHBondContact CA-O 3.24Å; R579-R609 HydrophobicContact CB-CB 4.29Å; R579-R609 WeakPolarHBondContact CB-O 3.42Å
580	S	91.1	Very high	93.2	Very high	21 Å²	21	39 Å²	39	15%	0.147	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	37.7	176.1	-56.8	0	0	0	0	114.9	Q551 R609 K610	Q551-S580 WeakPolarHBondContact CA-O 3.35Å; Q551-S580 VanDerWaalsContact CG-CB 3.44Å; S580-R609 PolarHBondContact N-O 3.07Å; S580-K610 WeakPolarHBondContact CA-O 3.27Å; S580-K610 VanDerWaalsContact OG-CB 3.23Å; S580-K610 WeakPolarHBondContact OG-CB 3.28Å; S580-K610 WeakPolarHBondContact OG-CD 3.37Å
581	N	93.6	Very high	93.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-102.5	8.7	-178.7	-89.9	-63.7	0	0	0	114.5	L549 N552 R553 L554 A555 I578 R579 I583 N611	L549-N581 PolarHBondContact O-ND2 3.16Å; L549-N581 PolarHBondContact O-OD1 3Å; N552-N581 PolarHBondContact N-OD1 3.33Å; R553-N581 PolarHBondContact N-OD1 3.22Å; L554-N581 HydrophobicContact CB-CB 4.14Å; L554-N581 HydrophobicContact CG-CB 4.41Å; L554-N581 WeakPolarHBondContact CG-OD1 3.33Å; L554-N581 PolarHBondContact N-OD1 3.07Å; L554-N581 VanDerWaalsContact N-OD1 3.17Å; A555-N581 PolarHBondContact N-O 3.2Å; I578-N581 VanDerWaalsContact C-ND2 3.32Å; I578-N581 PolarHBondContact O-ND2 3.47Å; R579-N581 VanDerWaalsContact C-N 3.3Å; R579-N581 PolarHBondContact O-N 2.96Å; R579-N581 PolarHBondContact O-ND2 3.43Å; N581-I583 HydrophobicContact CB-CD1 3.93Å; N581-I583 HydrophobicContact CB-CG1 3.9Å; N581-I583 PolarHBondContact O-N 3.38Å; N581-N611 PolarHBondContact N-OD1 2.93Å
582	F	91.8	Very high	94.2	Very high	99 Å²	99	34.4 Å²	34.4	43%	0.434	18%	0.175	S	C	.	.			trans	57.5	30.9	-176	-67.1	-87.7	0	0	0	114.1	Q584 N611 W638	F582-Q584 PolarHBondContact O-N 3.48Å; F582-Q584 PolarHBondContact O-NE2 3.3Å; F582-Q584 VanDerWaalsContact O-NE2 3.16Å; F582-N611 PolarHBondContact N-OD1 2.69Å; F582-N611 VanDerWaalsContact N-OD1 3.15Å; F582-W638 HydrophobicContact CD1-CH2 4.24Å; F582-W638 AromaticContact CE1-CH2 3.64Å; F582-W638 HydrophobicContact CE1-CH2 3.64Å; F582-W638 HydrophobicContact CE1-CZ2 4.46Å; F582-W638 HydrophobicContact CE1-CZ3 4.31Å; F582-W638 HydrophobicContact CZ-CH2 4.31Å
583	I	93.6	Very high	94.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.181	C	C	.	.			trans	-67.2	118.6	179.3	-61.1	160.5	0	0	0	109.3	V558 I578 N581 D587 L588 N611 P612	V558-I583 HydrophobicContact CB-CD1 4.22Å; V558-I583 HydrophobicContact CB-CG1 4.16Å; V558-I583 HydrophobicContact CG1-CG1 4.23Å; V558-I583 HydrophobicContact CG1-CG2 3.93Å; V558-I583 HydrophobicContact CG2-CD1 3.75Å; V558-I583 HydrophobicContact CG2-CG1 4.25Å; I578-I583 HydrophobicContact CB-CD1 4.36Å; I578-I583 HydrophobicContact CD1-CD1 3.92Å; I578-I583 HydrophobicContact CG1-CD1 4.3Å; N581-I583 HydrophobicContact CB-CD1 3.93Å; N581-I583 HydrophobicContact CB-CG1 3.9Å; N581-I583 PolarHBondContact O-N 3.38Å; I583-D587 HydrophobicContact CG2-CB 4.17Å; I583-L588 HydrophobicContact CG2-CB 3.88Å; I583-N611 HydrophobicContact CB-CB 4.48Å; I583-N611 PolarHBondContact N-OD1 2.95Å; I583-N611 VanDerWaalsContact N-OD1 3.12Å; I583-P612 WeakPolarHBondContact O-CD 3.31Å; I583-P612 WeakPolarHBondContact O-CG 3.27Å
584	Q	94.2	Very high	94.5	Very high	55 Å²	55	40.2 Å²	40.2	26%	0.257	19%	0.194	S	C	.	.			trans	-77.8	158	176.6	-56.3	-59.1	-62.5	0	0	110.9	F582 A586 D587 L588 P612 R615	F582-Q584 PolarHBondContact O-N 3.48Å; F582-Q584 PolarHBondContact O-NE2 3.3Å; F582-Q584 VanDerWaalsContact O-NE2 3.16Å; Q584-A586 VanDerWaalsContact C-N 3.3Å; Q584-A586 PolarHBondContact O-N 3.04Å; Q584-D587 WeakPolarHBondContact CB-OD2 3.46Å; Q584-D587 PolarHBondContact N-OD2 3.16Å; Q584-D587 WeakPolarHBondContact O-CB 3.37Å; Q584-D587 PolarHBondContact O-N 2.94Å; Q584-L588 PolarHBondContact O-N 3.46Å; Q584-P612 VanDerWaalsContact NE2-CG 3.3Å; Q584-R615 VanDerWaalsContact OE1-NH1 3.15Å
585	P	94.3	Very high	94.5	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.032	17%	0.172	C	C	.	.	H	α-helix	trans	-52.6	-41.1	177.7	-31.4	39.1	0	0	0	115	L588 L589 D616 T619 W620	P585-L588 PolarHBondContact O-N 3.37Å; P585-L589 WeakPolarHBondContact O-CB 3.45Å; P585-L589 PolarHBondContact O-N 3.44Å; P585-D616 HydrophobicContact CB-CB 4Å; P585-D616 HydrophobicContact CG-CB 3.9Å; P585-T619 HydrophobicContact CB-CG2 3.89Å; P585-T619 WeakPolarHBondContact O-CG2 3.43Å; P585-W620 HydrophobicContact CB-CB 4.2Å; P585-W620 HydrophobicContact CB-CE3 4.34Å; P585-W620 HydrophobicContact CG-CB 4.32Å; P585-W620 HydrophobicContact CG-CE3 4.12Å
586	A	95.4	Very high	94.4	Very high	66 Å²	66	35.9 Å²	35.9	55%	0.545	18%	0.177	S	C	.	.	H	α-helix	trans	-64.8	-40.1	177	0	0	0	0	0	112.8	Q584 L589 E590	Q584-A586 VanDerWaalsContact C-N 3.3Å; Q584-A586 PolarHBondContact O-N 3.04Å; A586-L589 PolarHBondContact O-N 3.03Å; A586-E590 PolarHBondContact O-N 3.33Å
587	D	95.9	Very high	94	Very high	38 Å²	38	41.4 Å²	41.4	20%	0.203	21%	0.205	C	C	.	.	H	α-helix	trans	-68	-40.1	178.7	-56.9	-42.1	0	0	0	111.2	K556 V558 I583 Q584 L589 E590 F591	K556-D587 WeakPolarHBondContact CB-OD1 3.46Å; V558-D587 HydrophobicContact CG1-CB 4.25Å; I583-D587 HydrophobicContact CG2-CB 4.17Å; Q584-D587 WeakPolarHBondContact CB-OD2 3.46Å; Q584-D587 PolarHBondContact N-OD2 3.16Å; Q584-D587 WeakPolarHBondContact O-CB 3.37Å; Q584-D587 PolarHBondContact O-N 2.94Å; D587-L589 VanDerWaalsContact C-N 3.34Å; D587-E590 PolarHBondContact O-N 3.1Å; D587-F591 PolarHBondContact O-N 3.33Å
588	L	96.6	Very high	93.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-39.5	174.4	-174.8	66.1	0	0	0	111.4	I583 Q584 P585 E590 F591 A592 L608 W620 A623 L624 L627	I583-L588 HydrophobicContact CG2-CB 3.88Å; Q584-L588 PolarHBondContact O-N 3.46Å; P585-L588 PolarHBondContact O-N 3.37Å; L588-E590 VanDerWaalsContact C-N 3.31Å; L588-E590 PolarHBondContact O-N 3.17Å; L588-F591 HydrophobicContact CD1-CD1 4.08Å; L588-F591 PolarHBondContact O-N 3.39Å; L588-A592 WeakPolarHBondContact O-CB 3.28Å; L588-A592 PolarHBondContact O-N 2.77Å; L588-L608 HydrophobicContact CD1-CD1 4.11Å; L588-L608 HydrophobicContact CD1-CD2 3.72Å; L588-L608 HydrophobicContact CD2-CD1 4.05Å; L588-W620 HydrophobicContact CB-CE3 4.34Å; L588-W620 HydrophobicContact CB-CZ3 4.09Å; L588-W620 HydrophobicContact CD2-CD2 3.86Å; L588-W620 HydrophobicContact CD2-CE3 3.56Å; L588-W620 HydrophobicContact CD2-CH2 3.58Å; L588-W620 HydrophobicContact CD2-CZ2 3.88Å; L588-W620 HydrophobicContact CD2-CZ3 3.43Å; L588-W620 VanDerWaalsContact CD2-CZ3 3.43Å; L588-W620 HydrophobicContact CG-CZ3 4.33Å; L588-A623 HydrophobicContact CB-CB 4.24Å; L588-A623 HydrophobicContact CD2-CB 3.92Å; L588-A623 HydrophobicContact CG-CB 3.8Å; L588-L624 HydrophobicContact CD2-CD2 4.01Å; L588-L627 HydrophobicContact CD1-CD1 4.06Å; L588-L627 HydrophobicContact CG-CD1 4.37Å
589	L	96.3	Very high	93.1	Very high	28 Å²	28	47.7 Å²	47.7	15%	0.147	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-39.3	176.3	-179.6	61.3	0	0	0	111.5	P585 A586 D587 A592 K593 T619 T622 A623	P585-L589 WeakPolarHBondContact O-CB 3.45Å; P585-L589 PolarHBondContact O-N 3.44Å; A586-L589 PolarHBondContact O-N 3.03Å; D587-L589 VanDerWaalsContact C-N 3.34Å; L589-A592 PolarHBondContact O-N 2.77Å; L589-K593 WeakPolarHBondContact O-CG 3.4Å; L589-K593 PolarHBondContact O-N 3.26Å; L589-T619 HydrophobicContact CB-CG2 4.11Å; L589-T619 HydrophobicContact CD2-CG2 3.95Å; L589-T622 HydrophobicContact CD1-CG2 4.02Å; L589-A623 HydrophobicContact CB-CB 4.04Å; L589-A623 HydrophobicContact CD1-CB 4.18Å
590	E	96.2	Very high	92.9	Very high	67 Å²	67	44.6 Å²	44.6	31%	0.313	23%	0.229	S	C	.	.	H	α-helix	trans	-66	-45.6	174.9	-179.2	55.7	-158.7	0	0	111.9	C559 A586 D587 L588 A592 K593 R594	C559-E590 HydrophobicContact CB-CG 4.06Å; A586-E590 PolarHBondContact O-N 3.33Å; D587-E590 PolarHBondContact O-N 3.1Å; L588-E590 VanDerWaalsContact C-N 3.31Å; L588-E590 PolarHBondContact O-N 3.17Å; E590-A592 VanDerWaalsContact C-N 3.3Å; E590-A592 PolarHBondContact O-N 2.74Å; E590-K593 WeakPolarHBondContact O-CB 3.43Å; E590-K593 PolarHBondContact O-N 3.32Å; E590-K593 IonicContact OE2-NZ 2.71Å; E590-R594 PolarHBondContact O-N 3.36Å; E590-R594 IonicContact OE1-CZ 3.92Å; E590-R594 IonicContact OE1-NE 2.73Å; E590-R594 PolarHBondContact OE1-NE 2.95Å; E590-R594 IonicContact OE1-NH2 3.87Å
591	F	95.9	Very high	92.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-54.9	-46.3	171.5	170.5	-102	0	0	0	111.8	V558 L561 A562 D587 L588 K593 R594 L595 L606 L627	V558-F591 HydrophobicContact CG1-CB 4.24Å; V558-F591 HydrophobicContact CG2-CD2 4.36Å; V558-F591 HydrophobicContact CG2-CG 4.48Å; V558-F591 VanDerWaalsContact O-CD2 3.27Å; V558-F591 WeakPolarHBondContact O-CD2 3.14Å; L561-F591 HydrophobicContact CB-CE2 4.1Å; A562-F591 HydrophobicContact CB-CD2 4.05Å; A562-F591 HydrophobicContact CB-CE2 4.08Å; D587-F591 PolarHBondContact O-N 3.33Å; L588-F591 HydrophobicContact CD1-CD1 4.08Å; L588-F591 PolarHBondContact O-N 3.39Å; F591-K593 PolarHBondContact O-N 3.07Å; F591-R594 PolarHBondContact O-N 3.5Å; F591-L595 HydrophobicContact CE1-CD2 4.22Å; F591-L595 HydrophobicContact CZ-CD2 4.23Å; F591-L595 WeakPolarHBondContact O-CB 3.33Å; F591-L595 PolarHBondContact O-N 3Å; F591-L606 HydrophobicContact CE1-CD2 4Å; F591-L627 HydrophobicContact CD1-CD2 4.23Å; F591-L627 HydrophobicContact CE1-CD2 4.02Å
592	A	95.4	Very high	92.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-42.5	177.7	0	0	0	0	0	112.3	L588 L589 E590 L595 M596 A623 R626 L627	L588-A592 WeakPolarHBondContact O-CB 3.28Å; L588-A592 PolarHBondContact O-N 2.77Å; L589-A592 PolarHBondContact O-N 2.77Å; E590-A592 VanDerWaalsContact C-N 3.3Å; E590-A592 PolarHBondContact O-N 2.74Å; A592-L595 PolarHBondContact O-N 3.21Å; A592-M596 WeakPolarHBondContact O-CG 3.32Å; A592-M596 PolarHBondContact O-N 3.34Å; A592-M596 VanDerWaalsContact O-N 3.1Å; A592-A623 HydrophobicContact CB-CB 4.47Å; A592-R626 HydrophobicContact CB-CB 4.11Å; A592-L627 HydrophobicContact CB-CD1 4.21Å; A592-L627 HydrophobicContact CB-CD2 3.79Å; A592-L627 HydrophobicContact CB-CG 3.7Å
593	K	94.9	Very high	91.9	Very high	86 Å²	86	55.2 Å²	55.2	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-59.3	-47.5	175.6	-73.6	169.3	-172.7	167.6	0	111.4	L589 E590 F591 M596	L589-K593 WeakPolarHBondContact O-CG 3.4Å; L589-K593 PolarHBondContact O-N 3.26Å; E590-K593 WeakPolarHBondContact O-CB 3.43Å; E590-K593 PolarHBondContact O-N 3.32Å; E590-K593 IonicContact OE2-NZ 2.71Å; F591-K593 PolarHBondContact O-N 3.07Å; K593-M596 PolarHBondContact O-N 3.27Å
594	R	93.5	Very high	91.7	Very high	76 Å²	76	55.2 Å²	55.2	29%	0.287	28%	0.277	S	S	.	.	H	α-helix	trans	-64.9	-40.6	179.8	-66.9	-172.1	-171.8	-164.9	1.5	112.1	A562 E590 F591 M596 I597 H598	A562-R594 HydrophobicContact CB-CB 3.58Å; E590-R594 PolarHBondContact O-N 3.36Å; E590-R594 IonicContact OE1-CZ 3.92Å; E590-R594 IonicContact OE1-NE 2.73Å; E590-R594 PolarHBondContact OE1-NE 2.95Å; E590-R594 IonicContact OE1-NH2 3.87Å; F591-R594 PolarHBondContact O-N 3.5Å; R594-M596 PolarHBondContact O-N 3.27Å; R594-I597 WeakPolarHBondContact O-CB 3.36Å; R594-I597 PolarHBondContact O-N 2.92Å; R594-I597 VanDerWaalsContact O-N 3.1Å; R594-H598 PolarHBondContact O-N 3.04Å
595	L	91.8	Very high	91.6	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-28.3	177.3	-162.7	70.4	0	0	0	112.5	A562 F565 F591 A592 I597 H598 P599 P600 L627	A562-L595 HydrophobicContact CB-CB 4.4Å; A562-L595 HydrophobicContact CB-CD1 4.36Å; F565-L595 HydrophobicContact CD2-CD1 3.42Å; F565-L595 VanDerWaalsContact CD2-CD1 3.42Å; F565-L595 HydrophobicContact CE2-CD1 3.86Å; F565-L595 HydrophobicContact CG-CD1 4.4Å; F591-L595 HydrophobicContact CE1-CD2 4.22Å; F591-L595 HydrophobicContact CZ-CD2 4.23Å; F591-L595 WeakPolarHBondContact O-CB 3.33Å; F591-L595 PolarHBondContact O-N 3Å; A592-L595 PolarHBondContact O-N 3.21Å; L595-I597 VanDerWaalsContact C-N 3.34Å; L595-H598 CarbonylContact O-C 3.37Å; L595-H598 PolarHBondContact O-N 3.23Å; L595-H598 VanDerWaalsContact O-O 3.09Å; L595-P599 VanDerWaalsContact O-CA 3.25Å; L595-P599 WeakPolarHBondContact O-CA 3.48Å; L595-P599 VanDerWaalsContact O-N 3.16Å; L595-P600 HydrophobicContact CD1-CG 4.06Å; L595-P600 HydrophobicContact CD2-CG 4.43Å; L595-P600 HydrophobicContact CG-CG 4.39Å; L595-L627 HydrophobicContact CD2-CD2 3.58Å
596	M	89.9	Confident	91.5	Very high	107 Å²	107	54.4 Å²	54.4	53%	0.527	28%	0.275	S	S	.	.	H	α-helix	trans	-71.5	-26.7	174.1	-67.7	-159.6	-37.8	0	0	113.6	A592 K593 R594 H598 R626	A592-M596 WeakPolarHBondContact O-CG 3.32Å; A592-M596 PolarHBondContact O-N 3.34Å; A592-M596 VanDerWaalsContact O-N 3.1Å; K593-M596 PolarHBondContact O-N 3.27Å; R594-M596 PolarHBondContact O-N 3.27Å; M596-H598 VanDerWaalsContact C-N 3.31Å; M596-R626 HydrophobicContact SD-CB 4.22Å; M596-R626 HydrophobicContact SD-CG 4.38Å
597	I	89.5	Confident	91.3	Very high	117 Å²	117	51.8 Å²	51.8	60%	0.6	25%	0.252	S	S	*	.	H	α-helix	trans	-68.1	-38.7	176.7	-57.5	172.7	0	0	0	109.5	R594 L595	R594-I597 WeakPolarHBondContact O-CB 3.36Å; R594-I597 PolarHBondContact O-N 2.92Å; R594-I597 VanDerWaalsContact O-N 3.1Å; L595-I597 VanDerWaalsContact C-N 3.34Å
598	H	86	Confident	91.2	Very high	84 Å²	84	50 Å²	50	39%	0.389	24%	0.243	S	C	.	.	S	Bend	trans	-132.3	81.4	-179.8	-60.8	-54	0	0	0	109.9	F565 S566 R594 L595 M596	F565-H598 WeakPolarHBondContact CB-O 3.46Å; S566-H598 WeakPolarHBondContact CB-CD2 3.45Å; R594-H598 PolarHBondContact O-N 3.04Å; L595-H598 CarbonylContact O-C 3.37Å; L595-H598 PolarHBondContact O-N 3.23Å; L595-H598 VanDerWaalsContact O-O 3.09Å; M596-H598 VanDerWaalsContact C-N 3.31Å
599	P	86.5	Confident	90.8	Very high	72 Å²	72	54.5 Å²	54.5	47%	0.468	26%	0.26	S	S	.	.			trans	-68.6	147	-176	27.5	-34.1	0	0	0	111.4	L595	L595-P599 VanDerWaalsContact O-CA 3.25Å; L595-P599 WeakPolarHBondContact O-CA 3.48Å; L595-P599 VanDerWaalsContact O-N 3.16Å
600	P	88.1	Confident	90.4	Very high	14 Å²	14	58.4 Å²	58.4	9%	0.091	28%	0.276	C	S	.	.			trans	-54.6	144.4	171.1	-25.3	33.3	0	0	0	112.3	F565 L595 H602 L604	F565-P600 HydrophobicContact CD1-CB 3.78Å; F565-P600 HydrophobicContact CD1-CG 4.02Å; F565-P600 HydrophobicContact CD2-CG 3.88Å; F565-P600 HydrophobicContact CE1-CB 3.77Å; F565-P600 HydrophobicContact CE1-CG 4.03Å; F565-P600 HydrophobicContact CE2-CG 3.88Å; F565-P600 HydrophobicContact CG-CB 4.15Å; F565-P600 HydrophobicContact CG-CG 3.93Å; F565-P600 HydrophobicContact CZ-CB 4.15Å; F565-P600 HydrophobicContact CZ-CG 3.95Å; L595-P600 HydrophobicContact CD1-CG 4.06Å; L595-P600 HydrophobicContact CD2-CG 4.43Å; L595-P600 HydrophobicContact CG-CG 4.39Å; P600-H602 WeakPolarHBondContact CB-O 3.03Å; P600-H602 PolarHBondContact O-N 3.36Å; P600-L604 HydrophobicContact CB-CB 4.36Å; P600-L604 HydrophobicContact CG-CB 4.19Å; P600-L604 HydrophobicContact CG-CD2 4.3Å
601	P	84.4	Confident	90.1	Very high	64 Å²	64	55.4 Å²	55.4	42%	0.416	26%	0.262	S	S	.	.	S	Bend	trans	-67.6	-21.3	-179.7	27	-34.7	0	0	0	113.1
602	H	85.6	Confident	89.8	Confident	116 Å²	116	55.4 Å²	55.4	54%	0.537	26%	0.262	S	S	.	.	S	Bend	trans	-132.2	161.9	177.1	-56.9	-49.1	0	0	0	110	P600 L604	P600-H602 WeakPolarHBondContact CB-O 3.03Å; P600-H602 PolarHBondContact O-N 3.36Å; H602-L604 PolarHBondContact O-N 2.91Å; H602-L604 VanDerWaalsContact O-N 3.08Å
603	R	85.4	Confident	89.3	Confident	164 Å²	164	55.8 Å²	55.8	62%	0.619	27%	0.266	S	S	*	.			trans	-64	114	177.5	-165.7	175.7	-171.5	173.1	4.8	110.4	S630 S631	R603-S630 WeakPolarHBondContact CA-O 3.15Å; R603-S631 PolarHBondContact NE-O 3.41Å
604	L	90.5	Very high	88.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	127	-174.1	178.1	68.8	0	0	0	111.3	F565 L573 L576 P600 H602 L606 S630 S631 F632	F565-L604 HydrophobicContact CE2-CD2 4.08Å; F565-L604 HydrophobicContact CZ-CD1 4.18Å; F565-L604 HydrophobicContact CZ-CD2 3.94Å; L573-L604 HydrophobicContact CD2-CD1 4.36Å; L573-L604 HydrophobicContact CG-CD1 4.37Å; L576-L604 HydrophobicContact CB-CD1 4.07Å; L576-L604 HydrophobicContact CB-CD2 4.21Å; L576-L604 HydrophobicContact CB-CG 4.43Å; L576-L604 HydrophobicContact CD2-CD2 4.44Å; P600-L604 HydrophobicContact CB-CB 4.36Å; P600-L604 HydrophobicContact CG-CB 4.19Å; P600-L604 HydrophobicContact CG-CD2 4.3Å; H602-L604 PolarHBondContact O-N 2.91Å; H602-L604 VanDerWaalsContact O-N 3.08Å; L604-L606 PolarHBondContact O-N 3.48Å; L604-S630 PolarHBondContact N-O 3.27Å; L604-S631 CarbonylContact O-C 3.4Å; L604-S631 WeakPolarHBondContact O-CA 3.14Å; L604-S631 WeakPolarHBondContact O-CB 3.38Å; L604-F632 PolarHBondContact O-N 3.23Å
605	T	90.9	Very high	88.5	Confident	43 Å²	43	58.4 Å²	58.4	26%	0.264	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	114.1	165.4	-63.4	0	0	0	0	108.9	K574 Q575 L576 F632 L634	K574-T605 PolarHBondContact O-N 3.2Å; Q575-T605 CarbonylContact C-O 3.56Å; Q575-T605 WeakPolarHBondContact CA-O 3.31Å; L576-T605 PolarHBondContact N-O 2.94Å; T605-F632 WeakPolarHBondContact CA-O 3.29Å; T605-F632 HydrophobicContact CG2-CD1 4.26Å; T605-L634 HydrophobicContact CG2-CD1 4.43Å
606	L	93.3	Very high	88.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.1	-177	-176.4	66.9	0	0	0	110.3	L576 I578 F591 L604 L608 L627 F632 L633 L634	L576-L606 HydrophobicContact CB-CD1 3.93Å; L576-L606 HydrophobicContact CD2-CD1 3.79Å; L576-L606 HydrophobicContact CG-CD1 3.85Å; L576-L606 WeakPolarHBondContact O-CA 3.42Å; I578-L606 HydrophobicContact CD1-CD1 3.87Å; I578-L606 HydrophobicContact CG1-CD1 3.99Å; F591-L606 HydrophobicContact CE1-CD2 4Å; L604-L606 PolarHBondContact O-N 3.48Å; L606-L608 HydrophobicContact CD2-CD1 3.97Å; L606-L608 HydrophobicContact CD2-CD2 4.17Å; L606-L608 HydrophobicContact CD2-CG 4.05Å; L606-L608 HydrophobicContact CG-CD1 4.39Å; L606-L608 HydrophobicContact CG-CD2 4.24Å; L606-L608 HydrophobicContact CG-CG 3.99Å; L606-L627 HydrophobicContact CD2-CD1 4.05Å; L606-F632 PolarHBondContact N-O 3.16Å; L606-L633 HydrophobicContact CB-CD2 4.05Å; L606-L633 HydrophobicContact CD2-CD2 3.96Å; L606-L633 HydrophobicContact CG-CD2 4.48Å; L606-L634 PolarHBondContact O-N 2.78Å
607	D	91.1	Very high	88.4	Confident	11 Å²	11	59.5 Å²	59.5	6%	0.059	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	109.7	175.3	-163.8	-12.8	0	0	0	110.9	L576 D577 I578 R579 R609 L634	L576-D607 PolarHBondContact O-N 3.34Å; D577-D607 HydrophobicContact CB-CB 4.13Å; I578-D607 CarbonylContact C-O 3.52Å; I578-D607 WeakPolarHBondContact CG1-O 3.37Å; I578-D607 PolarHBondContact N-O 3.28Å; R579-D607 PolarHBondContact N-O 3.49Å; D607-R609 WeakPolarHBondContact OD1-CB 3.42Å; D607-R609 WeakPolarHBondContact OD1-CG 3.3Å; D607-R609 IonicContact OD1-CZ 3.16Å; D607-R609 PolarHBondContact OD1-N 3.03Å; D607-R609 IonicContact OD1-NE 3.42Å; D607-R609 PolarHBondContact OD1-NE 2.89Å; D607-R609 IonicContact OD2-CZ 3.37Å; D607-R609 VanDerWaalsContact OD2-CZ 3.24Å; D607-R609 IonicContact OD2-NE 2.68Å; D607-R609 PolarHBondContact OD2-NE 3.42Å; D607-R609 IonicContact OD2-NH2 3.28Å; D607-R609 PolarHBondContact OD2-NH2 3.28Å; D607-L634 HydrophobicContact CB-CB 4.43Å; D607-L634 HydrophobicContact CB-CD1 4.17Å
608	L	93	Very high	88.6	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	30%	0.296	C	S	.	.			trans	-109.5	6.6	179	-66.9	170.7	0	0	0	112	I578 L588 L606 N611 W620 L624 L627 L633 L634 V635	I578-L608 HydrophobicContact CD1-CD2 3.65Å; I578-L608 HydrophobicContact CG1-CD2 3.9Å; L588-L608 HydrophobicContact CD1-CD1 4.11Å; L588-L608 HydrophobicContact CD1-CD2 3.72Å; L588-L608 HydrophobicContact CD2-CD1 4.05Å; L606-L608 HydrophobicContact CD2-CD1 3.97Å; L606-L608 HydrophobicContact CD2-CD2 4.17Å; L606-L608 HydrophobicContact CD2-CG 4.05Å; L606-L608 HydrophobicContact CG-CD1 4.39Å; L606-L608 HydrophobicContact CG-CD2 4.24Å; L606-L608 HydrophobicContact CG-CG 3.99Å; L608-N611 PolarHBondContact O-ND2 3.47Å; L608-W620 HydrophobicContact CB-CZ2 4.33Å; L608-L624 HydrophobicContact CD1-CD2 3.79Å; L608-L627 HydrophobicContact CD1-CD1 4.36Å; L608-L633 HydrophobicContact CD1-CD2 4.42Å; L608-L634 CarbonylContact C-O 3.58Å; L608-L634 WeakPolarHBondContact CA-O 3.41Å; L608-L634 WeakPolarHBondContact CB-O 3.32Å; L608-L634 PolarHBondContact N-O 2.91Å; L608-V635 HydrophobicContact CB-CG1 3.82Å; L608-V635 HydrophobicContact CD1-CG1 3.8Å; L608-V635 HydrophobicContact CG-CG1 4.4Å
609	R	89.2	Confident	89	Confident	94 Å²	94	59 Å²	59	36%	0.355	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	153.9	-176	-71.3	-177.4	-68.6	177.8	-0.9	111.7	R579 S580 D607 N611 L634 E636	R579-R609 WeakPolarHBondContact CA-O 3.24Å; R579-R609 HydrophobicContact CB-CB 4.29Å; R579-R609 WeakPolarHBondContact CB-O 3.42Å; S580-R609 PolarHBondContact N-O 3.07Å; D607-R609 WeakPolarHBondContact OD1-CB 3.42Å; D607-R609 WeakPolarHBondContact OD1-CG 3.3Å; D607-R609 IonicContact OD1-CZ 3.16Å; D607-R609 PolarHBondContact OD1-N 3.03Å; D607-R609 IonicContact OD1-NE 3.42Å; D607-R609 PolarHBondContact OD1-NE 2.89Å; D607-R609 IonicContact OD2-CZ 3.37Å; D607-R609 VanDerWaalsContact OD2-CZ 3.24Å; D607-R609 IonicContact OD2-NE 2.68Å; D607-R609 PolarHBondContact OD2-NE 3.42Å; D607-R609 IonicContact OD2-NH2 3.28Å; D607-R609 PolarHBondContact OD2-NH2 3.28Å; R609-N611 PolarHBondContact O-N 2.98Å; R609-N611 VanDerWaalsContact O-N 3.14Å; R609-N611 PolarHBondContact O-ND2 3.2Å; R609-L634 HydrophobicContact CG-CB 4.19Å; R609-L634 PolarHBondContact N-O 3.34Å; R609-E636 CarbonylContact C-O 3.53Å; R609-E636 WeakPolarHBondContact CA-O 3.14Å; R609-E636 WeakPolarHBondContact CB-O 3.09Å; R609-E636 VanDerWaalsContact CG-O 3.25Å; R609-E636 WeakPolarHBondContact CG-O 3.32Å
610	K	86.6	Confident	89.3	Confident	110 Å²	110	56.4 Å²	56.4	48%	0.478	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	28.2	175.9	-55.9	-177.9	175.4	-174.8	0	114.8	S580 E636	S580-K610 WeakPolarHBondContact CA-O 3.27Å; S580-K610 VanDerWaalsContact OG-CB 3.23Å; S580-K610 WeakPolarHBondContact OG-CB 3.28Å; S580-K610 WeakPolarHBondContact OG-CD 3.37Å; K610-E636 PolarHBondContact N-O 3.46Å
611	N	90.9	Very high	89.5	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	29%	0.285	C	S	.	.	S	Bend	trans	-102.9	152.2	168	-76	-72.8	0	0	0	110.7	I578 N581 F582 I583 L608 R609 G613 W620 W638	I578-N611 PolarHBondContact O-ND2 3.42Å; N581-N611 PolarHBondContact N-OD1 2.93Å; F582-N611 PolarHBondContact N-OD1 2.69Å; F582-N611 VanDerWaalsContact N-OD1 3.15Å; I583-N611 HydrophobicContact CB-CB 4.48Å; I583-N611 PolarHBondContact N-OD1 2.95Å; I583-N611 VanDerWaalsContact N-OD1 3.12Å; L608-N611 PolarHBondContact O-ND2 3.47Å; R609-N611 PolarHBondContact O-N 2.98Å; R609-N611 VanDerWaalsContact O-N 3.14Å; R609-N611 PolarHBondContact O-ND2 3.2Å; N611-G613 PolarHBondContact O-N 3.42Å; N611-W620 HydrophobicContact CB-CH2 3.75Å; N611-W620 HydrophobicContact CB-CZ3 4.38Å; N611-W638 WeakPolarHBondContact O-CB 3.39Å
612	P	89.4	Confident	90	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.282	C	S	.	.			trans	-74.3	57.8	-172.7	32.2	-37.8	0	0	0	114.8	I583 Q584 D614 R615 W638	I583-P612 WeakPolarHBondContact O-CD 3.31Å; I583-P612 WeakPolarHBondContact O-CG 3.27Å; Q584-P612 VanDerWaalsContact NE2-CG 3.3Å; P612-D614 VanDerWaalsContact C-N 3.29Å; P612-D614 PolarHBondContact O-N 3.18Å; P612-R615 HydrophobicContact CB-CG 4.32Å; P612-W638 VanDerWaalsContact CA-CD1 3.47Å; P612-W638 HydrophobicContact CB-CD2 4.44Å; P612-W638 HydrophobicContact CB-CZ2 4.26Å
613	G	85	Confident	90.4	Very high	8 Å²	8	53.8 Å²	53.8	8%	0.082	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-72.3	-18	179	0	0	0	0	0	114.8	N611 R615 D616 W620	N611-G613 PolarHBondContact O-N 3.42Å; G613-R615 VanDerWaalsContact C-N 3.31Å; G613-R615 PolarHBondContact O-N 3.45Å; G613-D616 CarbonylContact O-C 3.5Å; G613-W620 VanDerWaalsContact CA-CE3 3.41Å
614	D	84.2	Confident	90.8	Very high	65 Å²	65	46.9 Å²	46.9	35%	0.348	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-77.9	-13.5	-179	68.5	-32	0	0	0	113.9	P612 D616 W638 S640	P612-D614 VanDerWaalsContact C-N 3.29Å; P612-D614 PolarHBondContact O-N 3.18Å; D614-D616 VanDerWaalsContact C-N 3.35Å; D614-W638 PolarHBondContact OD1-NE1 3.36Å; D614-S640 VanDerWaalsContact CG-OG 3.27Å; D614-S640 PolarHBondContact OD1-OG 3.19Å; D614-S640 WeakPolarHBondContact OD2-CA 3.49Å; D614-S640 WeakPolarHBondContact OD2-CB 3.27Å; D614-S640 PolarHBondContact OD2-N 3.04Å; D614-S640 PolarHBondContact OD2-OG 3.49Å
615	R	86.4	Confident	90.8	Very high	152 Å²	152	53.9 Å²	53.9	57%	0.574	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-68.5	-32.5	177.9	-68.4	-174.6	172.9	-174.1	-7	113.5	Q584 P612 G613	Q584-R615 VanDerWaalsContact OE1-NH1 3.15Å; P612-R615 HydrophobicContact CB-CG 4.32Å; G613-R615 VanDerWaalsContact C-N 3.31Å; G613-R615 PolarHBondContact O-N 3.45Å
616	D	91.6	Very high	90.9	Very high	60 Å²	60	56.1 Å²	56.1	32%	0.321	27%	0.265	S	S	.	.	S	Bend	trans	-146.6	85.5	172.2	177.1	-5.4	0	0	0	108.4	P585 G613 D614 E618 T619 W620	P585-D616 HydrophobicContact CB-CB 4Å; P585-D616 HydrophobicContact CG-CB 3.9Å; G613-D616 CarbonylContact O-C 3.5Å; D614-D616 VanDerWaalsContact C-N 3.35Å; D616-E618 VanDerWaalsContact C-N 3.25Å; D616-E618 PolarHBondContact O-N 3.01Å; D616-E618 PolarHBondContact OD1-N 3.27Å; D616-T619 VanDerWaalsContact CG-CB 3.46Å; D616-T619 VanDerWaalsContact CG-OG1 3.26Å; D616-T619 PolarHBondContact OD1-N 3.11Å; D616-T619 PolarHBondContact OD1-OG1 3.11Å; D616-T619 WeakPolarHBondContact OD2-CB 3.45Å; D616-T619 PolarHBondContact OD2-OG1 3.19Å; D616-W620 WeakPolarHBondContact O-CB 3.49Å; D616-W620 PolarHBondContact O-N 3.03Å
617	P	89.6	Confident	90.8	Very high	70 Å²	70	56.1 Å²	56.1	46%	0.455	27%	0.266	S	S	.	.	H	α-helix	trans	-63.6	-28.7	-177.1	-23.5	34.7	0	0	0	113.3	N621	P617-N621 WeakPolarHBondContact O-CB 3.47Å; P617-N621 PolarHBondContact O-N 3.44Å; P617-N621 PolarHBondContact O-ND2 3.14Å
618	E	92.8	Very high	90.7	Very high	157 Å²	157	60.9 Å²	60.9	73%	0.734	29%	0.287	S	S	*	.	H	α-helix	trans	-70.3	-49.7	-178.1	-65.6	-170.8	175.2	0	0	110.9	D616 W620 N621 T622	D616-E618 VanDerWaalsContact C-N 3.25Å; D616-E618 PolarHBondContact O-N 3.01Å; D616-E618 PolarHBondContact OD1-N 3.27Å; E618-W620 VanDerWaalsContact C-N 3.34Å; E618-N621 PolarHBondContact O-N 2.93Å; E618-T622 WeakPolarHBondContact O-CB 3.43Å; E618-T622 PolarHBondContact O-N 2.81Å; E618-T622 PolarHBondContact O-OG1 3.22Å
619	T	94.5	Very high	90.4	Very high	34 Å²	34	66 Å²	66	21%	0.209	32%	0.321	C	S	.	.	H	α-helix	trans	-64.7	-40.8	175.8	-61.8	0	0	0	0	110.8	P585 L589 D616 T622 A623	P585-T619 HydrophobicContact CB-CG2 3.89Å; P585-T619 WeakPolarHBondContact O-CG2 3.43Å; L589-T619 HydrophobicContact CB-CG2 4.11Å; L589-T619 HydrophobicContact CD2-CG2 3.95Å; D616-T619 VanDerWaalsContact CG-CB 3.46Å; D616-T619 VanDerWaalsContact CG-OG1 3.26Å; D616-T619 PolarHBondContact OD1-N 3.11Å; D616-T619 PolarHBondContact OD1-OG1 3.11Å; D616-T619 WeakPolarHBondContact OD2-CB 3.45Å; D616-T619 PolarHBondContact OD2-OG1 3.19Å; T619-T622 WeakPolarHBondContact O-CB 3.32Å; T619-T622 PolarHBondContact O-N 3.47Å; T619-A623 PolarHBondContact O-N 3.49Å
620	W	93.7	Very high	90.2	Very high	18 Å²	18	62.6 Å²	62.6	7%	0.068	31%	0.311	C	S	.	.	H	α-helix	trans	-59.9	-52.5	177	-174	-98.8	0	0	0	111.3	P585 L588 L608 N611 G613 D616 E618 T622 A623 L624 V635	P585-W620 HydrophobicContact CB-CB 4.2Å; P585-W620 HydrophobicContact CB-CE3 4.34Å; P585-W620 HydrophobicContact CG-CB 4.32Å; P585-W620 HydrophobicContact CG-CE3 4.12Å; L588-W620 HydrophobicContact CB-CE3 4.34Å; L588-W620 HydrophobicContact CB-CZ3 4.09Å; L588-W620 HydrophobicContact CD2-CD2 3.86Å; L588-W620 HydrophobicContact CD2-CE3 3.56Å; L588-W620 HydrophobicContact CD2-CH2 3.58Å; L588-W620 HydrophobicContact CD2-CZ2 3.88Å; L588-W620 HydrophobicContact CD2-CZ3 3.43Å; L588-W620 VanDerWaalsContact CD2-CZ3 3.43Å; L588-W620 HydrophobicContact CG-CZ3 4.33Å; L608-W620 HydrophobicContact CB-CZ2 4.33Å; N611-W620 HydrophobicContact CB-CH2 3.75Å; N611-W620 HydrophobicContact CB-CZ3 4.38Å; G613-W620 VanDerWaalsContact CA-CE3 3.41Å; D616-W620 WeakPolarHBondContact O-CB 3.49Å; D616-W620 PolarHBondContact O-N 3.03Å; E618-W620 VanDerWaalsContact C-N 3.34Å; W620-T622 VanDerWaalsContact C-N 3.25Å; W620-T622 PolarHBondContact O-N 3.2Å; W620-A623 WeakPolarHBondContact O-CB 3.37Å; W620-A623 PolarHBondContact O-N 3.4Å; W620-L624 WeakPolarHBondContact O-CG 3.33Å; W620-L624 PolarHBondContact O-N 3.32Å; W620-V635 HydrophobicContact CZ2-CG1 4.49Å
621	N	91.6	Very high	90.2	Very high	81 Å²	81	57.4 Å²	57.4	43%	0.433	29%	0.289	S	S	.	.	H	α-helix	trans	-61.7	-34.4	177.9	-75.9	-43.4	0	0	0	112.4	P617 E618 L624 K625	P617-N621 WeakPolarHBondContact O-CB 3.47Å; P617-N621 PolarHBondContact O-N 3.44Å; P617-N621 PolarHBondContact O-ND2 3.14Å; E618-N621 PolarHBondContact O-N 2.93Å; N621-L624 PolarHBondContact O-N 3.22Å; N621-K625 WeakPolarHBondContact O-CB 3.41Å; N621-K625 VanDerWaalsContact O-CG 3.3Å; N621-K625 WeakPolarHBondContact O-CG 3.45Å; N621-K625 PolarHBondContact O-N 3.04Å
622	T	94.7	Very high	89.9	Confident	58 Å²	58	62.6 Å²	62.6	36%	0.356	31%	0.311	S	S	.	.	H	α-helix	trans	-63.4	-42.9	173.5	-60.8	0	0	0	0	111.3	L589 E618 T619 W620 R626	L589-T622 HydrophobicContact CD1-CG2 4.02Å; E618-T622 WeakPolarHBondContact O-CB 3.43Å; E618-T622 PolarHBondContact O-N 2.81Å; E618-T622 PolarHBondContact O-OG1 3.22Å; T619-T622 WeakPolarHBondContact O-CB 3.32Å; T619-T622 PolarHBondContact O-N 3.47Å; W620-T622 VanDerWaalsContact C-N 3.25Å; W620-T622 PolarHBondContact O-N 3.2Å; T622-R626 WeakPolarHBondContact O-CG 3.42Å; T622-R626 PolarHBondContact O-N 3.01Å
623	A	94.5	Very high	89.8	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-44.7	174.6	0	0	0	0	0	111.7	L588 L589 A592 T619 W620 K625 R626 L627	L588-A623 HydrophobicContact CB-CB 4.24Å; L588-A623 HydrophobicContact CD2-CB 3.92Å; L588-A623 HydrophobicContact CG-CB 3.8Å; L589-A623 HydrophobicContact CB-CB 4.04Å; L589-A623 HydrophobicContact CD1-CB 4.18Å; A592-A623 HydrophobicContact CB-CB 4.47Å; T619-A623 PolarHBondContact O-N 3.49Å; W620-A623 WeakPolarHBondContact O-CB 3.37Å; W620-A623 PolarHBondContact O-N 3.4Å; A623-K625 PolarHBondContact O-N 3.05Å; A623-R626 WeakPolarHBondContact O-CB 3.34Å; A623-R626 PolarHBondContact O-N 2.9Å; A623-R626 VanDerWaalsContact O-N 3.15Å; A623-L627 WeakPolarHBondContact O-CG 3.47Å; A623-L627 VanDerWaalsContact O-N 3.1Å; A623-L627 PolarHBondContact O-N 3.38Å
624	L	92.5	Very high	89.8	Confident	18 Å²	18	66.2 Å²	66.2	9%	0.094	33%	0.328	C	S	.	.	H	α-helix	trans	-60.1	-46.5	177.9	-62.1	-169.6	0	0	0	112.2	L588 L608 W620 N621 R626 L627 Q628 L633 V635	L588-L624 HydrophobicContact CD2-CD2 4.01Å; L608-L624 HydrophobicContact CD1-CD2 3.79Å; W620-L624 WeakPolarHBondContact O-CG 3.33Å; W620-L624 PolarHBondContact O-N 3.32Å; N621-L624 PolarHBondContact O-N 3.22Å; L624-R626 PolarHBondContact O-N 3.41Å; L624-L627 PolarHBondContact O-N 2.73Å; L624-Q628 WeakPolarHBondContact O-CG 3.42Å; L624-Q628 PolarHBondContact O-N 3.07Å; L624-L633 HydrophobicContact CB-CD1 4.14Å; L624-L633 HydrophobicContact CD2-CD1 4.18Å; L624-V635 HydrophobicContact CD1-CB 4.26Å; L624-V635 HydrophobicContact CD1-CG1 3.89Å; L624-V635 HydrophobicContact CD1-CG2 4.29Å; L624-V635 HydrophobicContact CD2-CG1 3.54Å; L624-V635 HydrophobicContact CG-CG1 4.36Å
625	K	91.6	Very high	89.6	Confident	148 Å²	148	65.7 Å²	65.7	64%	0.643	33%	0.328	S	S	*	.	H	α-helix	trans	-56.9	-35.6	176.6	-76.2	175.3	-177.6	178.6	0	112.3	N621 A623	N621-K625 WeakPolarHBondContact O-CB 3.41Å; N621-K625 VanDerWaalsContact O-CG 3.3Å; N621-K625 WeakPolarHBondContact O-CG 3.45Å; N621-K625 PolarHBondContact O-N 3.04Å; A623-K625 PolarHBondContact O-N 3.05Å
626	R	93.1	Very high	89.2	Confident	89 Å²	89	64.8 Å²	64.8	34%	0.336	33%	0.33	S	S	.	.	H	α-helix	trans	-73.7	-30.3	176.8	-70.6	178.1	-176.3	-164.2	-1.6	113.3	A592 M596 T622 A623 L624 P629	A592-R626 HydrophobicContact CB-CB 4.11Å; M596-R626 HydrophobicContact SD-CB 4.22Å; M596-R626 HydrophobicContact SD-CG 4.38Å; T622-R626 WeakPolarHBondContact O-CG 3.42Å; T622-R626 PolarHBondContact O-N 3.01Å; A623-R626 WeakPolarHBondContact O-CB 3.34Å; A623-R626 PolarHBondContact O-N 2.9Å; A623-R626 VanDerWaalsContact O-N 3.15Å; L624-R626 PolarHBondContact O-N 3.41Å; R626-P629 WeakPolarHBondContact O-CD 3.49Å
627	L	91.6	Very high	88	Confident	1 Å²	1	65 Å²	65	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-83.4	-24.6	179.2	-66.9	167.3	0	0	0	113	L588 F591 A592 L595 L606 L608 A623 L624 P629 S630 S631 L633	L588-L627 HydrophobicContact CD1-CD1 4.06Å; L588-L627 HydrophobicContact CG-CD1 4.37Å; F591-L627 HydrophobicContact CD1-CD2 4.23Å; F591-L627 HydrophobicContact CE1-CD2 4.02Å; A592-L627 HydrophobicContact CB-CD1 4.21Å; A592-L627 HydrophobicContact CB-CD2 3.79Å; A592-L627 HydrophobicContact CB-CG 3.7Å; L595-L627 HydrophobicContact CD2-CD2 3.58Å; L606-L627 HydrophobicContact CD2-CD1 4.05Å; L608-L627 HydrophobicContact CD1-CD1 4.36Å; A623-L627 WeakPolarHBondContact O-CG 3.47Å; A623-L627 VanDerWaalsContact O-N 3.1Å; A623-L627 PolarHBondContact O-N 3.38Å; L624-L627 PolarHBondContact O-N 2.73Å; L627-P629 VanDerWaalsContact C-CD 3.41Å; L627-S630 PolarHBondContact O-N 3.09Å; L627-S630 PolarHBondContact O-OG 3.34Å; L627-S631 WeakPolarHBondContact O-CB 3.38Å; L627-S631 PolarHBondContact O-N 3.06Å; L627-L633 HydrophobicContact CB-CD1 4.13Å; L627-L633 HydrophobicContact CB-CD2 3.92Å
628	Q	87.8	Confident	87.2	Confident	110 Å²	110	64.4 Å²	64.4	51%	0.514	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-38.4	-177.2	-84.6	178.9	-9.7	0	0	116.1	L624 S630 S631 L633	L624-Q628 WeakPolarHBondContact O-CG 3.42Å; L624-Q628 PolarHBondContact O-N 3.07Å; Q628-S630 VanDerWaalsContact C-N 3.35Å; Q628-S630 PolarHBondContact O-N 3.4Å; Q628-S631 VanDerWaalsContact O-O 3.05Å; Q628-L633 HydrophobicContact CG-CD1 3.83Å
629	P	86.9	Confident	86.2	Confident	109 Å²	109	63 Å²	63	71%	0.708	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-35.8	179.9	-23.4	35.2	0	0	0	113.2	R626 L627	R626-P629 WeakPolarHBondContact O-CD 3.49Å; L627-P629 VanDerWaalsContact C-CD 3.41Å
630	S	84.2	Confident	85	Confident	22 Å²	22	62.5 Å²	62.5	15%	0.154	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-11.2	-176.3	51.1	0	0	0	0	113.9	R603 L604 L627 Q628	R603-S630 WeakPolarHBondContact CA-O 3.15Å; L604-S630 PolarHBondContact N-O 3.27Å; L627-S630 PolarHBondContact O-N 3.09Å; L627-S630 PolarHBondContact O-OG 3.34Å; Q628-S630 VanDerWaalsContact C-N 3.35Å; Q628-S630 PolarHBondContact O-N 3.4Å
631	S	86.9	Confident	83.7	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.007	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154	-171.9	-57	0	0	0	0	114.5	R603 L604 L627 Q628	R603-S631 PolarHBondContact NE-O 3.41Å; L604-S631 CarbonylContact O-C 3.4Å; L604-S631 WeakPolarHBondContact O-CA 3.14Å; L604-S631 WeakPolarHBondContact O-CB 3.38Å; L627-S631 WeakPolarHBondContact O-CB 3.38Å; L627-S631 PolarHBondContact O-N 3.06Å; Q628-S631 VanDerWaalsContact O-O 3.05Å
632	F	85.9	Confident	82.3	Confident	113 Å²	113	66.8 Å²	66.8	50%	0.496	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	119.1	160.6	179.4	-100.6	0	0	0	108.2	L604 T605 L606 L634	L604-F632 PolarHBondContact O-N 3.23Å; T605-F632 WeakPolarHBondContact CA-O 3.29Å; T605-F632 HydrophobicContact CG2-CD1 4.26Å; L606-F632 PolarHBondContact N-O 3.16Å; F632-L634 HydrophobicContact CZ-CD2 4.43Å; F632-L634 HydrophobicContact CE1-CG 4.43Å; F632-L634 HydrophobicContact CD1-CD2 4.36Å; F632-L634 HydrophobicContact CE1-CD2 3.67Å
633	L	86.7	Confident	80.4	Confident	29 Å²	29	66.8 Å²	66.8	15%	0.152	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	130.7	-166.3	-56.5	175.6	0	0	0	111.5	L606 L608 L624 L627 Q628 V635	L606-L633 HydrophobicContact CB-CD2 4.05Å; L606-L633 HydrophobicContact CD2-CD2 3.96Å; L606-L633 HydrophobicContact CG-CD2 4.48Å; L608-L633 HydrophobicContact CD1-CD2 4.42Å; L624-L633 HydrophobicContact CB-CD1 4.14Å; L624-L633 HydrophobicContact CD2-CD1 4.18Å; L627-L633 HydrophobicContact CB-CD1 4.13Å; L627-L633 HydrophobicContact CB-CD2 3.92Å; Q628-L633 HydrophobicContact CG-CD1 3.83Å; L633-V635 HydrophobicContact CB-CG1 4.33Å; L633-V635 HydrophobicContact CB-CG2 4.45Å
634	L	85.3	Confident	78.2	Confident	55 Å²	55	72.8 Å²	72.8	29%	0.288	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.2	167.5	-53.5	173.2	0	0	0	108.3	T605 L606 D607 L608 R609 F632	T605-L634 HydrophobicContact CG2-CD1 4.43Å; L606-L634 PolarHBondContact O-N 2.78Å; D607-L634 HydrophobicContact CB-CB 4.43Å; D607-L634 HydrophobicContact CB-CD1 4.17Å; L608-L634 CarbonylContact C-O 3.58Å; L608-L634 WeakPolarHBondContact CA-O 3.41Å; L608-L634 WeakPolarHBondContact CB-O 3.32Å; L608-L634 PolarHBondContact N-O 2.91Å; R609-L634 HydrophobicContact CG-CB 4.19Å; R609-L634 PolarHBondContact N-O 3.34Å; F632-L634 HydrophobicContact CZ-CD2 4.43Å; F632-L634 HydrophobicContact CE1-CG 4.43Å; F632-L634 HydrophobicContact CD1-CD2 4.36Å; F632-L634 HydrophobicContact CE1-CD2 3.67Å
635	V	80	Confident	75.7	Confident	55 Å²	55	76 Å²	76	33%	0.333	40%	0.402	S	S	.	.			trans	-130.7	17.3	-159.8	-90.1	0	0	0	0	116.4	L608 W620 L624 L633	L608-V635 HydrophobicContact CB-CG1 3.82Å; L608-V635 HydrophobicContact CD1-CG1 3.8Å; L608-V635 HydrophobicContact CG-CG1 4.4Å; W620-V635 HydrophobicContact CZ2-CG1 4.49Å; L624-V635 HydrophobicContact CD1-CB 4.26Å; L624-V635 HydrophobicContact CD1-CG1 3.89Å; L624-V635 HydrophobicContact CD1-CG2 4.29Å; L624-V635 HydrophobicContact CD2-CG1 3.54Å; L624-V635 HydrophobicContact CG-CG1 4.36Å; L633-V635 HydrophobicContact CB-CG1 4.33Å; L633-V635 HydrophobicContact CB-CG2 4.45Å
636	E	78.7	Confident	73.3	Confident	133 Å²	133	74.9 Å²	74.9	62%	0.621	40%	0.403	S	S	*	.			trans	-104.7	166.1	-173.2	-62.6	-176.8	175.8	0	0	115.2	R609 K610	R609-E636 CarbonylContact C-O 3.53Å; R609-E636 WeakPolarHBondContact CA-O 3.14Å; R609-E636 WeakPolarHBondContact CB-O 3.09Å; R609-E636 VanDerWaalsContact CG-O 3.25Å; R609-E636 WeakPolarHBondContact CG-O 3.32Å; K610-E636 PolarHBondContact N-O 3.46Å
637	G	65.3	Low	70.6	Confident	64 Å²	64	77.8 Å²	77.8	66%	0.66	42%	0.42	S	S	*	.			trans	101.7	10.8	161.6	0	0	0	0	0	117.7
638	W	72.8	Confident	68	Low	57 Å²	57	83.9 Å²	83.9	22%	0.216	45%	0.451	C	S	.	.			trans	-110.7	136.7	166.8	-173.5	-86.9	0	0	0	111.2	F582 N611 P612 D614 S640 T643	F582-W638 HydrophobicContact CD1-CH2 4.24Å; F582-W638 AromaticContact CE1-CH2 3.64Å; F582-W638 HydrophobicContact CE1-CH2 3.64Å; F582-W638 HydrophobicContact CE1-CZ2 4.46Å; F582-W638 HydrophobicContact CE1-CZ3 4.31Å; F582-W638 HydrophobicContact CZ-CH2 4.31Å; N611-W638 WeakPolarHBondContact O-CB 3.39Å; P612-W638 VanDerWaalsContact CA-CD1 3.47Å; P612-W638 HydrophobicContact CB-CD2 4.44Å; P612-W638 HydrophobicContact CB-CZ2 4.26Å; D614-W638 PolarHBondContact OD1-NE1 3.36Å; W638-S640 PolarHBondContact NE1-OG 2.97Å; W638-T643 HydrophobicContact CH2-CG2 3.81Å; W638-T643 HydrophobicContact CZ2-CG2 3.83Å
639	K	72.6	Confident	65.6	Low	129 Å²	129	82.8 Å²	82.8	56%	0.561	46%	0.456	S	S	*	.			trans	-138.2	114.4	167.5	-67.1	-179.4	-178.4	176.2	0	108.1	T641 D642	K639-T641 PolarHBondContact O-N 3.44Å; K639-D642 HydrophobicContact CB-CB 4.31Å; K639-D642 WeakPolarHBondContact CB-OD2 3.33Å; K639-D642 WeakPolarHBondContact O-CB 3.13Å; K639-D642 PolarHBondContact O-N 2.74Å
640	S	69.3	Low	63.1	Low	23 Å²	23	84.9 Å²	84.9	16%	0.161	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.6	179.8	-68.2	0	0	0	0	112	D614 W638 D642 T643	D614-S640 VanDerWaalsContact CG-OG 3.27Å; D614-S640 PolarHBondContact OD1-OG 3.19Å; D614-S640 WeakPolarHBondContact OD2-CA 3.49Å; D614-S640 WeakPolarHBondContact OD2-CB 3.27Å; D614-S640 PolarHBondContact OD2-N 3.04Å; D614-S640 PolarHBondContact OD2-OG 3.49Å; W638-S640 PolarHBondContact NE1-OG 2.97Å; S640-D642 VanDerWaalsContact C-N 3.3Å; S640-D642 PolarHBondContact O-N 3.28Å; S640-T643 PolarHBondContact O-N 3.14Å; S640-T643 PolarHBondContact O-OG1 3.15Å
641	T	65.9	Low	60.6	Low	96 Å²	96	95.4 Å²	95.4	59%	0.589	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-34.1	172.6	52	0	0	0	0	112.9	K639 M644	K639-T641 PolarHBondContact O-N 3.44Å; T641-M644 PolarHBondContact O-N 3.34Å
642	D	63.1	Low	59.3	Low	93 Å²	93	100.2 Å²	100.2	50%	0.497	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-73.4	-32.3	-176.2	-61.4	-2.2	0	0	0	110.6	K639 S640 M644 V645	K639-D642 HydrophobicContact CB-CB 4.31Å; K639-D642 WeakPolarHBondContact CB-OD2 3.33Å; K639-D642 WeakPolarHBondContact O-CB 3.13Å; K639-D642 PolarHBondContact O-N 2.74Å; S640-D642 VanDerWaalsContact C-N 3.3Å; S640-D642 PolarHBondContact O-N 3.28Å; D642-M644 VanDerWaalsContact C-N 3.28Å; D642-M644 PolarHBondContact O-N 3.28Å; D642-V645 PolarHBondContact O-N 2.85Å
643	T	54.7	Low	57.9	Low	58 Å²	58	99.5 Å²	99.5	36%	0.356	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-73.9	-11.8	176.4	54.2	0	0	0	0	114.8	W638 S640	W638-T643 HydrophobicContact CH2-CG2 3.81Å; W638-T643 HydrophobicContact CZ2-CG2 3.83Å; S640-T643 PolarHBondContact O-N 3.14Å; S640-T643 PolarHBondContact O-OG1 3.15Å
644	M	47.8	Very low	56.3	Low	126 Å²	126	103.4 Å²	103.4	62%	0.621	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-91.1	-14.8	175.8	-67.9	-114.5	-73	0	0	112.8	T641 D642 H647 I648	T641-M644 PolarHBondContact O-N 3.34Å; D642-M644 VanDerWaalsContact C-N 3.28Å; D642-M644 PolarHBondContact O-N 3.28Å; M644-H647 PolarHBondContact O-N 3.28Å; M644-I648 WeakPolarHBondContact O-CG1 3.42Å
645	V	40.5	Very low	54.6	Low	85 Å²	85	106.2 Å²	106.2	52%	0.515	58%	0.575	S	S	.	*	H	α-helix	trans	-72.2	-32.7	179.9	-175.2	0	0	0	0	111.4	D642 H647 I648 S649	D642-V645 PolarHBondContact O-N 2.85Å; V645-H647 VanDerWaalsContact C-N 3.27Å; V645-H647 PolarHBondContact O-N 3.37Å; V645-I648 PolarHBondContact O-N 2.68Å; V645-S649 PolarHBondContact O-N 3.18Å; V645-S649 PolarHBondContact O-OG 3.42Å
646	D	39.5	Very low	53	Low	125 Å²	125	109.4 Å²	109.4	67%	0.668	59%	0.59	S	S	*	*	H	α-helix	trans	-70.1	-21.4	177.2	-70.8	-22.1	0	0	0	113.2
647	H	37.5	Very low	51.3	Low	150 Å²	150	107.9 Å²	107.9	69%	0.694	59%	0.588	S	S	*	*	H	α-helix	trans	-90.2	-15.4	178	-75.9	-58.6	0	0	0	114.2	M644 V645	M644-H647 PolarHBondContact O-N 3.28Å; V645-H647 VanDerWaalsContact C-N 3.27Å; V645-H647 PolarHBondContact O-N 3.37Å
648	I	37.6	Very low	50.3	Low	129 Å²	129	111 Å²	111	66%	0.662	58%	0.583	S	S	*	*	H	α-helix	trans	-96.3	-12.7	179.6	-60.5	170.9	0	0	0	111.4	M644 V645 N650	M644-I648 WeakPolarHBondContact O-CG1 3.42Å; V645-I648 PolarHBondContact O-N 2.68Å; I648-N650 VanDerWaalsContact C-N 3.34Å; I648-N650 PolarHBondContact O-N 3.08Å
649	S	35.7	Very low	48.6	Very low	87 Å²	87	115.2 Å²	115.2	61%	0.608	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	0.5	-179.8	-50.1	0	0	0	0	114.4	V645	V645-S649 PolarHBondContact O-N 3.18Å; V645-S649 PolarHBondContact O-OG 3.42Å
650	N	34.8	Very low	46.6	Very low	153 Å²	153	114 Å²	114	82%	0.818	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	22.5	179.3	-87.5	-19.7	0	0	0	113.1	I648	I648-N650 VanDerWaalsContact C-N 3.34Å; I648-N650 PolarHBondContact O-N 3.08Å
651	M	32.8	Very low	44.5	Very low	243 Å²	243	122.3 Å²	122.3	100%	1.197	66%	0.657	S	S	*	*			trans	-103.3	0	163.2	-82.7	-155.5	-168.2	0	0	111.3

Retrieved 651 of 651 residues in 1133.8 ms (Link to these results)

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