A0A087YRX3_POEFO Loading...

Kelch like family member 34

AlphaFold DB , UniProt , Accession A0A087YRX3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 597 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	L	46.6	Very low	68.8	Low	228 Å²	228	156.8 Å²	156.8	100%	1.194	83%	0.827	S	S	*	*				0	87.4	0	-75.3	156.6	0	0	0	107	M3	L1-M3 PolarHBondContact O-N 3.41Å
2	C	48.4	Very low	70.2	Confident	129 Å²	129	151.3 Å²	151.3	87%	0.872	81%	0.81	S	S	*	*			trans	-75.2	118.7	171.1	-123.2	0	0	0	0	106.5	D4	C2-D4 PolarHBondContact O-N 3.46Å
3	M	54.8	Low	71.7	Confident	182 Å²	182	145.3 Å²	145.3	90%	0.897	79%	0.788	S	S	*	*			trans	-79.5	109.3	170.6	-76.2	-165.6	173.9	0	0	107.7	L1 T5	L1-M3 PolarHBondContact O-N 3.41Å; M3-T5 PolarHBondContact O-N 3.21Å
4	D	57.3	Low	72.9	Confident	145 Å²	145	144.1 Å²	144.1	78%	0.775	77%	0.774	S	S	*	*			trans	-64.8	114.5	170.2	-74.7	-34.4	0	0	0	109.3	C2 Y6	C2-D4 PolarHBondContact O-N 3.46Å; D4-Y6 PolarHBondContact O-N 3.32Å
5	T	61.7	Low	73.7	Confident	145 Å²	145	145.9 Å²	145.9	89%	0.89	77%	0.765	S	S	*	*			trans	-74.8	108.1	170.7	38.7	0	0	0	0	109.5	M3	M3-T5 PolarHBondContact O-N 3.21Å
6	Y	72.4	Confident	74.4	Confident	223 Å²	223	142.6 Å²	142.6	88%	0.875	75%	0.753	S	S	*	*			trans	-96.3	138	171.4	58.4	-89	0	0	0	110.9	D4	D4-Y6 PolarHBondContact O-N 3.32Å
7	S	72.8	Confident	75.3	Confident	106 Å²	106	136.6 Å²	136.6	74%	0.741	73%	0.733	S	S	*	*			trans	-122.5	128.6	172.8	53.8	0	0	0	0	110.2
8	L	79.5	Confident	76.1	Confident	174 Å²	174	134.4 Å²	134.4	91%	0.911	72%	0.721	S	S	*	*			trans	-103.3	114.2	177.1	-176.2	70.6	0	0	0	108.7
9	L	87.4	Confident	76.8	Confident	156 Å²	156	130.4 Å²	130.4	82%	0.817	70%	0.699	S	S	*	*			trans	-111.4	130	-178.4	-61.8	173.6	0	0	0	110.5
10	Y	86.9	Confident	77.5	Confident	174 Å²	174	127.5 Å²	127.5	68%	0.682	69%	0.689	S	S	*	*			trans	-97.9	129.6	179.8	175.7	-102.7	0	0	0	111.4
11	S	88.8	Confident	78.2	Confident	63 Å²	63	122.4 Å²	122.4	44%	0.441	67%	0.667	S	S	.	*			trans	-104.4	113.9	172.5	178.1	0	0	0	0	110.7	S13	S11-S13 VanDerWaalsContact C-N 3.32Å; S11-S13 PolarHBondContact O-N 3.21Å; S11-S13 PolarHBondContact OG-OG 3.24Å; S11-S13 VanDerWaalsContact OG-OG 3.12Å
12	S	86.1	Confident	80.4	Confident	90 Å²	90	113.6 Å²	113.6	63%	0.629	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-27.6	176.2	54.7	0	0	0	0	113.1	H14	S12-H14 VanDerWaalsContact C-N 3.35Å
13	S	88.9	Confident	82.5	Confident	74 Å²	74	109.4 Å²	109.4	52%	0.517	59%	0.587	S	S	.	*	H	α-helix	trans	-77.7	-17.4	-178.7	60.5	0	0	0	0	113.9	S11 R15 T16 G17	S11-S13 VanDerWaalsContact C-N 3.32Å; S11-S13 PolarHBondContact O-N 3.21Å; S11-S13 PolarHBondContact OG-OG 3.24Å; S11-S13 VanDerWaalsContact OG-OG 3.12Å; S13-R15 VanDerWaalsContact C-N 3.35Å; S13-R15 PolarHBondContact O-N 3.4Å; S13-T16 PolarHBondContact O-N 3.27Å; S13-T16 PolarHBondContact O-OG1 3.5Å; S13-G17 PolarHBondContact O-N 3.33Å
14	H	89.1	Confident	84.3	Confident	129 Å²	129	108.6 Å²	108.6	60%	0.597	57%	0.573	S	S	*	*	H	α-helix	trans	-60.9	-43.1	-179.6	179.7	-94.6	0	0	0	112.1	S12 G17 L18	S12-H14 VanDerWaalsContact C-N 3.35Å; H14-G17 PolarHBondContact O-N 3.34Å; H14-L18 PolarHBondContact O-N 2.99Å
15	R	84.9	Confident	86.1	Confident	170 Å²	170	103.5 Å²	103.5	64%	0.642	55%	0.546	S	S	*	.	H	α-helix	trans	-66.3	-42.7	-177.3	-62.9	176.7	78	169.2	2.9	112	S13 L18 L19	S13-R15 VanDerWaalsContact C-N 3.35Å; S13-R15 PolarHBondContact O-N 3.4Å; R15-L18 PolarHBondContact O-N 3.29Å; R15-L19 PolarHBondContact O-N 3.4Å
16	T	85.3	Confident	87.6	Confident	94 Å²	94	97.9 Å²	97.9	58%	0.577	51%	0.509	S	S	*	.	H	α-helix	trans	-71.5	-36.9	177.7	50.2	0	0	0	0	111.9	S13 L18 S20	S13-T16 PolarHBondContact O-N 3.27Å; S13-T16 PolarHBondContact O-OG1 3.5Å; T16-L18 VanDerWaalsContact C-N 3.32Å; T16-L18 PolarHBondContact O-N 3.02Å; T16-S20 WeakPolarHBondContact O-CB 3.32Å; T16-S20 PolarHBondContact O-N 3.42Å; T16-S20 PolarHBondContact O-OG 2.6Å
17	G	88.5	Confident	88.6	Confident	40 Å²	40	92.4 Å²	92.4	41%	0.412	50%	0.495	S	S	.	.	H	α-helix	trans	-60.9	-38.9	172.2	0	0	0	0	0	113	S13 H14 S20 G21	S13-G17 PolarHBondContact O-N 3.33Å; H14-G17 PolarHBondContact O-N 3.34Å; G17-S20 WeakPolarHBondContact CA-OG 3.42Å; G17-S20 PolarHBondContact O-OG 3.43Å; G17-G21 PolarHBondContact O-N 3.18Å
18	L	90.2	Very high	89.6	Confident	97 Å²	97	92.3 Å²	92.3	51%	0.508	48%	0.482	S	S	.	.	H	α-helix	trans	-66.4	-49.6	177.9	-175.7	65.1	0	0	0	112.2	H14 R15 T16 G21 F22	H14-L18 PolarHBondContact O-N 2.99Å; R15-L18 PolarHBondContact O-N 3.29Å; T16-L18 VanDerWaalsContact C-N 3.32Å; T16-L18 PolarHBondContact O-N 3.02Å; L18-G21 WeakPolarHBondContact O-CA 3.47Å; L18-G21 PolarHBondContact O-N 2.85Å; L18-G21 VanDerWaalsContact O-N 3.16Å; L18-F22 HydrophobicContact CD1-CD2 4.23Å; L18-F22 HydrophobicContact CD1-CE2 3.86Å; L18-F22 HydrophobicContact CG-CD2 4.14Å; L18-F22 HydrophobicContact CG-CE2 4.03Å; L18-F22 WeakPolarHBondContact O-CD2 3.44Å; L18-F22 PolarHBondContact O-N 3.37Å
19	L	89.8	Confident	90.3	Very high	58 Å²	58	91.3 Å²	91.3	30%	0.304	47%	0.471	S	S	.	.	H	α-helix	trans	-60.9	-46.6	178.5	-85.5	154	0	0	0	111.9	R15 G21 F22 Q23 L90 Y91	R15-L19 PolarHBondContact O-N 3.4Å; L19-G21 PolarHBondContact O-N 2.85Å; L19-F22 PolarHBondContact O-N 2.67Å; L19-F22 VanDerWaalsContact O-N 3.09Å; L19-Q23 PolarHBondContact O-N 3.49Å; L19-L90 WeakPolarHBondContact CD2-O 3.25Å; L19-Y91 WeakPolarHBondContact CD2-O 3.38Å
20	S	90.1	Very high	90.4	Very high	73 Å²	73	89.3 Å²	89.3	51%	0.51	46%	0.455	S	S	.	.	H	α-helix	trans	-61.3	-32.8	175.3	57.4	0	0	0	0	113	T16 G17 R24	T16-S20 WeakPolarHBondContact O-CB 3.32Å; T16-S20 PolarHBondContact O-N 3.42Å; T16-S20 PolarHBondContact O-OG 2.6Å; G17-S20 WeakPolarHBondContact CA-OG 3.42Å; G17-S20 PolarHBondContact O-OG 3.43Å; S20-R24 PolarHBondContact O-N 3.18Å; S20-R24 VanDerWaalsContact O-N 3.11Å
21	G	92.5	Very high	90.6	Very high	21 Å²	21	87.9 Å²	87.9	22%	0.216	46%	0.457	C	S	.	.	H	α-helix	trans	-61.6	-48.4	170.4	0	0	0	0	0	112.8	G17 L18 L19 R24 L25	G17-G21 PolarHBondContact O-N 3.18Å; L18-G21 WeakPolarHBondContact O-CA 3.47Å; L18-G21 PolarHBondContact O-N 2.85Å; L18-G21 VanDerWaalsContact O-N 3.16Å; L19-G21 PolarHBondContact O-N 2.85Å; G21-R24 PolarHBondContact O-N 2.99Å; G21-L25 WeakPolarHBondContact O-CG 3.26Å; G21-L25 PolarHBondContact O-N 3.43Å; G21-L25 VanDerWaalsContact O-N 3.1Å
22	F	92.8	Very high	90.8	Very high	43 Å²	43	86.7 Å²	86.7	19%	0.189	45%	0.448	C	S	.	.	H	α-helix	trans	-64.1	-40	176.8	-86.2	-71.2	0	0	0	113	L18 L19 L25 R26 H46 L49 Y91	L18-F22 HydrophobicContact CD1-CD2 4.23Å; L18-F22 HydrophobicContact CD1-CE2 3.86Å; L18-F22 HydrophobicContact CG-CD2 4.14Å; L18-F22 HydrophobicContact CG-CE2 4.03Å; L18-F22 WeakPolarHBondContact O-CD2 3.44Å; L18-F22 PolarHBondContact O-N 3.37Å; L19-F22 PolarHBondContact O-N 2.67Å; L19-F22 VanDerWaalsContact O-N 3.09Å; F22-L25 PolarHBondContact O-N 3.32Å; F22-R26 PolarHBondContact O-N 2.86Å; F22-H46 HydrophobicContact CD1-CB 4.49Å; F22-H46 AromaticContact CD1-ND1 3.71Å; F22-H46 HydrophobicContact CE1-CB 4.35Å; F22-L49 HydrophobicContact CB-CD2 4.04Å; F22-L49 HydrophobicContact CD1-CB 4.45Å; F22-L49 HydrophobicContact CD1-CD2 4.4Å; F22-L49 HydrophobicContact CD2-CD1 4.21Å; F22-L49 HydrophobicContact CE1-CB 4.45Å; F22-L49 HydrophobicContact CE2-CD1 4.48Å; F22-L49 HydrophobicContact CG-CD1 4.43Å; F22-L49 HydrophobicContact CG-CD2 4.17Å; F22-Y91 HydrophobicContact CB-CD1 4Å; F22-Y91 HydrophobicContact CB-CE1 4.18Å; F22-Y91 WeakPolarHBondContact O-CD1 3.31Å
23	Q	92.7	Very high	91.2	Very high	40 Å²	40	86.1 Å²	86.1	19%	0.187	44%	0.438	C	S	.	.	H	α-helix	trans	-57.6	-50.5	174.5	-176.7	68.7	48.3	0	0	110.6	L19 L25 R26 D27	L19-Q23 PolarHBondContact O-N 3.49Å; Q23-L25 VanDerWaalsContact C-N 3.26Å; Q23-L25 PolarHBondContact O-N 3.13Å; Q23-R26 WeakPolarHBondContact O-CB 3.48Å; Q23-R26 PolarHBondContact O-N 2.67Å; Q23-R26 VanDerWaalsContact O-N 3.08Å; Q23-D27 PolarHBondContact NE2-OD1 2.96Å; Q23-D27 VanDerWaalsContact O-CG 3.26Å; Q23-D27 PolarHBondContact O-N 3.34Å
24	R	93.3	Very high	91.4	Very high	165 Å²	165	82.7 Å²	82.7	62%	0.623	41%	0.414	S	S	*	.	H	α-helix	trans	-59.9	-35.6	178.3	-175.2	175.5	65.1	178.7	-0.7	112.9	S20 G21 Q28	S20-R24 PolarHBondContact O-N 3.18Å; S20-R24 VanDerWaalsContact O-N 3.11Å; G21-R24 PolarHBondContact O-N 2.99Å; R24-Q28 WeakPolarHBondContact O-CG 3.23Å; R24-Q28 PolarHBondContact O-N 3.31Å
25	L	94.6	Very high	91.7	Very high	39 Å²	39	78.7 Å²	78.7	20%	0.204	40%	0.398	C	S	.	.	H	α-helix	trans	-66.5	-42.8	175.6	-72.9	172.2	0	0	0	111.7	G21 F22 Q23 Q28 K29 K30 M31	G21-L25 WeakPolarHBondContact O-CG 3.26Å; G21-L25 PolarHBondContact O-N 3.43Å; G21-L25 VanDerWaalsContact O-N 3.1Å; F22-L25 PolarHBondContact O-N 3.32Å; Q23-L25 VanDerWaalsContact C-N 3.26Å; Q23-L25 PolarHBondContact O-N 3.13Å; L25-Q28 CarbonylContact O-C 3.56Å; L25-Q28 PolarHBondContact O-N 2.92Å; L25-K29 PolarHBondContact O-N 2.87Å; L25-K30 HydrophobicContact CD2-CB 3.96Å; L25-K30 PolarHBondContact O-N 3.11Å; L25-M31 HydrophobicContact CD1-CE 3.58Å; L25-M31 HydrophobicContact CD2-CE 3.85Å; L25-M31 HydrophobicContact CG-CE 4.38Å
26	R	93.6	Very high	92.3	Very high	27 Å²	27	70.6 Å²	70.6	10%	0.102	37%	0.368	C	S	.	.	H	α-helix	trans	-63	-46.1	176.3	-178	175.9	170.7	-142.1	-11.8	111.6	F22 Q23 Q28 K29 L87 D88 Y91	F22-R26 PolarHBondContact O-N 2.86Å; Q23-R26 WeakPolarHBondContact O-CB 3.48Å; Q23-R26 PolarHBondContact O-N 2.67Å; Q23-R26 VanDerWaalsContact O-N 3.08Å; R26-Q28 VanDerWaalsContact C-N 3.25Å; R26-Q28 PolarHBondContact O-N 3.35Å; R26-K29 PolarHBondContact O-N 3.42Å; R26-L87 PolarHBondContact NH1-O 3.49Å; R26-D88 IonicContact CZ-OD1 3.41Å; R26-D88 IonicContact NH1-OD1 3.37Å; R26-D88 PolarHBondContact NH1-OD1 3.25Å; R26-D88 IonicContact NH2-OD1 2.81Å; R26-D88 PolarHBondContact NH2-OD1 3.04Å; R26-D88 VanDerWaalsContact NH2-OD1 3.08Å; R26-Y91 HydrophobicContact CB-CD1 3.94Å; R26-Y91 HydrophobicContact CB-CE1 3.62Å; R26-Y91 HydrophobicContact CG-CE1 4.18Å
27	D	92.5	Very high	92.7	Very high	108 Å²	108	68.6 Å²	68.6	58%	0.578	35%	0.352	S	S	*	.	H	α-helix	trans	-60.3	-36.7	179.3	-60.6	-17.8	0	0	0	112	Q23 K29	Q23-D27 PolarHBondContact NE2-OD1 2.96Å; Q23-D27 VanDerWaalsContact O-CG 3.26Å; Q23-D27 PolarHBondContact O-N 3.34Å; D27-K29 VanDerWaalsContact C-N 3.33Å
28	Q	94.4	Very high	93	Very high	103 Å²	103	66.7 Å²	66.7	48%	0.481	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-0.9	176.3	-64.7	-176.1	12	0	0	113.7	R24 L25 R26 K30	R24-Q28 WeakPolarHBondContact O-CG 3.23Å; R24-Q28 PolarHBondContact O-N 3.31Å; L25-Q28 CarbonylContact O-C 3.56Å; L25-Q28 PolarHBondContact O-N 2.92Å; R26-Q28 VanDerWaalsContact C-N 3.25Å; R26-Q28 PolarHBondContact O-N 3.35Å; Q28-K30 HydrophobicContact CB-CB 4.49Å; Q28-K30 HydrophobicContact CB-CD 4.14Å; Q28-K30 HydrophobicContact CB-CG 4Å; Q28-K30 PolarHBondContact O-N 3.26Å
29	K	93.1	Very high	92.9	Very high	154 Å²	154	65.2 Å²	65.2	67%	0.67	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	37	-173.7	-56.1	-179.3	-179.9	-177.8	0	112.9	L25 R26 D27 P44	L25-K29 PolarHBondContact O-N 2.87Å; R26-K29 PolarHBondContact O-N 3.42Å; D27-K29 VanDerWaalsContact C-N 3.33Å; K29-P44 HydrophobicContact CD-CG 4.25Å; K29-P44 HydrophobicContact CG-CG 4.31Å
30	K	91.3	Very high	92.9	Very high	113 Å²	113	66.1 Å²	66.1	49%	0.491	36%	0.364	S	S	.	.			trans	-99.5	135.3	-178.6	-75.9	-175.9	179.6	164.9	0	110.8	L25 Q28 C32 H46	L25-K30 HydrophobicContact CD2-CB 3.96Å; L25-K30 PolarHBondContact O-N 3.11Å; Q28-K30 HydrophobicContact CB-CB 4.49Å; Q28-K30 HydrophobicContact CB-CD 4.14Å; Q28-K30 HydrophobicContact CB-CG 4Å; Q28-K30 PolarHBondContact O-N 3.26Å; K30-C32 PolarHBondContact O-N 2.86Å; K30-H46 PolarHBondContact O-NE2 2.98Å
31	M	91.2	Very high	93.1	Very high	145 Å²	145	65.7 Å²	65.7	71%	0.714	36%	0.358	S	S	*	.	S	Bend	trans	61	17.6	178.8	-52.6	-163.4	-63.6	0	0	114.9	L25 D33 H46	L25-M31 HydrophobicContact CD1-CE 3.58Å; L25-M31 HydrophobicContact CD2-CE 3.85Å; L25-M31 HydrophobicContact CG-CE 4.38Å; M31-D33 PolarHBondContact O-N 2.74Å; M31-H46 PolarHBondContact O-CD2 2.96Å
32	C	92.5	Very high	93.2	Very high	38 Å²	38	68 Å²	68	26%	0.257	37%	0.371	S	S	.	.			trans	-69.9	125.8	172.4	-55.7	0	0	0	0	109.9	K30 P44 C45	K30-C32 PolarHBondContact O-N 2.86Å; C32-P44 HydrophobicContact CB-CB 3.9Å; C32-C45 CarbonylContact C-O 3.54Å; C32-C45 VanDerWaalsContact CA-O 3.24Å; C32-C45 WeakPolarHBondContact CA-O 3.29Å; C32-C45 WeakPolarHBondContact CB-O 3.28Å
33	D	93.6	Very high	93.4	Very high	77 Å²	77	66.6 Å²	66.6	41%	0.412	37%	0.365	S	S	.	.			trans	-113	5.8	-172.9	59.4	-4.9	0	0	0	112.6	M31 C45 H46 R47	M31-D33 PolarHBondContact O-N 2.74Å; D33-C45 PolarHBondContact N-O 2.91Å; D33-C45 VanDerWaalsContact N-O 3.14Å; D33-H46 VanDerWaalsContact OD1-CA 3.25Å; D33-H46 WeakPolarHBondContact OD1-CA 3.42Å; D33-R47 PolarHBondContact O-NE 3.36Å; D33-R47 WeakPolarHBondContact OD1-CG 3.33Å; D33-R47 PolarHBondContact OD1-N 3.39Å
34	V	94.4	Very high	93.6	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.018	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	147.8	172.4	66.6	0	0	0	0	110.6	L36 C45 R47 L50 F61 I73	V34-L36 HydrophobicContact CG2-CD2 4.37Å; V34-C45 HydrophobicContact CG1-CB 4.01Å; V34-C45 PolarHBondContact N-O 3.48Å; V34-C45 PolarHBondContact O-N 2.73Å; V34-R47 HydrophobicContact CB-CG 3.81Å; V34-R47 HydrophobicContact CG1-CG 3.66Å; V34-L50 HydrophobicContact CG1-CD1 4.36Å; V34-F61 HydrophobicContact CG1-CZ 4.46Å; V34-I73 HydrophobicContact CG2-CD1 3.69Å; V34-I73 HydrophobicContact CG2-CG1 4.05Å
35	V	95.4	Very high	93.7	Very high	44 Å²	44	58.4 Å²	58.4	27%	0.267	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.7	169.1	-178.3	0	0	0	0	109.2	D71 S72 I73	V35-D71 PolarHBondContact N-O 3.28Å; V35-S72 CarbonylContact O-C 3.45Å; V35-S72 VanDerWaalsContact O-CA 3.29Å; V35-S72 WeakPolarHBondContact O-CA 3.46Å; V35-I73 PolarHBondContact O-N 3.39Å
36	L	95.8	Very high	93.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	133.8	171.7	-56.6	-178.9	0	0	0	109.6	V34 S42 F43 L50 F57 I73 L75 L83 L87	V34-L36 HydrophobicContact CG2-CD2 4.37Å; L36-S42 CarbonylContact O-C 3.58Å; L36-S42 WeakPolarHBondContact O-CA 3.32Å; L36-F43 HydrophobicContact CB-CB 4.37Å; L36-F43 PolarHBondContact N-O 3.24Å; L36-F43 PolarHBondContact O-N 3.22Å; L36-L50 HydrophobicContact CD1-CD1 4Å; L36-F57 HydrophobicContact CD1-CE1 3.97Å; L36-F57 HydrophobicContact CD1-CZ 3.63Å; L36-F57 HydrophobicContact CD2-CE1 4.12Å; L36-I73 CarbonylContact C-O 3.58Å; L36-I73 WeakPolarHBondContact CA-O 3.22Å; L36-I73 HydrophobicContact CD2-CB 4.03Å; L36-I73 HydrophobicContact CD2-CD1 4.49Å; L36-I73 HydrophobicContact CD2-CG2 4.44Å; L36-L75 HydrophobicContact CB-CD1 4.44Å; L36-L75 HydrophobicContact CD1-CD1 4.29Å; L36-L75 HydrophobicContact CD2-CD1 4.39Å; L36-L83 HydrophobicContact CB-CD2 4.16Å; L36-L83 HydrophobicContact CD1-CD1 4.32Å; L36-L87 HydrophobicContact CD1-CD1 4.5Å; L36-L87 HydrophobicContact CD1-CD2 4.13Å
37	E	95	Very high	93.6	Very high	52 Å²	52	57 Å²	57	24%	0.243	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	121.4	178.8	-76	175.7	-163.6	0	0	110.5	V41 S72 I73 R74 L75	E37-V41 WeakPolarHBondContact CA-O 3.47Å; E37-S72 WeakPolarHBondContact CG-OG 3.39Å; E37-S72 PolarHBondContact OE1-OG 3.47Å; E37-I73 PolarHBondContact N-O 3.21Å; E37-R74 HydrophobicContact CB-CG 3.99Å; E37-R74 WeakPolarHBondContact O-CA 3.39Å; E37-R74 WeakPolarHBondContact OE2-CG 3.49Å; E37-R74 IonicContact OE2-CZ 3.86Å; E37-R74 IonicContact OE2-NE 2.98Å; E37-R74 PolarHBondContact OE2-NE 3.2Å; E37-R74 IonicContact OE2-NH2 3.88Å; E37-L75 PolarHBondContact O-N 3.4Å
38	A	94.8	Very high	93.6	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.008	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	132.6	173.4	0	0	0	0	0	109.6	G40 V41 F43 L78 L83	A38-G40 PolarHBondContact O-N 2.94Å; A38-V41 PolarHBondContact N-O 3.14Å; A38-V41 PolarHBondContact O-N 2.85Å; A38-F43 HydrophobicContact CB-CE2 4.47Å; A38-L78 HydrophobicContact CB-CB 4.46Å; A38-L83 HydrophobicContact CB-CB 4.38Å; A38-L83 HydrophobicContact CB-CD2 3.61Å
39	G	88.1	Confident	93.6	Very high	65 Å²	65	51 Å²	51	67%	0.67	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	24.7	179.3	0	0	0	0	0	115.7	V41	G39-V41 VanDerWaalsContact C-N 3.33Å
40	G	88.6	Confident	93.6	Very high	78 Å²	78	43.7 Å²	43.7	80%	0.804	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	3	-175.5	0	0	0	0	0	115.2	A38	A38-G40 PolarHBondContact O-N 2.94Å
41	V	95.4	Very high	93.7	Very high	64 Å²	64	39.1 Å²	39.1	39%	0.388	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	137.6	173.9	-175.1	0	0	0	0	109.7	E37 A38 G39 F43 P80	E37-V41 WeakPolarHBondContact CA-O 3.47Å; A38-V41 PolarHBondContact N-O 3.14Å; A38-V41 PolarHBondContact O-N 2.85Å; G39-V41 VanDerWaalsContact C-N 3.33Å; V41-F43 HydrophobicContact CB-CE2 3.83Å; V41-F43 HydrophobicContact CB-CZ 4.02Å; V41-F43 HydrophobicContact CG1-CD2 4.4Å; V41-F43 HydrophobicContact CG1-CE1 4.1Å; V41-F43 HydrophobicContact CG1-CE2 3.67Å; V41-F43 HydrophobicContact CG1-CZ 3.5Å; V41-P80 HydrophobicContact CB-CB 4.15Å; V41-P80 HydrophobicContact CB-CG 4.38Å; V41-P80 HydrophobicContact CG2-CB 3.88Å; V41-P80 HydrophobicContact CG2-CG 3.88Å
42	S	95.1	Very high	93.8	Very high	70 Å²	70	36.2 Å²	36.2	49%	0.49	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.7	-177.7	-56	0	0	0	0	112	L36	L36-S42 CarbonylContact O-C 3.58Å; L36-S42 WeakPolarHBondContact O-CA 3.32Å
43	F	96.3	Very high	93.8	Very high	13 Å²	13	36.6 Å²	36.6	6%	0.057	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	101.5	-176.1	-58.8	-88.5	0	0	0	111	L36 A38 V41 C45 P80 L83 E84 L87	L36-F43 HydrophobicContact CB-CB 4.37Å; L36-F43 PolarHBondContact N-O 3.24Å; L36-F43 PolarHBondContact O-N 3.22Å; A38-F43 HydrophobicContact CB-CE2 4.47Å; V41-F43 HydrophobicContact CB-CE2 3.83Å; V41-F43 HydrophobicContact CB-CZ 4.02Å; V41-F43 HydrophobicContact CG1-CD2 4.4Å; V41-F43 HydrophobicContact CG1-CE1 4.1Å; V41-F43 HydrophobicContact CG1-CE2 3.67Å; V41-F43 HydrophobicContact CG1-CZ 3.5Å; F43-C45 PolarHBondContact O-N 3.17Å; F43-C45 PolarHBondContact O-SG 3.24Å; F43-P80 HydrophobicContact CZ-CB 4.23Å; F43-L83 HydrophobicContact CD2-CD2 3.65Å; F43-L83 HydrophobicContact CD2-CG 4.33Å; F43-L83 HydrophobicContact CE2-CD2 3.89Å; F43-L83 HydrophobicContact CE2-CG 4.42Å; F43-L83 HydrophobicContact CG-CD2 4.39Å; F43-E84 HydrophobicContact CE1-CB 3.81Å; F43-E84 HydrophobicContact CE1-CG 4.17Å; F43-E84 HydrophobicContact CZ-CB 4.25Å; F43-L87 HydrophobicContact CB-CD1 3.69Å; F43-L87 HydrophobicContact CD1-CD1 4.07Å; F43-L87 HydrophobicContact CG-CD1 3.94Å
44	P	95.6	Very high	93.9	Very high	33 Å²	33	33.1 Å²	33.1	21%	0.214	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	127.3	174.4	-19	32.4	0	0	0	111.5	K29 C32	K29-P44 HydrophobicContact CD-CG 4.25Å; K29-P44 HydrophobicContact CG-CG 4.31Å; C32-P44 HydrophobicContact CB-CB 3.9Å
45	C	95.7	Very high	93.8	Very high	0 Å²	0	38 Å²	38	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	174.3	-173.3	-60.6	0	0	0	0	112.8	C32 D33 V34 F43 L50 Y91	C32-C45 CarbonylContact C-O 3.54Å; C32-C45 VanDerWaalsContact CA-O 3.24Å; C32-C45 WeakPolarHBondContact CA-O 3.29Å; C32-C45 WeakPolarHBondContact CB-O 3.28Å; D33-C45 PolarHBondContact N-O 2.91Å; D33-C45 VanDerWaalsContact N-O 3.14Å; V34-C45 HydrophobicContact CG1-CB 4.01Å; V34-C45 PolarHBondContact N-O 3.48Å; V34-C45 PolarHBondContact O-N 2.73Å; F43-C45 PolarHBondContact O-N 3.17Å; F43-C45 PolarHBondContact O-SG 3.24Å; C45-L50 HydrophobicContact CB-CD1 3.72Å; C45-L50 HydrophobicContact CB-CG 4.31Å; C45-Y91 WeakPolarHBondContact CA-OH 3.27Å
46	H	94.9	Very high	93.8	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.028	26%	0.258	C	S	.	.			trans	-112.9	116.8	175.9	-53.5	108	0	0	0	109.8	F22 K30 M31 D33 S48 L49 L50 Y91	F22-H46 HydrophobicContact CD1-CB 4.49Å; F22-H46 AromaticContact CD1-ND1 3.71Å; F22-H46 HydrophobicContact CE1-CB 4.35Å; K30-H46 PolarHBondContact O-NE2 2.98Å; M31-H46 PolarHBondContact O-CD2 2.96Å; D33-H46 VanDerWaalsContact OD1-CA 3.25Å; D33-H46 WeakPolarHBondContact OD1-CA 3.42Å; H46-S48 VanDerWaalsContact C-N 3.26Å; H46-S48 PolarHBondContact O-N 3.26Å; H46-L49 HydrophobicContact CB-CB 4.29Å; H46-L49 PolarHBondContact O-N 3.17Å; H46-L50 WeakPolarHBondContact O-CG 3.34Å; H46-L50 PolarHBondContact O-N 2.58Å; H46-L50 VanDerWaalsContact O-N 3.11Å; H46-Y91 AromaticContact CE1-CE1 3.94Å; H46-Y91 PolarHBondContact N-OH 3.46Å; H46-Y91 AromaticContact ND1-CE1 3.34Å; H46-Y91 VanDerWaalsContact ND1-CE1 3.34Å; H46-Y91 WeakPolarHBondContact ND1-CE1 3.49Å; H46-Y91 AromaticContact ND1-CZ 3.55Å; H46-Y91 PolarHBondContact ND1-OH 2.81Å
47	R	92.8	Very high	93.7	Very high	31 Å²	31	38.2 Å²	38.2	12%	0.117	26%	0.258	C	S	.	.	H	α-helix	trans	-55.1	-41.7	-178.6	-70.7	170.9	172.1	-88.3	0.3	112.2	D33 V34 L50 A51 F61 E67 R68 A70	D33-R47 PolarHBondContact O-NE 3.36Å; D33-R47 WeakPolarHBondContact OD1-CG 3.33Å; D33-R47 PolarHBondContact OD1-N 3.39Å; V34-R47 HydrophobicContact CB-CG 3.81Å; V34-R47 HydrophobicContact CG1-CG 3.66Å; R47-L50 PolarHBondContact O-N 2.81Å; R47-A51 VanDerWaalsContact O-CB 3.28Å; R47-A51 WeakPolarHBondContact O-CB 3.25Å; R47-A51 PolarHBondContact O-N 3.07Å; R47-F61 HydrophobicContact CB-CD2 3.84Å; R47-F61 HydrophobicContact CB-CE2 3.84Å; R47-F61 HydrophobicContact CB-CG 4.48Å; R47-F61 HydrophobicContact CB-CZ 4.45Å; R47-F61 HydrophobicContact CG-CD2 4.1Å; R47-F61 HydrophobicContact CG-CE1 4.31Å; R47-F61 HydrophobicContact CG-CE2 3.88Å; R47-F61 HydrophobicContact CG-CG 4.44Å; R47-F61 HydrophobicContact CG-CZ 3.98Å; R47-F61 VanDerWaalsContact NH1-CE1 3.28Å; R47-E67 PolarHBondContact NH1-O 3.16Å; R47-E67 PolarHBondContact NH2-O 3.06Å; R47-R68 PolarHBondContact NH1-O 3.38Å; R47-R68 PolarHBondContact NH2-O 3.22Å; R47-A70 PolarHBondContact NH2-O 3.41Å
48	S	92	Very high	93.6	Very high	73 Å²	73	44 Å²	44	51%	0.51	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-45.4	-179.3	56.1	0	0	0	0	112.8	H46 S52	H46-S48 VanDerWaalsContact C-N 3.26Å; H46-S48 PolarHBondContact O-N 3.26Å; S48-S52 WeakPolarHBondContact O-CB 3.34Å; S48-S52 PolarHBondContact O-N 3.12Å; S48-S52 PolarHBondContact O-OG 3.46Å
49	L	93.4	Very high	93.4	Very high	12 Å²	12	47 Å²	47	6%	0.063	30%	0.302	C	S	.	.	H	α-helix	trans	-68	-45.5	178.4	-174.2	70.3	0	0	0	111.1	F22 H46 S52 S53 Y91	F22-L49 HydrophobicContact CB-CD2 4.04Å; F22-L49 HydrophobicContact CD1-CB 4.45Å; F22-L49 HydrophobicContact CD1-CD2 4.4Å; F22-L49 HydrophobicContact CD2-CD1 4.21Å; F22-L49 HydrophobicContact CE1-CB 4.45Å; F22-L49 HydrophobicContact CE2-CD1 4.48Å; F22-L49 HydrophobicContact CG-CD1 4.43Å; F22-L49 HydrophobicContact CG-CD2 4.17Å; H46-L49 HydrophobicContact CB-CB 4.29Å; H46-L49 PolarHBondContact O-N 3.17Å; L49-S52 WeakPolarHBondContact CA-OG 3.24Å; L49-S52 PolarHBondContact O-N 3.29Å; L49-S52 PolarHBondContact O-OG 2.77Å; L49-S53 PolarHBondContact O-N 2.96Å; L49-S53 PolarHBondContact O-OG 3.29Å; L49-Y91 HydrophobicContact CD2-CD1 3.52Å; L49-Y91 HydrophobicContact CD2-CD2 3.62Å; L49-Y91 HydrophobicContact CD2-CE1 3.5Å; L49-Y91 HydrophobicContact CD2-CE2 3.62Å; L49-Y91 HydrophobicContact CD2-CG 3.6Å
50	L	94.6	Very high	93.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59	-51.2	178.4	-68.9	-176.3	0	0	0	111.4	V34 L36 C45 H46 R47 S52 S53 S54 F57 F61 L87 L90	V34-L50 HydrophobicContact CG1-CD1 4.36Å; L36-L50 HydrophobicContact CD1-CD1 4Å; C45-L50 HydrophobicContact CB-CD1 3.72Å; C45-L50 HydrophobicContact CB-CG 4.31Å; H46-L50 WeakPolarHBondContact O-CG 3.34Å; H46-L50 PolarHBondContact O-N 2.58Å; H46-L50 VanDerWaalsContact O-N 3.11Å; R47-L50 PolarHBondContact O-N 2.81Å; L50-S52 VanDerWaalsContact C-N 3.28Å; L50-S52 PolarHBondContact O-N 2.91Å; L50-S53 PolarHBondContact O-N 3.09Å; L50-S53 VanDerWaalsContact O-N 3.12Å; L50-S54 WeakPolarHBondContact O-CB 3.45Å; L50-S54 PolarHBondContact O-N 2.9Å; L50-S54 VanDerWaalsContact O-N 3.07Å; L50-F57 HydrophobicContact CB-CB 3.9Å; L50-F57 HydrophobicContact CB-CD1 4.47Å; L50-F57 HydrophobicContact CB-CD2 3.75Å; L50-F57 HydrophobicContact CB-CE2 4.4Å; L50-F57 HydrophobicContact CB-CG 3.8Å; L50-F57 HydrophobicContact CD1-CD1 4.31Å; L50-F57 HydrophobicContact CD1-CD2 4.35Å; L50-F57 HydrophobicContact CD1-CE1 4.25Å; L50-F57 HydrophobicContact CD1-CE2 4.29Å; L50-F57 HydrophobicContact CD1-CG 4.38Å; L50-F57 HydrophobicContact CD1-CZ 4.25Å; L50-F57 HydrophobicContact CD2-CD2 4.11Å; L50-F57 HydrophobicContact CD2-CE2 3.98Å; L50-F57 HydrophobicContact CG-CD2 4.29Å; L50-F57 HydrophobicContact CG-CE2 4.45Å; L50-F61 HydrophobicContact CB-CE2 4.02Å; L50-F61 HydrophobicContact CD1-CE2 4.27Å; L50-F61 HydrophobicContact CD1-CZ 4.3Å; L50-L87 HydrophobicContact CD2-CD2 3.62Å; L50-L90 HydrophobicContact CD2-CD1 3.58Å
51	A	93.4	Very high	93.6	Very high	16 Å²	16	42.5 Å²	42.5	13%	0.132	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-36.4	177.2	0	0	0	0	0	112.6	R47 S53 W58 F61	R47-A51 VanDerWaalsContact O-CB 3.28Å; R47-A51 WeakPolarHBondContact O-CB 3.25Å; R47-A51 PolarHBondContact O-N 3.07Å; A51-S53 PolarHBondContact O-N 3.22Å; A51-W58 HydrophobicContact CB-CE3 3.99Å; A51-F61 HydrophobicContact CB-CD2 4.17Å
52	S	92.3	Very high	93.1	Very high	84 Å²	84	40.6 Å²	40.6	59%	0.587	24%	0.237	S	C	*	.	H	α-helix	trans	-70.5	-16.6	178.6	71.5	0	0	0	0	114.3	S48 L49 L50	S48-S52 WeakPolarHBondContact O-CB 3.34Å; S48-S52 PolarHBondContact O-N 3.12Å; S48-S52 PolarHBondContact O-OG 3.46Å; L49-S52 WeakPolarHBondContact CA-OG 3.24Å; L49-S52 PolarHBondContact O-N 3.29Å; L49-S52 PolarHBondContact O-OG 2.77Å; L50-S52 VanDerWaalsContact C-N 3.28Å; L50-S52 PolarHBondContact O-N 2.91Å
53	S	92.3	Very high	92.1	Very high	47 Å²	47	45.2 Å²	45.2	33%	0.329	25%	0.251	S	S	.	.	H	α-helix	trans	-120	-1.9	-171.1	-47.7	0	0	0	0	114	L49 L50 A51	L49-S53 PolarHBondContact O-N 2.96Å; L49-S53 PolarHBondContact O-OG 3.29Å; L50-S53 PolarHBondContact O-N 3.09Å; L50-S53 VanDerWaalsContact O-N 3.12Å; A51-S53 PolarHBondContact O-N 3.22Å
54	S	95.4	Very high	91	Very high	4 Å²	4	51.2 Å²	51.2	3%	0.028	29%	0.289	C	S	.	.			trans	-152.1	124.4	-174.8	160.4	0	0	0	0	110.2	L50 Y56 F57 W58 L112	L50-S54 WeakPolarHBondContact O-CB 3.45Å; L50-S54 PolarHBondContact O-N 2.9Å; L50-S54 VanDerWaalsContact O-N 3.07Å; S54-Y56 PolarHBondContact O-N 3.26Å; S54-Y56 PolarHBondContact OG-N 2.96Å; S54-F57 PolarHBondContact O-N 3.08Å; S54-F57 WeakPolarHBondContact OG-CD2 3.49Å; S54-F57 PolarHBondContact OG-N 3.03Å; S54-F57 VanDerWaalsContact OG-N 3.17Å; S54-W58 WeakPolarHBondContact O-CB 3.28Å; S54-W58 PolarHBondContact O-N 3.29Å; S54-L112 WeakPolarHBondContact CB-O 3.41Å; S54-L112 PolarHBondContact OG-O 3.01Å
55	D	93.3	Very high	90.3	Very high	106 Å²	106	51.5 Å²	51.5	57%	0.567	29%	0.29	S	S	*	.	H	α-helix	trans	-65.8	-31.1	177	-68.8	-29.8	0	0	0	111.8	W58 A59 Q113	D55-W58 PolarHBondContact O-N 3.39Å; D55-A59 WeakPolarHBondContact O-CB 3.5Å; D55-A59 PolarHBondContact O-N 3.5Å; D55-Q113 HydrophobicContact CB-CB 4.26Å; D55-Q113 VanDerWaalsContact CB-OE1 3.32Å
56	Y	94.4	Very high	89.4	Confident	48 Å²	48	55.4 Å²	55.4	19%	0.188	32%	0.322	C	S	.	.	H	α-helix	trans	-60	-51.7	172.7	175.3	-97	0	0	0	111.2	S54 W58 A59 L60 L75 Y111 L112	S54-Y56 PolarHBondContact O-N 3.26Å; S54-Y56 PolarHBondContact OG-N 2.96Å; Y56-W58 VanDerWaalsContact C-N 3.35Å; Y56-A59 PolarHBondContact O-N 3.24Å; Y56-L60 HydrophobicContact CE1-CD2 3.87Å; Y56-L60 VanDerWaalsContact O-CB 3.26Å; Y56-L60 WeakPolarHBondContact O-CB 3.36Å; Y56-L60 PolarHBondContact O-N 3.47Å; Y56-L75 HydrophobicContact CE1-CD2 4.23Å; Y56-L75 WeakPolarHBondContact OH-CD2 3.43Å; Y56-Y111 HydrophobicContact CE1-CE1 4.26Å; Y56-Y111 HydrophobicContact CE2-CE1 4.07Å; Y56-Y111 AromaticContact CZ-CE1 3.8Å; Y56-Y111 PolarHBondContact OH-OH 2.94Å; Y56-L112 WeakPolarHBondContact CB-O 3.44Å; Y56-L112 HydrophobicContact CD1-CD2 3.67Å; Y56-L112 HydrophobicContact CE1-CD2 3.89Å; Y56-L112 HydrophobicContact CG-CD2 4.45Å
57	F	94.2	Very high	88.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-70.4	-32.6	179.6	-72	-56.8	0	0	0	112.4	L36 L50 S54 A59 L60 F61 L75 L112	L36-F57 HydrophobicContact CD1-CE1 3.97Å; L36-F57 HydrophobicContact CD1-CZ 3.63Å; L36-F57 HydrophobicContact CD2-CE1 4.12Å; L50-F57 HydrophobicContact CB-CB 3.9Å; L50-F57 HydrophobicContact CB-CD1 4.47Å; L50-F57 HydrophobicContact CB-CD2 3.75Å; L50-F57 HydrophobicContact CB-CE2 4.4Å; L50-F57 HydrophobicContact CB-CG 3.8Å; L50-F57 HydrophobicContact CD1-CD1 4.31Å; L50-F57 HydrophobicContact CD1-CD2 4.35Å; L50-F57 HydrophobicContact CD1-CE1 4.25Å; L50-F57 HydrophobicContact CD1-CE2 4.29Å; L50-F57 HydrophobicContact CD1-CG 4.38Å; L50-F57 HydrophobicContact CD1-CZ 4.25Å; L50-F57 HydrophobicContact CD2-CD2 4.11Å; L50-F57 HydrophobicContact CD2-CE2 3.98Å; L50-F57 HydrophobicContact CG-CD2 4.29Å; L50-F57 HydrophobicContact CG-CE2 4.45Å; S54-F57 PolarHBondContact O-N 3.08Å; S54-F57 WeakPolarHBondContact OG-CD2 3.49Å; S54-F57 PolarHBondContact OG-N 3.03Å; S54-F57 VanDerWaalsContact OG-N 3.17Å; F57-A59 VanDerWaalsContact C-N 3.34Å; F57-L60 HydrophobicContact CD1-CD2 4.01Å; F57-L60 HydrophobicContact CE1-CD2 4.29Å; F57-L60 PolarHBondContact O-N 3.44Å; F57-F61 HydrophobicContact CB-CD2 4.3Å; F57-F61 HydrophobicContact CB-CE2 3.91Å; F57-F61 HydrophobicContact CD1-CE2 4.05Å; F57-F61 AromaticContact CD1-CZ 3.81Å; F57-F61 HydrophobicContact CD1-CZ 3.81Å; F57-F61 HydrophobicContact CG-CE2 4.28Å; F57-F61 HydrophobicContact CG-CZ 4.49Å; F57-F61 WeakPolarHBondContact O-CB 3.38Å; F57-F61 VanDerWaalsContact O-CD2 3.23Å; F57-F61 WeakPolarHBondContact O-CD2 3.47Å; F57-F61 VanDerWaalsContact O-CG 3.32Å; F57-F61 WeakPolarHBondContact O-CG 3.48Å; F57-F61 PolarHBondContact O-N 2.99Å; F57-L75 HydrophobicContact CZ-CD1 4.48Å; F57-L112 HydrophobicContact CE1-CD2 4.31Å; F57-L112 HydrophobicContact CE2-CD1 4.26Å; F57-L112 HydrophobicContact CE2-CD2 3.79Å; F57-L112 HydrophobicContact CE2-CG 4.44Å; F57-L112 HydrophobicContact CZ-CD1 4.45Å; F57-L112 HydrophobicContact CZ-CD2 3.57Å
58	W	92.7	Very high	88.3	Confident	173 Å²	173	63.4 Å²	63.4	66%	0.655	36%	0.355	S	S	*	.	H	α-helix	trans	-57.7	-48	171.7	-178.1	-91.3	0	0	0	111.4	A51 S54 D55 Y56 G62	A51-W58 HydrophobicContact CB-CE3 3.99Å; S54-W58 WeakPolarHBondContact O-CB 3.28Å; S54-W58 PolarHBondContact O-N 3.29Å; D55-W58 PolarHBondContact O-N 3.39Å; Y56-W58 VanDerWaalsContact C-N 3.35Å; W58-G62 PolarHBondContact O-N 3.42Å
59	A	91.7	Very high	87.8	Confident	63 Å²	63	64.9 Å²	64.9	52%	0.521	37%	0.366	S	S	.	.	H	α-helix	trans	-68.1	-42.4	176.4	0	0	0	0	0	112.2	D55 Y56 F57 F61 G62	D55-A59 WeakPolarHBondContact O-CB 3.5Å; D55-A59 PolarHBondContact O-N 3.5Å; Y56-A59 PolarHBondContact O-N 3.24Å; F57-A59 VanDerWaalsContact C-N 3.34Å; A59-F61 VanDerWaalsContact C-N 3.27Å; A59-F61 PolarHBondContact O-N 3.42Å; A59-G62 PolarHBondContact O-N 3.26Å; A59-G62 VanDerWaalsContact O-N 3.13Å
60	L	90.7	Very high	87.6	Confident	20 Å²	20	65.7 Å²	65.7	11%	0.105	37%	0.374	C	S	.	.	H	α-helix	trans	-62.9	-32.3	-178.3	-171.3	67.4	0	0	0	112.7	Y56 F57 T65 E67 I73	Y56-L60 HydrophobicContact CE1-CD2 3.87Å; Y56-L60 VanDerWaalsContact O-CB 3.26Å; Y56-L60 WeakPolarHBondContact O-CB 3.36Å; Y56-L60 PolarHBondContact O-N 3.47Å; F57-L60 HydrophobicContact CD1-CD2 4.01Å; F57-L60 HydrophobicContact CE1-CD2 4.29Å; F57-L60 PolarHBondContact O-N 3.44Å; L60-T65 WeakPolarHBondContact O-CB 3.46Å; L60-T65 PolarHBondContact O-OG1 3.05Å; L60-E67 HydrophobicContact CD1-CB 3.85Å; L60-E67 HydrophobicContact CD1-CG 3.88Å; L60-E67 HydrophobicContact CG-CB 4.05Å; L60-I73 HydrophobicContact CD2-CD1 4.03Å; L60-I73 HydrophobicContact CD2-CG2 4.18Å
61	F	90.3	Very high	87.2	Confident	29 Å²	29	72.4 Å²	72.4	13%	0.127	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	7.4	178.5	-54.5	-30.7	0	0	0	113.7	V34 R47 L50 A51 F57 A59 I73	V34-F61 HydrophobicContact CG1-CZ 4.46Å; R47-F61 HydrophobicContact CB-CD2 3.84Å; R47-F61 HydrophobicContact CB-CE2 3.84Å; R47-F61 HydrophobicContact CB-CG 4.48Å; R47-F61 HydrophobicContact CB-CZ 4.45Å; R47-F61 HydrophobicContact CG-CD2 4.1Å; R47-F61 HydrophobicContact CG-CE1 4.31Å; R47-F61 HydrophobicContact CG-CE2 3.88Å; R47-F61 HydrophobicContact CG-CG 4.44Å; R47-F61 HydrophobicContact CG-CZ 3.98Å; R47-F61 VanDerWaalsContact NH1-CE1 3.28Å; L50-F61 HydrophobicContact CB-CE2 4.02Å; L50-F61 HydrophobicContact CD1-CE2 4.27Å; L50-F61 HydrophobicContact CD1-CZ 4.3Å; A51-F61 HydrophobicContact CB-CD2 4.17Å; F57-F61 HydrophobicContact CB-CD2 4.3Å; F57-F61 HydrophobicContact CB-CE2 3.91Å; F57-F61 HydrophobicContact CD1-CE2 4.05Å; F57-F61 AromaticContact CD1-CZ 3.81Å; F57-F61 HydrophobicContact CD1-CZ 3.81Å; F57-F61 HydrophobicContact CG-CE2 4.28Å; F57-F61 HydrophobicContact CG-CZ 4.49Å; F57-F61 WeakPolarHBondContact O-CB 3.38Å; F57-F61 VanDerWaalsContact O-CD2 3.23Å; F57-F61 WeakPolarHBondContact O-CD2 3.47Å; F57-F61 VanDerWaalsContact O-CG 3.32Å; F57-F61 WeakPolarHBondContact O-CG 3.48Å; F57-F61 PolarHBondContact O-N 2.99Å; A59-F61 VanDerWaalsContact C-N 3.27Å; A59-F61 PolarHBondContact O-N 3.42Å; F61-I73 HydrophobicContact CD1-CD1 4.5Å; F61-I73 HydrophobicContact CE1-CD1 3.57Å; F61-I73 HydrophobicContact CZ-CD1 4.37Å
62	G	84.1	Confident	87.2	Confident	25 Å²	25	74 Å²	74	26%	0.258	42%	0.42	S	S	.	.	S	Bend	trans	-63.9	176.2	176.2	0	0	0	0	0	113.6	W58 A59 T64 T65	W58-G62 PolarHBondContact O-N 3.42Å; A59-G62 PolarHBondContact O-N 3.26Å; A59-G62 VanDerWaalsContact O-N 3.13Å; G62-T64 VanDerWaalsContact C-N 3.26Å; G62-T64 PolarHBondContact O-N 2.94Å; G62-T65 PolarHBondContact O-OG1 2.94Å
63	E	73.4	Confident	87.2	Confident	166 Å²	166	70.4 Å²	70.4	78%	0.776	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.5	-169	-63.4	-170.6	154.4	0	0	114.8
64	T	73.3	Confident	87.3	Confident	140 Å²	140	77.4 Å²	77.4	86%	0.859	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-1.3	-168.3	54.9	0	0	0	0	115	G62	G62-T64 VanDerWaalsContact C-N 3.26Å; G62-T64 PolarHBondContact O-N 2.94Å
65	T	82.4	Confident	87.2	Confident	38 Å²	38	77.2 Å²	77.2	23%	0.233	41%	0.412	C	S	.	.			trans	-100	144.1	-174.4	52.9	0	0	0	0	111.9	L60 G62 E67 R68	L60-T65 WeakPolarHBondContact O-CB 3.46Å; L60-T65 PolarHBondContact O-OG1 3.05Å; G62-T65 PolarHBondContact O-OG1 2.94Å; T65-E67 WeakPolarHBondContact CB-OE2 3.37Å; T65-E67 PolarHBondContact O-N 3.05Å; T65-R68 VanDerWaalsContact O-CB 3.32Å; T65-R68 WeakPolarHBondContact O-CB 3.41Å; T65-R68 PolarHBondContact O-N 3.11Å
66	A	76.4	Confident	87	Confident	82 Å²	82	78 Å²	78	68%	0.678	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-69.8	-26.4	176.9	0	0	0	0	0	111.6	R68 S69	A66-R68 PolarHBondContact O-N 3.1Å; A66-S69 PolarHBondContact O-N 3.49Å
67	E	81.6	Confident	86.9	Confident	76 Å²	76	78 Å²	78	36%	0.355	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-69.8	-13.5	179.7	-62.7	83.3	176.5	0	0	112.9	R47 L60 T65 S69 A70 I73	R47-E67 PolarHBondContact NH1-O 3.16Å; R47-E67 PolarHBondContact NH2-O 3.06Å; L60-E67 HydrophobicContact CD1-CB 3.85Å; L60-E67 HydrophobicContact CD1-CG 3.88Å; L60-E67 HydrophobicContact CG-CB 4.05Å; T65-E67 WeakPolarHBondContact CB-OE2 3.37Å; T65-E67 PolarHBondContact O-N 3.05Å; E67-S69 VanDerWaalsContact C-N 3.27Å; E67-S69 PolarHBondContact O-N 3.12Å; E67-A70 PolarHBondContact O-N 2.95Å; E67-I73 HydrophobicContact CB-CD1 4.05Å; E67-I73 HydrophobicContact CB-CG1 4.4Å
68	R	81.9	Confident	86.9	Confident	130 Å²	130	78.4 Å²	78.4	49%	0.491	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-56.5	-39.4	174	180	-176.2	174.2	175	5.3	112.7	R47 T65 A66	R47-R68 PolarHBondContact NH1-O 3.38Å; R47-R68 PolarHBondContact NH2-O 3.22Å; T65-R68 VanDerWaalsContact O-CB 3.32Å; T65-R68 WeakPolarHBondContact O-CB 3.41Å; T65-R68 PolarHBondContact O-N 3.11Å; A66-R68 PolarHBondContact O-N 3.1Å
69	S	82.9	Confident	87	Confident	104 Å²	104	72.4 Å²	72.4	73%	0.727	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-110.8	9.5	-177.9	54.9	0	0	0	0	113.3	A66 E67	A66-S69 PolarHBondContact O-N 3.49Å; E67-S69 VanDerWaalsContact C-N 3.27Å; E67-S69 PolarHBondContact O-N 3.12Å
70	A	88	Confident	87.2	Confident	29 Å²	29	70.6 Å²	70.6	24%	0.24	40%	0.4	C	S	.	.			trans	-78.3	131.2	179.4	0	0	0	0	0	111.5	R47 E67 S72 I73	R47-A70 PolarHBondContact NH2-O 3.41Å; E67-A70 PolarHBondContact O-N 2.95Å; A70-S72 VanDerWaalsContact C-N 3.29Å; A70-S72 PolarHBondContact O-N 3.17Å; A70-I73 HydrophobicContact CB-CG1 4.29Å
71	D	87.1	Confident	87.5	Confident	141 Å²	141	75.3 Å²	75.3	75%	0.754	42%	0.422	S	S	*	.	S	Bend	trans	-71.4	-28.4	176.1	-64.7	-32.5	0	0	0	112.2	V35	V35-D71 PolarHBondContact N-O 3.28Å
72	S	92.2	Very high	87.7	Confident	48 Å²	48	73.9 Å²	73.9	34%	0.336	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138.5	177.8	-177.3	0	0	0	0	111.7	V35 E37 A70	V35-S72 CarbonylContact O-C 3.45Å; V35-S72 VanDerWaalsContact O-CA 3.29Å; V35-S72 WeakPolarHBondContact O-CA 3.46Å; E37-S72 WeakPolarHBondContact CG-OG 3.39Å; E37-S72 PolarHBondContact OE1-OG 3.47Å; A70-S72 VanDerWaalsContact C-N 3.29Å; A70-S72 PolarHBondContact O-N 3.17Å
73	I	93.6	Very high	88.3	Confident	10 Å²	10	72.7 Å²	72.7	5%	0.051	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.8	-178.7	-60.4	175.1	0	0	0	109.2	V34 V35 L36 E37 L60 F61 E67 A70 L75	V34-I73 HydrophobicContact CG2-CD1 3.69Å; V34-I73 HydrophobicContact CG2-CG1 4.05Å; V35-I73 PolarHBondContact O-N 3.39Å; L36-I73 CarbonylContact C-O 3.58Å; L36-I73 WeakPolarHBondContact CA-O 3.22Å; L36-I73 HydrophobicContact CD2-CB 4.03Å; L36-I73 HydrophobicContact CD2-CD1 4.49Å; L36-I73 HydrophobicContact CD2-CG2 4.44Å; E37-I73 PolarHBondContact N-O 3.21Å; L60-I73 HydrophobicContact CD2-CD1 4.03Å; L60-I73 HydrophobicContact CD2-CG2 4.18Å; F61-I73 HydrophobicContact CD1-CD1 4.5Å; F61-I73 HydrophobicContact CE1-CD1 3.57Å; F61-I73 HydrophobicContact CZ-CD1 4.37Å; E67-I73 HydrophobicContact CB-CD1 4.05Å; E67-I73 HydrophobicContact CB-CG1 4.4Å; A70-I73 HydrophobicContact CB-CG1 4.29Å; I73-L75 HydrophobicContact CG2-CD2 4.26Å
74	R	92.8	Very high	89.4	Confident	193 Å²	193	69.2 Å²	69.2	73%	0.728	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.4	179.4	-68.2	-179.1	178.1	171	6.3	111.5	E37 P76	E37-R74 HydrophobicContact CB-CG 3.99Å; E37-R74 WeakPolarHBondContact O-CA 3.39Å; E37-R74 WeakPolarHBondContact OE2-CG 3.49Å; E37-R74 IonicContact OE2-CZ 3.86Å; E37-R74 IonicContact OE2-NE 2.98Å; E37-R74 PolarHBondContact OE2-NE 3.2Å; E37-R74 IonicContact OE2-NH2 3.88Å; R74-P76 VanDerWaalsContact C-CD 3.49Å; R74-P76 VanDerWaalsContact O-CD 3.28Å; R74-P76 WeakPolarHBondContact O-CD 3.49Å
75	L	93.9	Very high	90.5	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.005	35%	0.354	C	S	.	.			trans	-117.4	74.7	177.7	-59.9	177.6	0	0	0	109.4	L36 E37 Y56 F57 I73 A77 L78 L83 Y111 L112	L36-L75 HydrophobicContact CB-CD1 4.44Å; L36-L75 HydrophobicContact CD1-CD1 4.29Å; L36-L75 HydrophobicContact CD2-CD1 4.39Å; E37-L75 PolarHBondContact O-N 3.4Å; Y56-L75 HydrophobicContact CE1-CD2 4.23Å; Y56-L75 WeakPolarHBondContact OH-CD2 3.43Å; F57-L75 HydrophobicContact CZ-CD1 4.48Å; I73-L75 HydrophobicContact CG2-CD2 4.26Å; L75-A77 PolarHBondContact O-N 3.25Å; L75-L78 HydrophobicContact CB-CD1 4.24Å; L75-L78 HydrophobicContact CB-CG 4.45Å; L75-L78 HydrophobicContact CD1-CD1 4.09Å; L75-L78 PolarHBondContact O-N 2.87Å; L75-L83 HydrophobicContact CD1-CD1 4.21Å; L75-L83 HydrophobicContact CD1-CD2 4.26Å; L75-Y111 HydrophobicContact CD2-CE1 4.28Å; L75-L112 HydrophobicContact CD1-CD2 4.39Å
76	P	90.2	Very high	91.2	Very high	121 Å²	121	61.7 Å²	61.7	79%	0.786	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-18	-172.7	29	-36.2	0	0	0	113.8	R74 L78	R74-P76 VanDerWaalsContact C-CD 3.49Å; R74-P76 VanDerWaalsContact O-CD 3.28Å; R74-P76 WeakPolarHBondContact O-CD 3.49Å; P76-L78 VanDerWaalsContact C-N 3.25Å; P76-L78 PolarHBondContact O-N 3.03Å
77	A	91.3	Very high	92.1	Very high	48 Å²	48	57.8 Å²	57.8	40%	0.397	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-10	177.5	0	0	0	0	0	113.4	L75 Y111	L75-A77 PolarHBondContact O-N 3.25Å; A77-Y111 HydrophobicContact CB-CD2 3.99Å; A77-Y111 HydrophobicContact CB-CE2 3.58Å
78	L	94.8	Very high	92.7	Very high	9 Å²	9	57 Å²	57	5%	0.047	31%	0.309	C	S	.	.	S	Bend	trans	-111.6	145	-174.7	-60.6	-176.6	0	0	0	111.9	A38 L75 P76 L83 A108 Y111 L112	A38-L78 HydrophobicContact CB-CB 4.46Å; L75-L78 HydrophobicContact CB-CD1 4.24Å; L75-L78 HydrophobicContact CB-CG 4.45Å; L75-L78 HydrophobicContact CD1-CD1 4.09Å; L75-L78 PolarHBondContact O-N 2.87Å; P76-L78 VanDerWaalsContact C-N 3.25Å; P76-L78 PolarHBondContact O-N 3.03Å; L78-L83 HydrophobicContact CD1-CB 4.49Å; L78-L83 HydrophobicContact CD1-CD1 4.09Å; L78-A108 HydrophobicContact CD2-CB 4Å; L78-Y111 HydrophobicContact CD1-CD1 3.94Å; L78-Y111 HydrophobicContact CD1-CE1 4.38Å; L78-Y111 HydrophobicContact CD2-CD1 4Å; L78-Y111 HydrophobicContact CD2-CG 3.93Å; L78-Y111 HydrophobicContact CG-CD1 4.05Å; L78-Y111 HydrophobicContact CG-CE1 4.46Å; L78-Y111 HydrophobicContact CG-CG 4.42Å; L78-L112 HydrophobicContact CD1-CD1 3.99Å; L78-L112 HydrophobicContact CD1-CD2 4.02Å; L78-L112 HydrophobicContact CD1-CG 3.96Å
79	T	95.5	Very high	93.4	Very high	47 Å²	47	52 Å²	52	29%	0.288	29%	0.291	S	S	.	.			trans	-80.2	152.7	167	69	0	0	0	0	110.6	E81 G82 L83 V104	T79-E81 VanDerWaalsContact C-N 3.25Å; T79-E81 WeakPolarHBondContact CB-OE2 3.47Å; T79-E81 PolarHBondContact O-N 2.91Å; T79-G82 PolarHBondContact O-N 3.04Å; T79-G82 PolarHBondContact OG1-N 2.88Å; T79-G82 VanDerWaalsContact OG1-N 3.14Å; T79-L83 PolarHBondContact O-N 3.01Å; T79-V104 HydrophobicContact CG2-CG1 4.21Å
80	P	95.9	Very high	93.9	Very high	26 Å²	26	47.4 Å²	47.4	17%	0.169	26%	0.258	C	S	.	.	H	α-helix	trans	-54.4	-42.7	173.8	-23.4	32.2	0	0	0	112.4	V41 F43 L83 E84	V41-P80 HydrophobicContact CB-CB 4.15Å; V41-P80 HydrophobicContact CB-CG 4.38Å; V41-P80 HydrophobicContact CG2-CB 3.88Å; V41-P80 HydrophobicContact CG2-CG 3.88Å; F43-P80 HydrophobicContact CZ-CB 4.23Å; P80-L83 PolarHBondContact O-N 3.17Å; P80-E84 VanDerWaalsContact O-CB 3.26Å; P80-E84 WeakPolarHBondContact O-CB 3.49Å; P80-E84 PolarHBondContact O-N 2.91Å
81	E	95.6	Very high	94.2	Very high	118 Å²	118	46 Å²	46	55%	0.551	25%	0.246	S	C	*	.	H	α-helix	trans	-66.8	-41.2	-177.3	-58.7	77.4	-168.6	0	0	111.9	T79 A85	T79-E81 VanDerWaalsContact C-N 3.25Å; T79-E81 WeakPolarHBondContact CB-OE2 3.47Å; T79-E81 PolarHBondContact O-N 2.91Å; E81-A85 WeakPolarHBondContact O-CB 3.39Å; E81-A85 PolarHBondContact O-N 3.21Å; E81-A85 VanDerWaalsContact O-N 3.12Å
82	G	95.3	Very high	94.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.3	-44.6	177.5	0	0	0	0	0	111.7	T79 I86 A108	T79-G82 PolarHBondContact O-N 3.04Å; T79-G82 PolarHBondContact OG1-N 2.88Å; T79-G82 VanDerWaalsContact OG1-N 3.14Å; G82-I86 WeakPolarHBondContact O-CG1 3.29Å; G82-I86 PolarHBondContact O-N 3.33Å; G82-A108 WeakPolarHBondContact O-CB 3.48Å
83	L	96.4	Very high	94.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.6	-44.5	177.7	180	59.6	0	0	0	111.6	L36 A38 F43 L75 L78 T79 P80 A85 I86 L87 L112	L36-L83 HydrophobicContact CB-CD2 4.16Å; L36-L83 HydrophobicContact CD1-CD1 4.32Å; A38-L83 HydrophobicContact CB-CB 4.38Å; A38-L83 HydrophobicContact CB-CD2 3.61Å; F43-L83 HydrophobicContact CD2-CD2 3.65Å; F43-L83 HydrophobicContact CD2-CG 4.33Å; F43-L83 HydrophobicContact CE2-CD2 3.89Å; F43-L83 HydrophobicContact CE2-CG 4.42Å; F43-L83 HydrophobicContact CG-CD2 4.39Å; L75-L83 HydrophobicContact CD1-CD1 4.21Å; L75-L83 HydrophobicContact CD1-CD2 4.26Å; L78-L83 HydrophobicContact CD1-CB 4.49Å; L78-L83 HydrophobicContact CD1-CD1 4.09Å; T79-L83 PolarHBondContact O-N 3.01Å; P80-L83 PolarHBondContact O-N 3.17Å; L83-A85 PolarHBondContact O-N 2.86Å; L83-I86 PolarHBondContact O-N 3.42Å; L83-L87 HydrophobicContact CD1-CD1 4.07Å; L83-L87 HydrophobicContact CD1-CG 4.02Å; L83-L87 HydrophobicContact CG-CD1 3.89Å; L83-L87 HydrophobicContact CG-CG 4.27Å; L83-L87 WeakPolarHBondContact O-CB 3.26Å; L83-L87 VanDerWaalsContact O-CG 3.27Å; L83-L87 WeakPolarHBondContact O-CG 3.31Å; L83-L87 PolarHBondContact O-N 3.17Å; L83-L112 HydrophobicContact CD1-CD1 3.88Å
84	E	95.6	Very high	94.3	Very high	93 Å²	93	50.6 Å²	50.6	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-59	-48	178.3	-174.3	168.1	-144.1	0	0	111.6	F43 P80 I86 L87 D88	F43-E84 HydrophobicContact CE1-CB 3.81Å; F43-E84 HydrophobicContact CE1-CG 4.17Å; F43-E84 HydrophobicContact CZ-CB 4.25Å; P80-E84 VanDerWaalsContact O-CB 3.26Å; P80-E84 WeakPolarHBondContact O-CB 3.49Å; P80-E84 PolarHBondContact O-N 2.91Å; E84-I86 VanDerWaalsContact C-N 3.32Å; E84-I86 PolarHBondContact O-N 3.49Å; E84-L87 PolarHBondContact O-N 2.79Å; E84-D88 WeakPolarHBondContact O-CB 3.41Å; E84-D88 VanDerWaalsContact O-CG 3.26Å; E84-D88 PolarHBondContact O-N 2.89Å
85	A	96.4	Very high	94.4	Very high	20 Å²	20	42.6 Å²	42.6	17%	0.165	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-40.1	179.2	0	0	0	0	0	113	E81 L83 F89 V105	E81-A85 WeakPolarHBondContact O-CB 3.39Å; E81-A85 PolarHBondContact O-N 3.21Å; E81-A85 VanDerWaalsContact O-N 3.12Å; L83-A85 PolarHBondContact O-N 2.86Å; A85-F89 WeakPolarHBondContact O-CB 3.47Å; A85-F89 PolarHBondContact O-N 3.41Å; A85-V105 HydrophobicContact CB-CG2 3.79Å
86	I	97.2	Very high	94.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-70.5	-43.5	176.6	-61.9	-56.7	0	0	0	111	G82 L83 E84 D88 F89 L90 L95 V105 A108 A109 L112 V114 A117	G82-I86 WeakPolarHBondContact O-CG1 3.29Å; G82-I86 PolarHBondContact O-N 3.33Å; L83-I86 PolarHBondContact O-N 3.42Å; E84-I86 VanDerWaalsContact C-N 3.32Å; E84-I86 PolarHBondContact O-N 3.49Å; I86-D88 VanDerWaalsContact C-N 3.31Å; I86-D88 PolarHBondContact O-N 3.29Å; I86-F89 WeakPolarHBondContact O-CB 3.26Å; I86-F89 PolarHBondContact O-N 3.47Å; I86-L90 HydrophobicContact CG2-CD1 4.44Å; I86-L90 HydrophobicContact CG2-CG 4.29Å; I86-L90 VanDerWaalsContact O-CG 3.31Å; I86-L90 WeakPolarHBondContact O-CG 3.2Å; I86-L90 PolarHBondContact O-N 3.06Å; I86-L95 HydrophobicContact CD1-CD1 4.28Å; I86-V105 HydrophobicContact CD1-CG1 4.03Å; I86-A108 HydrophobicContact CG1-CB 3.68Å; I86-A109 HydrophobicContact CD1-CB 3.67Å; I86-L112 HydrophobicContact CB-CD1 4.24Å; I86-L112 HydrophobicContact CG2-CD1 3.83Å; I86-V114 HydrophobicContact CG2-CB 4.49Å; I86-V114 HydrophobicContact CG2-CG2 3.88Å; I86-A117 HydrophobicContact CD1-CB 3.98Å
87	L	95.6	Very high	94.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-42.5	176	-69.7	175.2	0	0	0	111.4	R26 L36 F43 L50 L83 E84 F89 L90 Y91	R26-L87 PolarHBondContact NH1-O 3.49Å; L36-L87 HydrophobicContact CD1-CD1 4.5Å; L36-L87 HydrophobicContact CD1-CD2 4.13Å; F43-L87 HydrophobicContact CB-CD1 3.69Å; F43-L87 HydrophobicContact CD1-CD1 4.07Å; F43-L87 HydrophobicContact CG-CD1 3.94Å; L50-L87 HydrophobicContact CD2-CD2 3.62Å; L83-L87 HydrophobicContact CD1-CD1 4.07Å; L83-L87 HydrophobicContact CD1-CG 4.02Å; L83-L87 HydrophobicContact CG-CD1 3.89Å; L83-L87 HydrophobicContact CG-CG 4.27Å; L83-L87 WeakPolarHBondContact O-CB 3.26Å; L83-L87 VanDerWaalsContact O-CG 3.27Å; L83-L87 WeakPolarHBondContact O-CG 3.31Å; L83-L87 PolarHBondContact O-N 3.17Å; E84-L87 PolarHBondContact O-N 2.79Å; L87-F89 VanDerWaalsContact C-N 3.29Å; L87-F89 PolarHBondContact O-N 2.63Å; L87-L90 PolarHBondContact O-N 2.99Å; L87-L90 VanDerWaalsContact O-N 3.17Å; L87-Y91 VanDerWaalsContact O-CD2 3.22Å; L87-Y91 WeakPolarHBondContact O-CD2 3.49Å; L87-Y91 PolarHBondContact O-N 3.01Å
88	D	94.4	Very high	94.5	Very high	60 Å²	60	43.1 Å²	43.1	32%	0.321	24%	0.238	S	C	.	.	H	α-helix	trans	-63.1	-38.1	176.7	-71.1	-1.2	0	0	0	111.5	R26 E84 I86 Y91 S92	R26-D88 IonicContact CZ-OD1 3.41Å; R26-D88 IonicContact NH1-OD1 3.37Å; R26-D88 PolarHBondContact NH1-OD1 3.25Å; R26-D88 IonicContact NH2-OD1 2.81Å; R26-D88 PolarHBondContact NH2-OD1 3.04Å; R26-D88 VanDerWaalsContact NH2-OD1 3.08Å; E84-D88 WeakPolarHBondContact O-CB 3.41Å; E84-D88 VanDerWaalsContact O-CG 3.26Å; E84-D88 PolarHBondContact O-N 2.89Å; I86-D88 VanDerWaalsContact C-N 3.31Å; I86-D88 PolarHBondContact O-N 3.29Å; D88-Y91 PolarHBondContact O-N 2.72Å; D88-S92 WeakPolarHBondContact O-CB 3.27Å; D88-S92 PolarHBondContact O-N 2.82Å; D88-S92 PolarHBondContact O-OG 3.23Å
89	F	95.9	Very high	94.2	Very high	23 Å²	23	46.2 Å²	46.2	10%	0.101	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-44.8	171.1	171.5	-104	0	0	0	112.7	A85 I86 L87 Y91 S92 G93 W94 L95 V114 A116 A117 I120	A85-F89 WeakPolarHBondContact O-CB 3.47Å; A85-F89 PolarHBondContact O-N 3.41Å; I86-F89 WeakPolarHBondContact O-CB 3.26Å; I86-F89 PolarHBondContact O-N 3.47Å; L87-F89 VanDerWaalsContact C-N 3.29Å; L87-F89 PolarHBondContact O-N 2.63Å; F89-Y91 PolarHBondContact O-N 3.24Å; F89-S92 PolarHBondContact O-N 2.81Å; F89-G93 VanDerWaalsContact O-CA 3.25Å; F89-G93 WeakPolarHBondContact O-CA 3.4Å; F89-G93 PolarHBondContact O-N 3.08Å; F89-W94 WeakPolarHBondContact CA-O 3.3Å; F89-L95 HydrophobicContact CB-CB 4.34Å; F89-L95 HydrophobicContact CB-CD1 3.73Å; F89-L95 HydrophobicContact CD2-CB 3.78Å; F89-L95 HydrophobicContact CE2-CB 4.48Å; F89-L95 HydrophobicContact CG-CB 4.29Å; F89-L95 HydrophobicContact CG-CD1 4.19Å; F89-V114 HydrophobicContact CD1-CG1 4.02Å; F89-V114 HydrophobicContact CE1-CG1 3.74Å; F89-A116 HydrophobicContact CE1-CB 4.18Å; F89-A116 HydrophobicContact CZ-CB 3.92Å; F89-A117 HydrophobicContact CD1-CB 3.87Å; F89-A117 HydrophobicContact CE1-CB 3.84Å; F89-A117 HydrophobicContact CZ-CB 4.44Å; F89-I120 HydrophobicContact CD2-CD1 4.45Å; F89-I120 HydrophobicContact CE2-CD1 3.63Å; F89-I120 HydrophobicContact CZ-CD1 4.09Å
90	L	95.2	Very high	94	Very high	8 Å²	8	48.7 Å²	48.7	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-61.8	-33.2	-180	-67.6	-172.6	0	0	0	112.6	L19 L50 I86 L87 V114	L19-L90 WeakPolarHBondContact CD2-O 3.25Å; L50-L90 HydrophobicContact CD2-CD1 3.58Å; I86-L90 HydrophobicContact CG2-CD1 4.44Å; I86-L90 HydrophobicContact CG2-CG 4.29Å; I86-L90 VanDerWaalsContact O-CG 3.31Å; I86-L90 WeakPolarHBondContact O-CG 3.2Å; I86-L90 PolarHBondContact O-N 3.06Å; L87-L90 PolarHBondContact O-N 2.99Å; L87-L90 VanDerWaalsContact O-N 3.17Å; L90-V114 HydrophobicContact CD2-CG1 3.88Å; L90-V114 HydrophobicContact CD2-CG2 4.23Å
91	Y	94	Very high	93.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-91.9	-29.5	-178.1	-79.8	-106.1	0	0	0	114	L19 F22 R26 C45 H46 L49 L87 D88 F89	L19-Y91 WeakPolarHBondContact CD2-O 3.38Å; F22-Y91 HydrophobicContact CB-CD1 4Å; F22-Y91 HydrophobicContact CB-CE1 4.18Å; F22-Y91 WeakPolarHBondContact O-CD1 3.31Å; R26-Y91 HydrophobicContact CB-CD1 3.94Å; R26-Y91 HydrophobicContact CB-CE1 3.62Å; R26-Y91 HydrophobicContact CG-CE1 4.18Å; C45-Y91 WeakPolarHBondContact CA-OH 3.27Å; H46-Y91 AromaticContact CE1-CE1 3.94Å; H46-Y91 PolarHBondContact N-OH 3.46Å; H46-Y91 AromaticContact ND1-CE1 3.34Å; H46-Y91 VanDerWaalsContact ND1-CE1 3.34Å; H46-Y91 WeakPolarHBondContact ND1-CE1 3.49Å; H46-Y91 AromaticContact ND1-CZ 3.55Å; H46-Y91 PolarHBondContact ND1-OH 2.81Å; L49-Y91 HydrophobicContact CD2-CD1 3.52Å; L49-Y91 HydrophobicContact CD2-CD2 3.62Å; L49-Y91 HydrophobicContact CD2-CE1 3.5Å; L49-Y91 HydrophobicContact CD2-CE2 3.62Å; L49-Y91 HydrophobicContact CD2-CG 3.6Å; L87-Y91 VanDerWaalsContact O-CD2 3.22Å; L87-Y91 WeakPolarHBondContact O-CD2 3.49Å; L87-Y91 PolarHBondContact O-N 3.01Å; D88-Y91 PolarHBondContact O-N 2.72Å; F89-Y91 PolarHBondContact O-N 3.24Å
92	S	91.8	Very high	93.9	Very high	45 Å²	45	44.2 Å²	44.2	32%	0.315	26%	0.26	S	S	.	.	H	α-helix	trans	-106.7	-24.3	-175.3	74.8	0	0	0	0	114.2	D88 F89 W94	D88-S92 WeakPolarHBondContact O-CB 3.27Å; D88-S92 PolarHBondContact O-N 2.82Å; D88-S92 PolarHBondContact O-OG 3.23Å; F89-S92 PolarHBondContact O-N 2.81Å; S92-W94 VanDerWaalsContact O-CD1 3.26Å; S92-W94 PolarHBondContact OG-N 2.89Å; S92-W94 PolarHBondContact OG-O 3.44Å
93	G	90.8	Very high	93.9	Very high	43 Å²	43	45.7 Å²	45.7	44%	0.443	27%	0.27	S	S	.	.	S	Bend	trans	77.2	0.2	-167.3	0	0	0	0	0	114.5	F89	F89-G93 VanDerWaalsContact O-CA 3.25Å; F89-G93 WeakPolarHBondContact O-CA 3.4Å; F89-G93 PolarHBondContact O-N 3.08Å
94	W	91.9	Very high	93.9	Very high	207 Å²	207	47.5 Å²	47.5	78%	0.784	28%	0.281	S	S	*	.			trans	-107.2	130.4	-179.8	-63	91.7	0	0	0	110.8	F89 S92	F89-W94 WeakPolarHBondContact CA-O 3.3Å; S92-W94 VanDerWaalsContact O-CD1 3.26Å; S92-W94 PolarHBondContact OG-N 2.89Å; S92-W94 PolarHBondContact OG-O 3.44Å
95	L	95.1	Very high	93.9	Very high	25 Å²	25	43.1 Å²	43.1	13%	0.131	26%	0.261	C	S	.	.			trans	-112	116.6	177.3	-170.9	70.8	0	0	0	109.4	I86 F89 I97 V105 A117 I120	I86-L95 HydrophobicContact CD1-CD1 4.28Å; F89-L95 HydrophobicContact CB-CB 4.34Å; F89-L95 HydrophobicContact CB-CD1 3.73Å; F89-L95 HydrophobicContact CD2-CB 3.78Å; F89-L95 HydrophobicContact CE2-CB 4.48Å; F89-L95 HydrophobicContact CG-CB 4.29Å; F89-L95 HydrophobicContact CG-CD1 4.19Å; L95-I97 HydrophobicContact CD2-CG2 3.94Å; L95-I97 HydrophobicContact CG-CG2 3.94Å; L95-V105 HydrophobicContact CD1-CG1 4Å; L95-V105 HydrophobicContact CD2-CG1 4.23Å; L95-V105 HydrophobicContact CG-CG1 4.47Å; L95-A117 HydrophobicContact CD2-CB 4.23Å; L95-I120 HydrophobicContact CB-CD1 4.44Å; L95-I120 HydrophobicContact CB-CG2 4.43Å; L95-I120 HydrophobicContact CD2-CB 4.13Å; L95-I120 HydrophobicContact CD2-CG2 3.97Å
96	S	91.3	Very high	93.9	Very high	106 Å²	106	42.2 Å²	42.2	74%	0.741	25%	0.253	S	S	*	.			trans	-90	113.7	175.6	-172.7	0	0	0	0	109.9
97	I	93.4	Very high	93.9	Very high	31 Å²	31	46.2 Å²	46.2	16%	0.159	27%	0.272	C	S	.	.			trans	-130.1	141	-177.5	49.5	-177.1	0	0	0	111.3	L95 V105 I120 F124	L95-I97 HydrophobicContact CD2-CG2 3.94Å; L95-I97 HydrophobicContact CG-CG2 3.94Å; I97-V105 HydrophobicContact CG2-CB 4.46Å; I97-V105 HydrophobicContact CG2-CG1 4.02Å; I97-V105 HydrophobicContact CG2-CG2 4.49Å; I97-I120 HydrophobicContact CD1-CG2 4.1Å; I97-F124 HydrophobicContact CD1-CB 3.36Å; I97-F124 HydrophobicContact CD1-CD1 4.04Å; I97-F124 HydrophobicContact CD1-CD2 3.68Å; I97-F124 HydrophobicContact CD1-CE2 4.47Å; I97-F124 HydrophobicContact CD1-CG 3.42Å; I97-F124 VanDerWaalsContact CD1-CG 3.42Å; I97-F124 HydrophobicContact CG1-CB 4.47Å; I97-F124 HydrophobicContact CG1-CD2 3.9Å; I97-F124 HydrophobicContact CG1-CE2 4.25Å; I97-F124 HydrophobicContact CG1-CG 4.05Å
98	S	92.3	Very high	93.9	Very high	45 Å²	45	46.3 Å²	46.3	32%	0.315	27%	0.272	S	S	.	.			trans	-136.6	168.8	171.6	77	0	0	0	0	109.2	S100 T101 L102	S98-S100 PolarHBondContact O-N 3.47Å; S98-S100 VanDerWaalsContact O-N 3.15Å; S98-S100 PolarHBondContact OG-N 3.22Å; S98-S100 PolarHBondContact OG-OG 3.44Å; S98-S100 VanDerWaalsContact OG-OG 3.07Å; S98-T101 PolarHBondContact N-OG1 3.4Å; S98-T101 PolarHBondContact O-N 3.14Å; S98-T101 PolarHBondContact O-OG1 3.04Å; S98-T101 PolarHBondContact OG-N 2.92Å; S98-T101 PolarHBondContact OG-OG1 3.43Å; S98-L102 VanDerWaalsContact O-CB 3.31Å; S98-L102 WeakPolarHBondContact O-CB 3.38Å; S98-L102 PolarHBondContact O-N 2.83Å
99	S	89.1	Confident	94	Very high	73 Å²	73	43.4 Å²	43.4	51%	0.51	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-26.2	179.2	-48.3	0	0	0	0	113.6
100	S	91.3	Very high	93.9	Very high	100 Å²	100	46 Å²	46	70%	0.699	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-31.7	178.1	56.8	0	0	0	0	113.2	S98	S98-S100 PolarHBondContact O-N 3.47Å; S98-S100 VanDerWaalsContact O-N 3.15Å; S98-S100 PolarHBondContact OG-N 3.22Å; S98-S100 PolarHBondContact OG-OG 3.44Å; S98-S100 VanDerWaalsContact OG-OG 3.07Å
101	T	93.8	Very high	94	Very high	49 Å²	49	49.7 Å²	49.7	30%	0.301	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-19.3	-179.9	61.8	0	0	0	0	113.1	S98 P103 V104 V105	S98-T101 PolarHBondContact N-OG1 3.4Å; S98-T101 PolarHBondContact O-N 3.14Å; S98-T101 PolarHBondContact O-OG1 3.04Å; S98-T101 PolarHBondContact OG-N 2.92Å; S98-T101 PolarHBondContact OG-OG1 3.43Å; T101-P103 VanDerWaalsContact C-CD 3.44Å; T101-V104 WeakPolarHBondContact O-CG2 3.4Å; T101-V104 PolarHBondContact O-N 3.02Å; T101-V105 VanDerWaalsContact O-CG2 3.28Å; T101-V105 WeakPolarHBondContact O-CG2 3.45Å; T101-V105 PolarHBondContact O-N 3.14Å; T101-V105 VanDerWaalsContact O-N 3.1Å
102	L	95.1	Very high	94.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-51.1	-45	-175.9	-176.7	68.7	0	0	0	114.6	S98 V104 V105 V106 C121 F124 M125 Y137 L140	S98-L102 VanDerWaalsContact O-CB 3.31Å; S98-L102 WeakPolarHBondContact O-CB 3.38Å; S98-L102 PolarHBondContact O-N 2.83Å; L102-V104 PolarHBondContact O-N 3.41Å; L102-V105 PolarHBondContact O-N 3.01Å; L102-V106 HydrophobicContact CD1-CG2 3.84Å; L102-V106 HydrophobicContact CG-CG2 4.15Å; L102-V106 WeakPolarHBondContact O-CB 3.43Å; L102-V106 VanDerWaalsContact O-CG2 3.27Å; L102-V106 WeakPolarHBondContact O-CG2 3.26Å; L102-V106 PolarHBondContact O-N 3.33Å; L102-C121 HydrophobicContact CD1-CB 3.94Å; L102-F124 HydrophobicContact CD1-CD1 4.12Å; L102-F124 HydrophobicContact CD2-CD1 4.2Å; L102-F124 HydrophobicContact CD2-CE1 4.27Å; L102-M125 HydrophobicContact CD2-CG 3.56Å; L102-M125 HydrophobicContact CD2-SD 3.94Å; L102-Y137 HydrophobicContact CD2-CD1 4.21Å; L102-Y137 HydrophobicContact CD2-CE1 3.69Å; L102-L140 HydrophobicContact CD2-CD2 3.82Å; L102-L140 HydrophobicContact CG-CD2 3.95Å
103	P	95.4	Very high	94.2	Very high	31 Å²	31	51.9 Å²	51.9	20%	0.201	29%	0.285	C	S	.	.	H	α-helix	trans	-63.5	-46.9	-176.1	-23.3	36.3	0	0	0	112.7	T101 V105 V106 E107 Y136 L140	T101-P103 VanDerWaalsContact C-CD 3.44Å; P103-V105 VanDerWaalsContact C-N 3.31Å; P103-V105 PolarHBondContact O-N 3.45Å; P103-V106 PolarHBondContact O-N 3.34Å; P103-E107 WeakPolarHBondContact O-CB 3.37Å; P103-E107 PolarHBondContact O-N 2.71Å; P103-Y136 WeakPolarHBondContact CG-OH 3.32Å; P103-L140 HydrophobicContact CB-CD1 4.15Å; P103-L140 HydrophobicContact CG-CD2 4.44Å
104	V	95.6	Very high	94.5	Very high	39 Å²	39	50 Å²	50	24%	0.236	27%	0.265	C	S	.	.	H	α-helix	trans	-68.2	-33.4	-179.8	-63.7	0	0	0	0	111.6	T79 T101 L102 A108	T79-V104 HydrophobicContact CG2-CG1 4.21Å; T101-V104 WeakPolarHBondContact O-CG2 3.4Å; T101-V104 PolarHBondContact O-N 3.02Å; L102-V104 PolarHBondContact O-N 3.41Å; V104-A108 VanDerWaalsContact O-CB 3.3Å; V104-A108 WeakPolarHBondContact O-CB 3.41Å; V104-A108 PolarHBondContact O-N 2.9Å
105	V	96.8	Very high	94.6	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-70.7	-42.7	175.8	175.9	0	0	0	0	111.3	A85 I86 L95 I97 T101 L102 P103 A108 A109	A85-V105 HydrophobicContact CB-CG2 3.79Å; I86-V105 HydrophobicContact CD1-CG1 4.03Å; L95-V105 HydrophobicContact CD1-CG1 4Å; L95-V105 HydrophobicContact CD2-CG1 4.23Å; L95-V105 HydrophobicContact CG-CG1 4.47Å; I97-V105 HydrophobicContact CG2-CB 4.46Å; I97-V105 HydrophobicContact CG2-CG1 4.02Å; I97-V105 HydrophobicContact CG2-CG2 4.49Å; T101-V105 VanDerWaalsContact O-CG2 3.28Å; T101-V105 WeakPolarHBondContact O-CG2 3.45Å; T101-V105 PolarHBondContact O-N 3.14Å; T101-V105 VanDerWaalsContact O-N 3.1Å; L102-V105 PolarHBondContact O-N 3.01Å; P103-V105 VanDerWaalsContact C-N 3.31Å; P103-V105 PolarHBondContact O-N 3.45Å; V105-A108 PolarHBondContact O-N 3.4Å; V105-A109 VanDerWaalsContact O-CB 3.27Å; V105-A109 WeakPolarHBondContact O-CB 3.43Å; V105-A109 PolarHBondContact O-N 3.27Å
106	V	96.5	Very high	94.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-43.7	177.2	169.9	0	0	0	0	110.7	L102 P103 A109 R110 L118 C121 H144 L146	L102-V106 HydrophobicContact CD1-CG2 3.84Å; L102-V106 HydrophobicContact CG-CG2 4.15Å; L102-V106 WeakPolarHBondContact O-CB 3.43Å; L102-V106 VanDerWaalsContact O-CG2 3.27Å; L102-V106 WeakPolarHBondContact O-CG2 3.26Å; L102-V106 PolarHBondContact O-N 3.33Å; P103-V106 PolarHBondContact O-N 3.34Å; V106-A109 PolarHBondContact O-N 3.31Å; V106-R110 VanDerWaalsContact O-CB 3.31Å; V106-R110 WeakPolarHBondContact O-CB 3.39Å; V106-R110 PolarHBondContact O-N 3.46Å; V106-L118 HydrophobicContact CG1-CD2 4.21Å; V106-C121 HydrophobicContact CG2-CB 3.68Å; V106-H144 HydrophobicContact CG1-CB 3.69Å; V106-H144 VanDerWaalsContact CG1-CG 3.45Å; V106-L146 HydrophobicContact CG1-CD1 3.96Å
107	E	95.6	Very high	94.8	Very high	85 Å²	85	41.5 Å²	41.5	40%	0.397	23%	0.231	S	C	.	.	H	α-helix	trans	-59.1	-48.5	175.4	-176.4	172.7	-160.4	0	0	111.1	P103 R110 Y111	P103-E107 WeakPolarHBondContact O-CB 3.37Å; P103-E107 PolarHBondContact O-N 2.71Å; E107-R110 PolarHBondContact O-N 3.42Å; E107-Y111 VanDerWaalsContact O-CB 3.26Å; E107-Y111 WeakPolarHBondContact O-CB 3.22Å; E107-Y111 PolarHBondContact O-N 3.04Å
108	A	96.3	Very high	94.9	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-45.4	177.5	0	0	0	0	0	112.8	L78 G82 I86 V104 V105 R110 Y111 L112	L78-A108 HydrophobicContact CD2-CB 4Å; G82-A108 WeakPolarHBondContact O-CB 3.48Å; I86-A108 HydrophobicContact CG1-CB 3.68Å; V104-A108 VanDerWaalsContact O-CB 3.3Å; V104-A108 WeakPolarHBondContact O-CB 3.41Å; V104-A108 PolarHBondContact O-N 2.9Å; V105-A108 PolarHBondContact O-N 3.4Å; A108-R110 VanDerWaalsContact C-N 3.33Å; A108-R110 PolarHBondContact O-N 3.22Å; A108-Y111 PolarHBondContact O-N 3.01Å; A108-L112 VanDerWaalsContact O-CB 3.26Å; A108-L112 WeakPolarHBondContact O-CB 3.37Å; A108-L112 VanDerWaalsContact O-CG 3.29Å; A108-L112 WeakPolarHBondContact O-CG 3.4Å; A108-L112 PolarHBondContact O-N 2.91Å
109	A	96.4	Very high	95.1	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-41.3	178.1	0	0	0	0	0	111.8	I86 V105 V106 Q113 V114 A117 L118	I86-A109 HydrophobicContact CD1-CB 3.67Å; V105-A109 VanDerWaalsContact O-CB 3.27Å; V105-A109 WeakPolarHBondContact O-CB 3.43Å; V105-A109 PolarHBondContact O-N 3.27Å; V106-A109 PolarHBondContact O-N 3.31Å; A109-Q113 PolarHBondContact O-N 3.22Å; A109-V114 PolarHBondContact O-N 3.45Å; A109-A117 HydrophobicContact CB-CB 3.99Å; A109-L118 HydrophobicContact CB-CD2 3.62Å; A109-L118 HydrophobicContact CB-CG 3.76Å
110	R	95.3	Very high	95.4	Very high	78 Å²	78	39.8 Å²	39.8	29%	0.294	22%	0.217	S	C	.	.	H	α-helix	trans	-69.5	-46.6	178.3	-179.3	64.7	75.5	-167.6	5.5	111.6	V106 E107 A108 L112 Q113 E115 L118 H144	V106-R110 VanDerWaalsContact O-CB 3.31Å; V106-R110 WeakPolarHBondContact O-CB 3.39Å; V106-R110 PolarHBondContact O-N 3.46Å; E107-R110 PolarHBondContact O-N 3.42Å; A108-R110 VanDerWaalsContact C-N 3.33Å; A108-R110 PolarHBondContact O-N 3.22Å; R110-L112 VanDerWaalsContact C-N 3.33Å; R110-L112 PolarHBondContact O-N 3.34Å; R110-Q113 PolarHBondContact O-N 3.12Å; R110-Q113 VanDerWaalsContact O-N 3.17Å; R110-E115 IonicContact NH1-OE1 2.73Å; R110-E115 PolarHBondContact NH1-OE1 3.39Å; R110-E115 IonicContact NH1-OE2 3.08Å; R110-L118 HydrophobicContact CB-CD1 4.34Å; R110-L118 HydrophobicContact CB-CD2 4.15Å; R110-L118 VanDerWaalsContact CZ-CD1 3.49Å; R110-H144 PolarHBondContact NE-O 2.89Å; R110-H144 PolarHBondContact NH2-O 3.38Å
111	Y	95.3	Very high	95.6	Very high	85 Å²	85	35 Å²	35	33%	0.333	18%	0.184	S	C	.	.	H	α-helix	trans	-60.4	-44.9	178.7	-178.2	-85.5	0	0	0	111.3	Y56 L75 A77 L78 E107 A108 Q113	Y56-Y111 HydrophobicContact CE1-CE1 4.26Å; Y56-Y111 HydrophobicContact CE2-CE1 4.07Å; Y56-Y111 AromaticContact CZ-CE1 3.8Å; Y56-Y111 PolarHBondContact OH-OH 2.94Å; L75-Y111 HydrophobicContact CD2-CE1 4.28Å; A77-Y111 HydrophobicContact CB-CD2 3.99Å; A77-Y111 HydrophobicContact CB-CE2 3.58Å; L78-Y111 HydrophobicContact CD1-CD1 3.94Å; L78-Y111 HydrophobicContact CD1-CE1 4.38Å; L78-Y111 HydrophobicContact CD2-CD1 4Å; L78-Y111 HydrophobicContact CD2-CG 3.93Å; L78-Y111 HydrophobicContact CG-CD1 4.05Å; L78-Y111 HydrophobicContact CG-CE1 4.46Å; L78-Y111 HydrophobicContact CG-CG 4.42Å; E107-Y111 VanDerWaalsContact O-CB 3.26Å; E107-Y111 WeakPolarHBondContact O-CB 3.22Å; E107-Y111 PolarHBondContact O-N 3.04Å; A108-Y111 PolarHBondContact O-N 3.01Å; Y111-Q113 VanDerWaalsContact C-N 3.25Å; Y111-Q113 PolarHBondContact O-N 3.24Å
112	L	96.1	Very high	95.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	4	179.1	-61.1	174.9	0	0	0	113.4	S54 Y56 F57 L75 L78 L83 I86 A108 R110 V114	S54-L112 WeakPolarHBondContact CB-O 3.41Å; S54-L112 PolarHBondContact OG-O 3.01Å; Y56-L112 WeakPolarHBondContact CB-O 3.44Å; Y56-L112 HydrophobicContact CD1-CD2 3.67Å; Y56-L112 HydrophobicContact CE1-CD2 3.89Å; Y56-L112 HydrophobicContact CG-CD2 4.45Å; F57-L112 HydrophobicContact CE1-CD2 4.31Å; F57-L112 HydrophobicContact CE2-CD1 4.26Å; F57-L112 HydrophobicContact CE2-CD2 3.79Å; F57-L112 HydrophobicContact CE2-CG 4.44Å; F57-L112 HydrophobicContact CZ-CD1 4.45Å; F57-L112 HydrophobicContact CZ-CD2 3.57Å; L75-L112 HydrophobicContact CD1-CD2 4.39Å; L78-L112 HydrophobicContact CD1-CD1 3.99Å; L78-L112 HydrophobicContact CD1-CD2 4.02Å; L78-L112 HydrophobicContact CD1-CG 3.96Å; L83-L112 HydrophobicContact CD1-CD1 3.88Å; I86-L112 HydrophobicContact CB-CD1 4.24Å; I86-L112 HydrophobicContact CG2-CD1 3.83Å; A108-L112 VanDerWaalsContact O-CB 3.26Å; A108-L112 WeakPolarHBondContact O-CB 3.37Å; A108-L112 VanDerWaalsContact O-CG 3.29Å; A108-L112 WeakPolarHBondContact O-CG 3.4Å; A108-L112 PolarHBondContact O-N 2.91Å; R110-L112 VanDerWaalsContact C-N 3.33Å; R110-L112 PolarHBondContact O-N 3.34Å; L112-V114 VanDerWaalsContact C-N 3.27Å; L112-V114 HydrophobicContact CB-CG2 3.96Å; L112-V114 PolarHBondContact O-N 3.15Å
113	Q	95.8	Very high	95.7	Very high	90 Å²	90	42 Å²	42	42%	0.421	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	43.1	178.8	-57.2	179.1	6.6	0	0	113.3	D55 A109 R110 Y111 E115	D55-Q113 HydrophobicContact CB-CB 4.26Å; D55-Q113 VanDerWaalsContact CB-OE1 3.32Å; A109-Q113 PolarHBondContact O-N 3.22Å; R110-Q113 PolarHBondContact O-N 3.12Å; R110-Q113 VanDerWaalsContact O-N 3.17Å; Y111-Q113 VanDerWaalsContact C-N 3.25Å; Y111-Q113 PolarHBondContact O-N 3.24Å; Q113-E115 PolarHBondContact O-N 3.46Å
114	V	96.3	Very high	95.7	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.018	21%	0.209	C	C	.	.			trans	-96	78.6	176.9	-172	0	0	0	0	109	I86 F89 L90 A109 L112 A116 A117 L118	I86-V114 HydrophobicContact CG2-CB 4.49Å; I86-V114 HydrophobicContact CG2-CG2 3.88Å; F89-V114 HydrophobicContact CD1-CG1 4.02Å; F89-V114 HydrophobicContact CE1-CG1 3.74Å; L90-V114 HydrophobicContact CD2-CG1 3.88Å; L90-V114 HydrophobicContact CD2-CG2 4.23Å; A109-V114 PolarHBondContact O-N 3.45Å; L112-V114 VanDerWaalsContact C-N 3.27Å; L112-V114 HydrophobicContact CB-CG2 3.96Å; L112-V114 PolarHBondContact O-N 3.15Å; V114-A116 VanDerWaalsContact C-N 3.25Å; V114-A116 PolarHBondContact O-N 3.48Å; V114-A117 HydrophobicContact CB-CB 4.2Å; V114-A117 HydrophobicContact CG1-CB 3.74Å; V114-A117 WeakPolarHBondContact O-CB 3.49Å; V114-A117 PolarHBondContact O-N 3.33Å; V114-L118 PolarHBondContact O-N 2.83Å; V114-L118 VanDerWaalsContact O-N 3.14Å
115	E	94.3	Very high	95.7	Very high	105 Å²	105	41.7 Å²	41.7	49%	0.491	20%	0.198	S	C	.	.	H	α-helix	trans	-59.3	-33	-174.1	-68.1	-59.7	144.5	0	0	113.3	R110 Q113 A117 L118 S119	R110-E115 IonicContact NH1-OE1 2.73Å; R110-E115 PolarHBondContact NH1-OE1 3.39Å; R110-E115 IonicContact NH1-OE2 3.08Å; Q113-E115 PolarHBondContact O-N 3.46Å; E115-A117 PolarHBondContact O-N 3.34Å; E115-L118 PolarHBondContact O-N 2.91Å; E115-S119 PolarHBondContact O-N 3.36Å
116	A	94.6	Very high	95.6	Very high	55 Å²	55	43.1 Å²	43.1	46%	0.455	21%	0.211	S	C	.	.	H	α-helix	trans	-62.3	-41.8	175.3	0	0	0	0	0	112.1	F89 V114 S119 I120	F89-A116 HydrophobicContact CE1-CB 4.18Å; F89-A116 HydrophobicContact CZ-CB 3.92Å; V114-A116 VanDerWaalsContact C-N 3.25Å; V114-A116 PolarHBondContact O-N 3.48Å; A116-S119 PolarHBondContact O-N 3.22Å; A116-S119 PolarHBondContact O-OG 2.88Å; A116-I120 WeakPolarHBondContact O-CG1 3.27Å; A116-I120 PolarHBondContact O-N 3.24Å
117	A	95.8	Very high	95.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.4	-41.9	176.1	0	0	0	0	0	111.2	I86 F89 L95 A109 V114 E115 S119 I120 C121	I86-A117 HydrophobicContact CD1-CB 3.98Å; F89-A117 HydrophobicContact CD1-CB 3.87Å; F89-A117 HydrophobicContact CE1-CB 3.84Å; F89-A117 HydrophobicContact CZ-CB 4.44Å; L95-A117 HydrophobicContact CD2-CB 4.23Å; A109-A117 HydrophobicContact CB-CB 3.99Å; V114-A117 HydrophobicContact CB-CB 4.2Å; V114-A117 HydrophobicContact CG1-CB 3.74Å; V114-A117 WeakPolarHBondContact O-CB 3.49Å; V114-A117 PolarHBondContact O-N 3.33Å; E115-A117 PolarHBondContact O-N 3.34Å; A117-S119 VanDerWaalsContact C-N 3.32Å; A117-S119 PolarHBondContact O-N 2.95Å; A117-I120 WeakPolarHBondContact O-CB 3.44Å; A117-I120 PolarHBondContact O-N 3.45Å; A117-I120 VanDerWaalsContact O-N 3.14Å; A117-C121 PolarHBondContact O-N 3.1Å; A117-C121 PolarHBondContact O-SG 3.34Å; A117-C121 VanDerWaalsContact O-SG 3.41Å
118	L	95.4	Very high	95.3	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-58.7	-42.3	174.7	-72.9	175.9	0	0	0	112.3	V106 A109 R110 V114 E115 I120 C121 E122 L146	V106-L118 HydrophobicContact CG1-CD2 4.21Å; A109-L118 HydrophobicContact CB-CD2 3.62Å; A109-L118 HydrophobicContact CB-CG 3.76Å; R110-L118 HydrophobicContact CB-CD1 4.34Å; R110-L118 HydrophobicContact CB-CD2 4.15Å; R110-L118 VanDerWaalsContact CZ-CD1 3.49Å; V114-L118 PolarHBondContact O-N 2.83Å; V114-L118 VanDerWaalsContact O-N 3.14Å; E115-L118 PolarHBondContact O-N 2.91Å; L118-I120 VanDerWaalsContact C-N 3.27Å; L118-I120 PolarHBondContact O-N 2.83Å; L118-C121 WeakPolarHBondContact O-CB 3.44Å; L118-C121 PolarHBondContact O-N 3.49Å; L118-E122 WeakPolarHBondContact O-CB 3.42Å; L118-E122 PolarHBondContact O-N 3.14Å; L118-L146 HydrophobicContact CD2-CD2 4.4Å
119	S	95.4	Very high	95.3	Very high	64 Å²	64	47.9 Å²	47.9	45%	0.448	25%	0.245	S	C	.	.	H	α-helix	trans	-62.3	-34.8	177.5	78.2	0	0	0	0	112.6	E115 A116 A117 R123	E115-S119 PolarHBondContact O-N 3.36Å; A116-S119 PolarHBondContact O-N 3.22Å; A116-S119 PolarHBondContact O-OG 2.88Å; A117-S119 VanDerWaalsContact C-N 3.32Å; A117-S119 PolarHBondContact O-N 2.95Å; S119-R123 WeakPolarHBondContact O-CB 3.09Å; S119-R123 PolarHBondContact O-N 3.36Å
120	I	95.7	Very high	95.1	Very high	46 Å²	46	50.7 Å²	50.7	24%	0.236	26%	0.263	C	S	.	.	H	α-helix	trans	-70.3	-44.6	175.7	-64.9	166.3	0	0	0	110.1	F89 L95 I97 A116 A117 L118 E122 R123 F124	F89-I120 HydrophobicContact CD2-CD1 4.45Å; F89-I120 HydrophobicContact CE2-CD1 3.63Å; F89-I120 HydrophobicContact CZ-CD1 4.09Å; L95-I120 HydrophobicContact CB-CD1 4.44Å; L95-I120 HydrophobicContact CB-CG2 4.43Å; L95-I120 HydrophobicContact CD2-CB 4.13Å; L95-I120 HydrophobicContact CD2-CG2 3.97Å; I97-I120 HydrophobicContact CD1-CG2 4.1Å; A116-I120 WeakPolarHBondContact O-CG1 3.27Å; A116-I120 PolarHBondContact O-N 3.24Å; A117-I120 WeakPolarHBondContact O-CB 3.44Å; A117-I120 PolarHBondContact O-N 3.45Å; A117-I120 VanDerWaalsContact O-N 3.14Å; L118-I120 VanDerWaalsContact C-N 3.27Å; L118-I120 PolarHBondContact O-N 2.83Å; I120-E122 VanDerWaalsContact C-N 3.33Å; I120-E122 PolarHBondContact O-N 3.04Å; I120-R123 PolarHBondContact O-N 3.34Å; I120-F124 WeakPolarHBondContact O-CB 3.49Å; I120-F124 PolarHBondContact O-N 3.49Å
121	C	95.9	Very high	94.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-43.4	174.6	-67.7	0	0	0	0	111.7	L102 V106 A117 L118 F124 M125	L102-C121 HydrophobicContact CD1-CB 3.94Å; V106-C121 HydrophobicContact CG2-CB 3.68Å; A117-C121 PolarHBondContact O-N 3.1Å; A117-C121 PolarHBondContact O-SG 3.34Å; A117-C121 VanDerWaalsContact O-SG 3.41Å; L118-C121 WeakPolarHBondContact O-CB 3.44Å; L118-C121 PolarHBondContact O-N 3.49Å; C121-F124 PolarHBondContact O-N 3.45Å; C121-M125 PolarHBondContact O-N 2.98Å
122	E	95.3	Very high	94.7	Very high	30 Å²	30	50 Å²	50	14%	0.14	27%	0.273	C	S	.	.	H	α-helix	trans	-61.5	-46.2	178.2	-166.4	176.7	-144.4	0	0	111.4	L118 I120 M125 A126 L146 L147 N148 A149	L118-E122 WeakPolarHBondContact O-CB 3.42Å; L118-E122 PolarHBondContact O-N 3.14Å; I120-E122 VanDerWaalsContact C-N 3.33Å; I120-E122 PolarHBondContact O-N 3.04Å; E122-M125 PolarHBondContact O-N 3.41Å; E122-A126 PolarHBondContact O-N 2.99Å; E122-L146 HydrophobicContact CG-CB 4.35Å; E122-L146 VanDerWaalsContact OE1-C 3.26Å; E122-L147 PolarHBondContact OE1-N 3.41Å; E122-N148 HydrophobicContact CG-CB 4.2Å; E122-N148 WeakPolarHBondContact OE1-CA 3.49Å; E122-N148 WeakPolarHBondContact OE1-CB 3.48Å; E122-N148 PolarHBondContact OE1-N 3.35Å; E122-N148 PolarHBondContact OE1-ND2 3.03Å; E122-N148 PolarHBondContact OE2-ND2 2.83Å; E122-A149 HydrophobicContact CG-CB 3.59Å; E122-A149 PolarHBondContact OE1-N 2.92Å
123	R	95.2	Very high	94.5	Very high	167 Å²	167	51.3 Å²	51.3	63%	0.63	28%	0.28	S	S	*	.	H	α-helix	trans	-62.6	-43.4	175.1	-172.8	174.9	73.2	173.8	3.4	112.2	S119 I120 M125 A126 D127	S119-R123 WeakPolarHBondContact O-CB 3.09Å; S119-R123 PolarHBondContact O-N 3.36Å; I120-R123 PolarHBondContact O-N 3.34Å; R123-M125 VanDerWaalsContact C-N 3.3Å; R123-M125 PolarHBondContact O-N 3.39Å; R123-A126 PolarHBondContact O-N 2.98Å; R123-D127 WeakPolarHBondContact CG-OD2 3.3Å; R123-D127 WeakPolarHBondContact O-CB 3.2Å; R123-D127 PolarHBondContact O-N 3.39Å
124	F	95.3	Very high	94.5	Very high	61 Å²	61	47 Å²	47	27%	0.268	26%	0.26	S	S	.	.	H	α-helix	trans	-59.5	-41.4	177	174.1	-94.1	0	0	0	112.2	I97 L102 I120 C121 G128	I97-F124 HydrophobicContact CD1-CB 3.36Å; I97-F124 HydrophobicContact CD1-CD1 4.04Å; I97-F124 HydrophobicContact CD1-CD2 3.68Å; I97-F124 HydrophobicContact CD1-CE2 4.47Å; I97-F124 HydrophobicContact CD1-CG 3.42Å; I97-F124 VanDerWaalsContact CD1-CG 3.42Å; I97-F124 HydrophobicContact CG1-CB 4.47Å; I97-F124 HydrophobicContact CG1-CD2 3.9Å; I97-F124 HydrophobicContact CG1-CE2 4.25Å; I97-F124 HydrophobicContact CG1-CG 4.05Å; L102-F124 HydrophobicContact CD1-CD1 4.12Å; L102-F124 HydrophobicContact CD2-CD1 4.2Å; L102-F124 HydrophobicContact CD2-CE1 4.27Å; I120-F124 WeakPolarHBondContact O-CB 3.49Å; I120-F124 PolarHBondContact O-N 3.49Å; C121-F124 PolarHBondContact O-N 3.45Å; F124-G128 WeakPolarHBondContact O-CA 3.28Å; F124-G128 PolarHBondContact O-N 2.77Å
125	M	95.4	Very high	94.4	Very high	1 Å²	1	47 Å²	47	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-52.6	173.7	-78.6	-175.9	-77.5	0	0	111.1	L102 C121 E122 R123 D127 G128 L129 Y137 L140 L146 A149	L102-M125 HydrophobicContact CD2-CG 3.56Å; L102-M125 HydrophobicContact CD2-SD 3.94Å; C121-M125 PolarHBondContact O-N 2.98Å; E122-M125 PolarHBondContact O-N 3.41Å; R123-M125 VanDerWaalsContact C-N 3.3Å; R123-M125 PolarHBondContact O-N 3.39Å; M125-D127 PolarHBondContact O-N 3.47Å; M125-G128 PolarHBondContact O-N 3.43Å; M125-L129 WeakPolarHBondContact O-CG 3.39Å; M125-L129 PolarHBondContact O-N 2.94Å; M125-Y137 HydrophobicContact CB-CD2 4.05Å; M125-Y137 HydrophobicContact CB-CE2 4.45Å; M125-Y137 HydrophobicContact CB-CG 4.37Å; M125-Y137 HydrophobicContact CG-CD1 4.17Å; M125-Y137 HydrophobicContact CG-CD2 3.97Å; M125-Y137 HydrophobicContact CG-CE1 4.44Å; M125-Y137 HydrophobicContact CG-CE2 4.23Å; M125-Y137 HydrophobicContact CG-CG 3.95Å; M125-Y137 HydrophobicContact SD-CD1 4.37Å; M125-Y137 HydrophobicContact SD-CG 4.29Å; M125-L140 HydrophobicContact SD-CD2 4.1Å; M125-L146 HydrophobicContact CE-CD1 3.27Å; M125-A149 HydrophobicContact CB-CB 3.95Å; M125-A149 HydrophobicContact CE-CB 4.06Å; M125-A149 HydrophobicContact SD-CB 4.41Å
126	A	94.8	Very high	94.4	Very high	32 Å²	32	47 Å²	47	26%	0.264	26%	0.256	S	S	.	.	H	α-helix	trans	-59.8	-44	-176.4	0	0	0	0	0	112.8	E122 R123 A152	E122-A126 PolarHBondContact O-N 2.99Å; R123-A126 PolarHBondContact O-N 2.98Å; A126-A152 HydrophobicContact CB-CB 4.03Å
127	D	94.1	Very high	94.5	Very high	130 Å²	130	44.6 Å²	44.6	70%	0.695	24%	0.235	S	C	*	.	H	α-helix	trans	-75.3	-27.6	-179.9	-66.7	-17.6	0	0	0	112.2	R123 M125	R123-D127 WeakPolarHBondContact CG-OD2 3.3Å; R123-D127 WeakPolarHBondContact O-CB 3.2Å; R123-D127 PolarHBondContact O-N 3.39Å; M125-D127 PolarHBondContact O-N 3.47Å
128	G	93.3	Very high	94.5	Very high	30 Å²	30	44.6 Å²	44.6	31%	0.309	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	10.8	-176.2	0	0	0	0	0	115.8	F124 M125 T130 N133	F124-G128 WeakPolarHBondContact O-CA 3.28Å; F124-G128 PolarHBondContact O-N 2.77Å; M125-G128 PolarHBondContact O-N 3.43Å; G128-T130 PolarHBondContact O-N 3.43Å; G128-N133 PolarHBondContact O-ND2 3.44Å
129	L	95.2	Very high	94.6	Very high	25 Å²	25	46.8 Å²	46.8	13%	0.131	25%	0.247	C	C	.	.			trans	-70	121.8	-174.3	-76.7	166.1	0	0	0	113.7	M125 C134 Y137 A152 A153 T156	M125-L129 WeakPolarHBondContact O-CG 3.39Å; M125-L129 PolarHBondContact O-N 2.94Å; L129-C134 HydrophobicContact CD2-CB 4.01Å; L129-Y137 HydrophobicContact CD2-CD2 3.95Å; L129-A152 HydrophobicContact CD1-CB 3.7Å; L129-A152 VanDerWaalsContact CD1-O 3.29Å; L129-A152 WeakPolarHBondContact CD1-O 3.32Å; L129-A153 HydrophobicContact CD1-CB 4.47Å; L129-A153 HydrophobicContact CD2-CB 3.96Å; L129-T156 HydrophobicContact CB-CG2 4.19Å
130	T	93.3	Very high	94.6	Very high	59 Å²	59	44.2 Å²	44.2	36%	0.362	23%	0.228	S	C	.	.			trans	-122	177.2	174.5	72	0	0	0	0	110.8	G128 D132 N133 C134	G128-T130 PolarHBondContact O-N 3.43Å; T130-D132 PolarHBondContact O-N 2.92Å; T130-D132 PolarHBondContact OG1-N 3.42Å; T130-N133 PolarHBondContact N-OD1 2.98Å; T130-N133 PolarHBondContact O-OD1 3.32Å; T130-N133 VanDerWaalsContact OG1-CG 3.29Å; T130-N133 PolarHBondContact OG1-N 2.81Å; T130-N133 PolarHBondContact OG1-ND2 2.96Å; T130-N133 PolarHBondContact OG1-OD1 3.32Å; T130-C134 VanDerWaalsContact O-CB 3.25Å; T130-C134 WeakPolarHBondContact O-CB 3.4Å; T130-C134 PolarHBondContact O-N 2.9Å
131	A	90.3	Very high	94.6	Very high	19 Å²	19	42 Å²	42	16%	0.157	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-36	173.8	0	0	0	0	0	110.8	C134 K160 L164	A131-C134 PolarHBondContact O-SG 3.25Å; A131-K160 HydrophobicContact CB-CD 3.89Å; A131-L164 VanDerWaalsContact O-CD2 3.28Å; A131-L164 WeakPolarHBondContact O-CD2 3.35Å
132	D	90.6	Very high	94.6	Very high	129 Å²	129	44.6 Å²	44.6	69%	0.69	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-29.1	-169.6	-49.6	-61.9	0	0	0	113.1	T130	T130-D132 PolarHBondContact O-N 2.92Å; T130-D132 PolarHBondContact OG1-N 3.42Å
133	N	93.1	Very high	94.6	Very high	28 Å²	28	49.6 Å²	49.6	15%	0.15	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-11.4	-176.2	69.1	12.8	0	0	0	114.9	G128 T130 C135 Y136 Y137	G128-N133 PolarHBondContact O-ND2 3.44Å; T130-N133 PolarHBondContact N-OD1 2.98Å; T130-N133 PolarHBondContact O-OD1 3.32Å; T130-N133 VanDerWaalsContact OG1-CG 3.29Å; T130-N133 PolarHBondContact OG1-N 2.81Å; T130-N133 PolarHBondContact OG1-ND2 2.96Å; T130-N133 PolarHBondContact OG1-OD1 3.32Å; N133-C135 PolarHBondContact O-N 3.4Å; N133-Y136 WeakPolarHBondContact O-CB 3.5Å; N133-Y136 PolarHBondContact O-N 2.97Å; N133-Y136 VanDerWaalsContact O-N 3.11Å; N133-Y137 HydrophobicContact CB-CD2 4.5Å; N133-Y137 HydrophobicContact CB-CE2 4.31Å; N133-Y137 WeakPolarHBondContact ND2-CE2 3.1Å; N133-Y137 PolarHBondContact O-N 2.92Å
134	C	94.9	Very high	94.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-40.8	-170	59.1	0	0	0	0	114	L129 T130 A131 A138 T156 I157	L129-C134 HydrophobicContact CD2-CB 4.01Å; T130-C134 VanDerWaalsContact O-CB 3.25Å; T130-C134 WeakPolarHBondContact O-CB 3.4Å; T130-C134 PolarHBondContact O-N 2.9Å; A131-C134 PolarHBondContact O-SG 3.25Å; C134-A138 WeakPolarHBondContact O-CB 3.37Å; C134-A138 PolarHBondContact O-N 3.15Å; C134-T156 HydrophobicContact CB-CG2 4.08Å; C134-I157 HydrophobicContact CB-CG1 3.86Å
135	C	95.2	Very high	94.4	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-67.9	-38	177	-63.2	0	0	0	0	111.8	N133 A138 N139 V171 L175	N133-C135 PolarHBondContact O-N 3.4Å; C135-A138 PolarHBondContact O-N 3.45Å; C135-N139 PolarHBondContact O-N 2.99Å; C135-N139 VanDerWaalsContact O-N 3.08Å; C135-V171 HydrophobicContact CB-CG1 3.58Å; C135-L175 HydrophobicContact CB-CD1 4.19Å
136	Y	94.3	Very high	94.4	Very high	105 Å²	105	47.1 Å²	47.1	41%	0.412	25%	0.247	S	C	.	.	H	α-helix	trans	-64.9	-48.4	177	174.4	-106.3	0	0	0	111.5	P103 N133 A138 N139 L140	P103-Y136 WeakPolarHBondContact CG-OH 3.32Å; N133-Y136 WeakPolarHBondContact O-CB 3.5Å; N133-Y136 PolarHBondContact O-N 2.97Å; N133-Y136 VanDerWaalsContact O-N 3.11Å; Y136-A138 VanDerWaalsContact C-N 3.32Å; Y136-A138 PolarHBondContact O-N 3.21Å; Y136-N139 PolarHBondContact O-N 3.26Å; Y136-L140 PolarHBondContact O-N 3.07Å
137	Y	95.6	Very high	94.3	Very high	5 Å²	5	51.3 Å²	51.3	2%	0.02	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-34	176	-70.7	-10.4	0	0	0	112.6	L102 M125 L129 N133 L140 A141	L102-Y137 HydrophobicContact CD2-CD1 4.21Å; L102-Y137 HydrophobicContact CD2-CE1 3.69Å; M125-Y137 HydrophobicContact CB-CD2 4.05Å; M125-Y137 HydrophobicContact CB-CE2 4.45Å; M125-Y137 HydrophobicContact CB-CG 4.37Å; M125-Y137 HydrophobicContact CG-CD1 4.17Å; M125-Y137 HydrophobicContact CG-CD2 3.97Å; M125-Y137 HydrophobicContact CG-CE1 4.44Å; M125-Y137 HydrophobicContact CG-CE2 4.23Å; M125-Y137 HydrophobicContact CG-CG 3.95Å; M125-Y137 HydrophobicContact SD-CD1 4.37Å; M125-Y137 HydrophobicContact SD-CG 4.29Å; L129-Y137 HydrophobicContact CD2-CD2 3.95Å; N133-Y137 HydrophobicContact CB-CD2 4.5Å; N133-Y137 HydrophobicContact CB-CE2 4.31Å; N133-Y137 WeakPolarHBondContact ND2-CE2 3.1Å; N133-Y137 PolarHBondContact O-N 2.92Å; Y137-L140 PolarHBondContact O-N 3.45Å; Y137-A141 WeakPolarHBondContact O-CB 3.31Å; Y137-A141 PolarHBondContact O-N 2.99Å
138	A	97	Very high	94.3	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-43.4	172.6	0	0	0	0	0	111.8	C134 C135 Y136 E142 L150 A153 I157 L175 N176	C134-A138 WeakPolarHBondContact O-CB 3.37Å; C134-A138 PolarHBondContact O-N 3.15Å; C135-A138 PolarHBondContact O-N 3.45Å; Y136-A138 VanDerWaalsContact C-N 3.32Å; Y136-A138 PolarHBondContact O-N 3.21Å; A138-E142 WeakPolarHBondContact O-CB 3.28Å; A138-E142 PolarHBondContact O-N 3.01Å; A138-L150 HydrophobicContact CB-CD1 4.33Å; A138-L150 VanDerWaalsContact O-CD1 3.28Å; A138-L150 WeakPolarHBondContact O-CD1 3.41Å; A138-A153 HydrophobicContact CB-CB 3.88Å; A138-I157 HydrophobicContact CB-CD1 3.89Å; A138-L175 HydrophobicContact CB-CD1 3.95Å; A138-N176 VanDerWaalsContact C-ND2 3.34Å; A138-N176 PolarHBondContact O-ND2 3.44Å
139	N	96.1	Very high	94.4	Very high	49 Å²	49	48.7 Å²	48.7	26%	0.262	24%	0.244	S	C	.	.	H	α-helix	trans	-66	-44.1	176.8	-71.9	-12.7	0	0	0	112.4	C135 Y136 E142 Q143 G174 N176	C135-N139 PolarHBondContact O-N 2.99Å; C135-N139 VanDerWaalsContact O-N 3.08Å; Y136-N139 PolarHBondContact O-N 3.26Å; N139-E142 PolarHBondContact O-N 3.24Å; N139-Q143 WeakPolarHBondContact O-CB 3.35Å; N139-Q143 PolarHBondContact O-N 3.03Å; N139-G174 PolarHBondContact ND2-O 3.35Å; N139-N176 WeakPolarHBondContact CA-ND2 3.34Å; N139-N176 PolarHBondContact N-ND2 2.93Å; N139-N176 WeakPolarHBondContact OD1-CB 3.37Å; N139-N176 PolarHBondContact OD1-N 3.43Å; N139-N176 PolarHBondContact OD1-ND2 3.2Å
140	L	95.3	Very high	94.5	Very high	10 Å²	10	48.3 Å²	48.3	5%	0.052	24%	0.242	C	C	.	.	H	α-helix	trans	-64.4	-43	177.3	-174.6	66.6	0	0	0	111.5	L102 P103 M125 Y136 Y137 Q143 H144	L102-L140 HydrophobicContact CD2-CD2 3.82Å; L102-L140 HydrophobicContact CG-CD2 3.95Å; P103-L140 HydrophobicContact CB-CD1 4.15Å; P103-L140 HydrophobicContact CG-CD2 4.44Å; M125-L140 HydrophobicContact SD-CD2 4.1Å; Y136-L140 PolarHBondContact O-N 3.07Å; Y137-L140 PolarHBondContact O-N 3.45Å; L140-Q143 PolarHBondContact O-N 3.41Å; L140-H144 PolarHBondContact O-CD2 3.34Å; L140-H144 PolarHBondContact O-N 3.27Å; L140-H144 VanDerWaalsContact O-N 3.15Å
141	A	96.4	Very high	94.6	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-64.5	-41.7	178.4	0	0	0	0	0	111.7	Y137 H144 F145 L146 A149 L150	Y137-A141 WeakPolarHBondContact O-CB 3.31Å; Y137-A141 PolarHBondContact O-N 2.99Å; A141-H144 CarbonylContact O-C 3.46Å; A141-H144 PolarHBondContact O-N 2.84Å; A141-F145 CarbonylContact O-C 3.59Å; A141-F145 WeakPolarHBondContact O-CA 3.4Å; A141-F145 PolarHBondContact O-N 3.02Å; A141-L146 HydrophobicContact CB-CB 4.09Å; A141-L146 PolarHBondContact O-N 2.91Å; A141-A149 HydrophobicContact CB-CB 4.13Å; A141-L150 HydrophobicContact CB-CB 3.95Å; A141-L150 HydrophobicContact CB-CD1 4.28Å
142	E	96.4	Very high	94.9	Very high	54 Å²	54	51.1 Å²	51.1	25%	0.252	25%	0.252	S	S	.	.	H	α-helix	trans	-64.8	-45.2	175.3	179.6	59.5	-167.2	0	0	111.6	A138 N139 H144 F145 L150 N176 P178	A138-E142 WeakPolarHBondContact O-CB 3.28Å; A138-E142 PolarHBondContact O-N 3.01Å; N139-E142 PolarHBondContact O-N 3.24Å; E142-H144 PolarHBondContact O-N 2.92Å; E142-F145 PolarHBondContact O-N 2.77Å; E142-L150 HydrophobicContact CB-CD1 4.08Å; E142-L150 WeakPolarHBondContact OE2-CD2 3.35Å; E142-N176 HydrophobicContact CB-CB 4.5Å; E142-N176 HydrophobicContact CG-CB 4.3Å; E142-P178 HydrophobicContact CG-CG 4.39Å; E142-P178 WeakPolarHBondContact OE1-CG 3.43Å
143	Q	94.3	Very high	95.2	Very high	136 Å²	136	45 Å²	45	64%	0.636	22%	0.219	S	C	*	.	H	α-helix	trans	-58.2	-34.7	179.4	-179.7	177.4	-21.2	0	0	112.7	N139 L140	N139-Q143 WeakPolarHBondContact O-CB 3.35Å; N139-Q143 PolarHBondContact O-N 3.03Å; L140-Q143 PolarHBondContact O-N 3.41Å
144	H	93.4	Very high	95.4	Very high	20 Å²	20	44.5 Å²	44.5	9%	0.093	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	11.9	-178.6	-64.2	-76.9	0	0	0	114.2	V106 R110 L140 A141 E142 L146	V106-H144 HydrophobicContact CG1-CB 3.69Å; V106-H144 VanDerWaalsContact CG1-CG 3.45Å; R110-H144 PolarHBondContact NE-O 2.89Å; R110-H144 PolarHBondContact NH2-O 3.38Å; L140-H144 PolarHBondContact O-CD2 3.34Å; L140-H144 PolarHBondContact O-N 3.27Å; L140-H144 VanDerWaalsContact O-N 3.15Å; A141-H144 CarbonylContact O-C 3.46Å; A141-H144 PolarHBondContact O-N 2.84Å; E142-H144 PolarHBondContact O-N 2.92Å; H144-L146 HydrophobicContact CB-CD1 4.29Å; H144-L146 HydrophobicContact CB-CG 4.21Å; H144-L146 PolarHBondContact O-N 3.22Å
145	F	93.8	Very high	95.4	Very high	149 Å²	149	48.9 Å²	48.9	65%	0.654	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	46	178.9	-53.2	-81.3	0	0	0	114.7	A141 E142 L147	A141-F145 CarbonylContact O-C 3.59Å; A141-F145 WeakPolarHBondContact O-CA 3.4Å; A141-F145 PolarHBondContact O-N 3.02Å; E142-F145 PolarHBondContact O-N 2.77Å; F145-L147 PolarHBondContact O-N 3.31Å
146	L	94.3	Very high	95.4	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.037	24%	0.243	C	C	.	.			trans	-96.8	83.6	178.2	-58.6	175.1	0	0	0	110.2	V106 L118 E122 M125 A141 H144 N148 A149 L150	V106-L146 HydrophobicContact CG1-CD1 3.96Å; L118-L146 HydrophobicContact CD2-CD2 4.4Å; E122-L146 HydrophobicContact CG-CB 4.35Å; E122-L146 VanDerWaalsContact OE1-C 3.26Å; M125-L146 HydrophobicContact CE-CD1 3.27Å; A141-L146 HydrophobicContact CB-CB 4.09Å; A141-L146 PolarHBondContact O-N 2.91Å; H144-L146 HydrophobicContact CB-CD1 4.29Å; H144-L146 HydrophobicContact CB-CG 4.21Å; H144-L146 PolarHBondContact O-N 3.22Å; L146-N148 PolarHBondContact O-N 2.94Å; L146-A149 HydrophobicContact CB-CB 4.31Å; L146-A149 PolarHBondContact O-N 3.41Å; L146-L150 VanDerWaalsContact O-CB 3.32Å; L146-L150 WeakPolarHBondContact O-CB 3.22Å; L146-L150 PolarHBondContact O-N 3.24Å
147	L	93.3	Very high	95.5	Very high	120 Å²	120	44.9 Å²	44.9	63%	0.628	22%	0.223	S	C	*	.	H	α-helix	trans	-64.3	-38.8	-165.7	-61.3	177.2	0	0	0	114.1	E122 F145 L150 E151	E122-L147 PolarHBondContact OE1-N 3.41Å; F145-L147 PolarHBondContact O-N 3.31Å; L147-L150 PolarHBondContact O-N 2.89Å; L147-E151 WeakPolarHBondContact O-CB 3.42Å; L147-E151 PolarHBondContact O-N 3.11Å
148	N	93.9	Very high	95.4	Very high	104 Å²	104	44.9 Å²	44.9	56%	0.556	22%	0.224	S	C	*	.	H	α-helix	trans	-71.7	-41.3	-178.9	-52.5	-53.7	0	0	0	110.7	E122 L146 L150 E151 A152	E122-N148 HydrophobicContact CG-CB 4.2Å; E122-N148 WeakPolarHBondContact OE1-CA 3.49Å; E122-N148 WeakPolarHBondContact OE1-CB 3.48Å; E122-N148 PolarHBondContact OE1-N 3.35Å; E122-N148 PolarHBondContact OE1-ND2 3.03Å; E122-N148 PolarHBondContact OE2-ND2 2.83Å; L146-N148 PolarHBondContact O-N 2.94Å; N148-L150 VanDerWaalsContact C-N 3.34Å; N148-E151 PolarHBondContact O-N 2.92Å; N148-A152 WeakPolarHBondContact O-CB 3.31Å; N148-A152 PolarHBondContact O-N 3.19Å
149	A	95.5	Very high	95.2	Very high	2 Å²	2	51.3 Å²	51.3	2%	0.017	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-40.3	174.1	0	0	0	0	0	111.4	E122 M125 A141 L146 A152 A153	E122-A149 HydrophobicContact CG-CB 3.59Å; E122-A149 PolarHBondContact OE1-N 2.92Å; M125-A149 HydrophobicContact CB-CB 3.95Å; M125-A149 HydrophobicContact CE-CB 4.06Å; M125-A149 HydrophobicContact SD-CB 4.41Å; A141-A149 HydrophobicContact CB-CB 4.13Å; L146-A149 HydrophobicContact CB-CB 4.31Å; L146-A149 PolarHBondContact O-N 3.41Å; A149-A152 PolarHBondContact O-N 3.21Å; A149-A153 VanDerWaalsContact O-CB 3.24Å; A149-A153 WeakPolarHBondContact O-CB 3.16Å; A149-A153 PolarHBondContact O-N 2.83Å
150	L	96.8	Very high	95	Very high	16 Å²	16	52.4 Å²	52.4	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-46.8	176.6	-175	67.1	0	0	0	111.6	A138 A141 E142 L146 L147 N148 A153 N154 S179	A138-L150 HydrophobicContact CB-CD1 4.33Å; A138-L150 VanDerWaalsContact O-CD1 3.28Å; A138-L150 WeakPolarHBondContact O-CD1 3.41Å; A141-L150 HydrophobicContact CB-CB 3.95Å; A141-L150 HydrophobicContact CB-CD1 4.28Å; E142-L150 HydrophobicContact CB-CD1 4.08Å; E142-L150 WeakPolarHBondContact OE2-CD2 3.35Å; L146-L150 VanDerWaalsContact O-CB 3.32Å; L146-L150 WeakPolarHBondContact O-CB 3.22Å; L146-L150 PolarHBondContact O-N 3.24Å; L147-L150 PolarHBondContact O-N 2.89Å; N148-L150 VanDerWaalsContact C-N 3.34Å; L150-A153 PolarHBondContact O-N 2.7Å; L150-N154 WeakPolarHBondContact O-CB 3.34Å; L150-N154 PolarHBondContact O-N 3.06Å; L150-N154 PolarHBondContact O-ND2 3.45Å; L150-S179 VanDerWaalsContact CD1-OG 3.3Å; L150-S179 WeakPolarHBondContact CD1-OG 3.41Å
151	E	96.2	Very high	95	Very high	115 Å²	115	52 Å²	52	54%	0.537	25%	0.252	S	S	.	.	H	α-helix	trans	-62.1	-47.8	177.1	-170.7	-176.4	166.5	0	0	111.4	L147 N148 A153 N154 Q155	L147-E151 WeakPolarHBondContact O-CB 3.42Å; L147-E151 PolarHBondContact O-N 3.11Å; N148-E151 PolarHBondContact O-N 2.92Å; E151-A153 VanDerWaalsContact C-N 3.29Å; E151-A153 PolarHBondContact O-N 2.82Å; E151-N154 PolarHBondContact O-N 3.24Å; E151-Q155 WeakPolarHBondContact O-CG 3.39Å; E151-Q155 PolarHBondContact O-N 3.44Å; E151-Q155 PolarHBondContact OE1-NE2 3.35Å
152	A	96.3	Very high	94.7	Very high	23 Å²	23	53.5 Å²	53.5	19%	0.19	26%	0.263	C	S	.	.	H	α-helix	trans	-59.7	-41	177.6	0	0	0	0	0	111.9	A126 L129 N148 A149 T156	A126-A152 HydrophobicContact CB-CB 4.03Å; L129-A152 HydrophobicContact CD1-CB 3.7Å; L129-A152 VanDerWaalsContact CD1-O 3.29Å; L129-A152 WeakPolarHBondContact CD1-O 3.32Å; N148-A152 WeakPolarHBondContact O-CB 3.31Å; N148-A152 PolarHBondContact O-N 3.19Å; A149-A152 PolarHBondContact O-N 3.21Å; A152-T156 WeakPolarHBondContact O-CB 3.4Å; A152-T156 PolarHBondContact O-N 2.87Å; A152-T156 PolarHBondContact O-OG1 3.08Å
153	A	97.1	Very high	94.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-48.3	176.1	0	0	0	0	0	110.9	L129 A138 A149 L150 E151 Q155 T156 I157	L129-A153 HydrophobicContact CD1-CB 4.47Å; L129-A153 HydrophobicContact CD2-CB 3.96Å; A138-A153 HydrophobicContact CB-CB 3.88Å; A149-A153 VanDerWaalsContact O-CB 3.24Å; A149-A153 WeakPolarHBondContact O-CB 3.16Å; A149-A153 PolarHBondContact O-N 2.83Å; L150-A153 PolarHBondContact O-N 2.7Å; E151-A153 VanDerWaalsContact C-N 3.29Å; E151-A153 PolarHBondContact O-N 2.82Å; A153-Q155 PolarHBondContact O-N 2.93Å; A153-T156 CarbonylContact O-C 3.52Å; A153-T156 WeakPolarHBondContact O-CB 3.05Å; A153-T156 PolarHBondContact O-N 3.44Å; A153-T156 VanDerWaalsContact O-N 3.09Å; A153-I157 VanDerWaalsContact O-CG1 3.25Å; A153-I157 WeakPolarHBondContact O-CG1 2.94Å; A153-I157 PolarHBondContact O-N 2.95Å
154	N	96.9	Very high	94.5	Very high	18 Å²	18	47.2 Å²	47.2	10%	0.096	24%	0.237	C	C	.	.	H	α-helix	trans	-59.6	-42.8	178	-71	-22	0	0	0	112.7	L150 E151 T156 I157 A158 S179 A182 V183	L150-N154 WeakPolarHBondContact O-CB 3.34Å; L150-N154 PolarHBondContact O-N 3.06Å; L150-N154 PolarHBondContact O-ND2 3.45Å; E151-N154 PolarHBondContact O-N 3.24Å; N154-T156 VanDerWaalsContact C-N 3.32Å; N154-T156 PolarHBondContact O-N 3.42Å; N154-I157 PolarHBondContact O-N 2.9Å; N154-A158 WeakPolarHBondContact O-CB 3.48Å; N154-A158 PolarHBondContact O-N 3Å; N154-S179 WeakPolarHBondContact OD1-CA 3.32Å; N154-S179 WeakPolarHBondContact OD1-CB 3.49Å; N154-S179 PolarHBondContact OD1-OG 2.92Å; N154-S179 VanDerWaalsContact OD1-OG 3.11Å; N154-A182 HydrophobicContact CB-CB 4.36Å; N154-V183 HydrophobicContact CB-CG2 4.4Å
155	Q	95.1	Very high	94.4	Very high	92 Å²	92	47.9 Å²	47.9	43%	0.43	24%	0.241	S	C	.	.	H	α-helix	trans	-63.4	-39.9	175.1	-69.3	179.9	16.2	0	0	111.7	E151 A153 K159	E151-Q155 WeakPolarHBondContact O-CG 3.39Å; E151-Q155 PolarHBondContact O-N 3.44Å; E151-Q155 PolarHBondContact OE1-NE2 3.35Å; A153-Q155 PolarHBondContact O-N 2.93Å; Q155-K159 WeakPolarHBondContact O-CB 3.41Å; Q155-K159 VanDerWaalsContact O-CG 3.28Å; Q155-K159 WeakPolarHBondContact O-CG 3.34Å; Q155-K159 PolarHBondContact O-N 3.38Å; Q155-K159 VanDerWaalsContact O-N 3.08Å
156	T	95.3	Very high	94.2	Very high	23 Å²	23	48.6 Å²	48.6	14%	0.141	25%	0.247	C	C	.	.	H	α-helix	trans	-67	-42.2	176.1	-61.1	0	0	0	0	112.1	L129 C134 A152 A153 N154 K159 K160	L129-T156 HydrophobicContact CB-CG2 4.19Å; C134-T156 HydrophobicContact CB-CG2 4.08Å; A152-T156 WeakPolarHBondContact O-CB 3.4Å; A152-T156 PolarHBondContact O-N 2.87Å; A152-T156 PolarHBondContact O-OG1 3.08Å; A153-T156 CarbonylContact O-C 3.52Å; A153-T156 WeakPolarHBondContact O-CB 3.05Å; A153-T156 PolarHBondContact O-N 3.44Å; A153-T156 VanDerWaalsContact O-N 3.09Å; N154-T156 VanDerWaalsContact C-N 3.32Å; N154-T156 PolarHBondContact O-N 3.42Å; T156-K159 PolarHBondContact O-N 2.91Å; T156-K160 HydrophobicContact CG2-CD 4.03Å; T156-K160 WeakPolarHBondContact O-CB 3.24Å; T156-K160 PolarHBondContact O-N 3.23Å
157	I	95.9	Very high	93.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-48.4	176.2	-67.3	163.3	0	0	0	109.7	C134 A138 A153 N154 K159 K160 M161 L164 L172 L175 V183	C134-I157 HydrophobicContact CB-CG1 3.86Å; A138-I157 HydrophobicContact CB-CD1 3.89Å; A153-I157 VanDerWaalsContact O-CG1 3.25Å; A153-I157 WeakPolarHBondContact O-CG1 2.94Å; A153-I157 PolarHBondContact O-N 2.95Å; N154-I157 PolarHBondContact O-N 2.9Å; I157-K159 PolarHBondContact O-N 2.98Å; I157-K160 CarbonylContact O-C 3.59Å; I157-K160 PolarHBondContact O-N 3.01Å; I157-M161 HydrophobicContact CG2-CE 3.8Å; I157-M161 WeakPolarHBondContact O-CA 3.39Å; I157-M161 PolarHBondContact O-N 3.43Å; I157-L164 HydrophobicContact CB-CD1 4.45Å; I157-L164 HydrophobicContact CG2-CD1 3.96Å; I157-L172 HydrophobicContact CG2-CD2 4.39Å; I157-L175 HydrophobicContact CD1-CD1 3.99Å; I157-L175 HydrophobicContact CD1-CD2 4.4Å; I157-V183 HydrophobicContact CB-CG2 3.91Å; I157-V183 HydrophobicContact CG2-CG1 4.11Å; I157-V183 HydrophobicContact CG2-CG2 3.66Å
158	A	94.4	Very high	93.3	Very high	5 Å²	5	51.9 Å²	51.9	4%	0.041	26%	0.259	C	S	.	.	H	α-helix	trans	-59.4	-44.5	177.8	0	0	0	0	0	112.2	N154 K160 V183 A186	N154-A158 WeakPolarHBondContact O-CB 3.48Å; N154-A158 PolarHBondContact O-N 3Å; A158-K160 VanDerWaalsContact C-N 3.34Å; A158-K160 PolarHBondContact O-N 3.42Å; A158-V183 HydrophobicContact CB-CG1 4.26Å; A158-A186 HydrophobicContact CB-CB 4.19Å
159	K	92.2	Very high	93	Very high	135 Å²	135	51.6 Å²	51.6	59%	0.587	25%	0.25	S	S	*	.	H	α-helix	trans	-65.3	-32.8	177.9	-74.1	170.9	-175.1	168.3	0	113.6	Q155 T156 I157 P190	Q155-K159 WeakPolarHBondContact O-CB 3.41Å; Q155-K159 VanDerWaalsContact O-CG 3.28Å; Q155-K159 WeakPolarHBondContact O-CG 3.34Å; Q155-K159 PolarHBondContact O-N 3.38Å; Q155-K159 VanDerWaalsContact O-N 3.08Å; T156-K159 PolarHBondContact O-N 2.91Å; I157-K159 PolarHBondContact O-N 2.98Å; K159-P190 WeakPolarHBondContact O-CG 3.34Å
160	K	92.9	Very high	92.6	Very high	72 Å²	72	57.1 Å²	57.1	31%	0.313	28%	0.284	S	S	.	.	H	α-helix	trans	-106.6	12.9	-175.7	-63.8	-175	178	173.7	0	113.3	A131 T156 I157 A158 S162 V163 L164	A131-K160 HydrophobicContact CB-CD 3.89Å; T156-K160 HydrophobicContact CG2-CD 4.03Å; T156-K160 WeakPolarHBondContact O-CB 3.24Å; T156-K160 PolarHBondContact O-N 3.23Å; I157-K160 CarbonylContact O-C 3.59Å; I157-K160 PolarHBondContact O-N 3.01Å; A158-K160 VanDerWaalsContact C-N 3.34Å; A158-K160 PolarHBondContact O-N 3.42Å; K160-S162 VanDerWaalsContact C-N 3.27Å; K160-S162 PolarHBondContact O-N 2.83Å; K160-V163 PolarHBondContact O-N 2.73Å; K160-L164 WeakPolarHBondContact O-CG 3.29Å; K160-L164 PolarHBondContact O-N 2.9Å
161	M	94	Very high	92.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-56.8	-39	-174.5	-177.2	57	74	0	0	112.8	I157 V163 L164 L165 L172 V183 I189 V192 L197 L200	I157-M161 HydrophobicContact CG2-CE 3.8Å; I157-M161 WeakPolarHBondContact O-CA 3.39Å; I157-M161 PolarHBondContact O-N 3.43Å; M161-V163 VanDerWaalsContact C-N 3.32Å; M161-V163 PolarHBondContact O-N 3.32Å; M161-L164 PolarHBondContact O-N 3.25Å; M161-L165 HydrophobicContact CG-CD1 4.02Å; M161-L165 HydrophobicContact CG-CG 4.25Å; M161-L165 WeakPolarHBondContact O-CB 3.45Å; M161-L165 WeakPolarHBondContact O-CG 3.49Å; M161-L165 PolarHBondContact O-N 3.48Å; M161-L165 HydrophobicContact SD-CD1 4.31Å; M161-L165 HydrophobicContact SD-CD2 4.48Å; M161-L165 HydrophobicContact SD-CG 3.97Å; M161-L172 HydrophobicContact CE-CD2 4.21Å; M161-L172 HydrophobicContact SD-CD1 3.88Å; M161-L172 HydrophobicContact SD-CD2 4.2Å; M161-V183 HydrophobicContact CE-CG1 3.33Å; M161-I189 HydrophobicContact CB-CG2 3.62Å; M161-I189 HydrophobicContact CG-CG2 3.87Å; M161-V192 HydrophobicContact CB-CG2 3.95Å; M161-V192 HydrophobicContact CG-CG1 4.43Å; M161-V192 HydrophobicContact CG-CG2 3.84Å; M161-L197 HydrophobicContact CG-CD2 4.04Å; M161-L200 HydrophobicContact SD-CD2 4.33Å
162	S	91.9	Very high	92.1	Very high	32 Å²	32	54.2 Å²	54.2	22%	0.224	27%	0.274	C	S	.	.	H	α-helix	trans	-58.9	-41.2	177.2	53.5	0	0	0	0	112.9	K160 Q166	K160-S162 VanDerWaalsContact C-N 3.27Å; K160-S162 PolarHBondContact O-N 2.83Å; S162-Q166 WeakPolarHBondContact O-CG 3.43Å; S162-Q166 PolarHBondContact O-N 3.35Å
163	V	92.2	Very high	91.9	Very high	56 Å²	56	53.6 Å²	53.6	34%	0.339	27%	0.267	S	S	.	.	H	α-helix	trans	-70.6	-41.5	176.4	-178.1	0	0	0	0	110.8	K160 M161 Q166 K167	K160-V163 PolarHBondContact O-N 2.73Å; M161-V163 VanDerWaalsContact C-N 3.32Å; M161-V163 PolarHBondContact O-N 3.32Å; V163-Q166 PolarHBondContact O-N 3.09Å; V163-K167 HydrophobicContact CG1-CD 4.11Å; V163-K167 PolarHBondContact O-N 3.1Å
164	L	93.1	Very high	91.7	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-65	-41.5	-179.5	-68.4	172.2	0	0	0	112.3	A131 I157 K160 M161 Q166 S168 R169 L172	A131-L164 VanDerWaalsContact O-CD2 3.28Å; A131-L164 WeakPolarHBondContact O-CD2 3.35Å; I157-L164 HydrophobicContact CB-CD1 4.45Å; I157-L164 HydrophobicContact CG2-CD1 3.96Å; K160-L164 WeakPolarHBondContact O-CG 3.29Å; K160-L164 PolarHBondContact O-N 2.9Å; M161-L164 PolarHBondContact O-N 3.25Å; L164-Q166 VanDerWaalsContact C-N 3.27Å; L164-Q166 PolarHBondContact O-N 3.01Å; L164-S168 CarbonylContact O-C 3.59Å; L164-S168 WeakPolarHBondContact O-CA 3.5Å; L164-S168 PolarHBondContact O-N 3.5Å; L164-R169 PolarHBondContact O-N 3Å; L164-L172 HydrophobicContact CB-CD1 3.83Å; L164-L172 HydrophobicContact CB-CD2 4.29Å; L164-L172 HydrophobicContact CB-CG 4.19Å; L164-L172 HydrophobicContact CD1-CD2 4.14Å
165	L	92.3	Very high	91.6	Very high	34 Å²	34	55 Å²	55	18%	0.178	29%	0.285	C	S	.	.	H	α-helix	trans	-62	-34.5	176	-77.3	172.3	0	0	0	112.5	M161 L172 V192 D196 L200	M161-L165 HydrophobicContact CG-CD1 4.02Å; M161-L165 HydrophobicContact CG-CG 4.25Å; M161-L165 WeakPolarHBondContact O-CB 3.45Å; M161-L165 WeakPolarHBondContact O-CG 3.49Å; M161-L165 PolarHBondContact O-N 3.48Å; M161-L165 HydrophobicContact SD-CD1 4.31Å; M161-L165 HydrophobicContact SD-CD2 4.48Å; M161-L165 HydrophobicContact SD-CG 3.97Å; L165-L172 HydrophobicContact CD2-CD1 4.01Å; L165-L172 HydrophobicContact CG-CD1 4.31Å; L165-V192 HydrophobicContact CD1-CB 4.46Å; L165-V192 HydrophobicContact CD1-CG1 3.46Å; L165-V192 VanDerWaalsContact CD1-CG1 3.46Å; L165-V192 HydrophobicContact CD1-CG2 4.12Å; L165-D196 HydrophobicContact CD1-CB 4.25Å; L165-L200 HydrophobicContact CD2-CB 4.24Å; L165-L200 HydrophobicContact CD2-CD1 4.36Å; L165-L200 HydrophobicContact CD2-CD2 4.01Å; L165-L200 HydrophobicContact CD2-CG 4.43Å
166	Q	88	Confident	91.6	Very high	164 Å²	164	51.8 Å²	51.8	77%	0.766	27%	0.271	S	S	*	.	H	α-helix	trans	-80.5	-43.1	-179.6	-69.8	175.9	8.4	0	0	113.1	S162 V163 L164	S162-Q166 WeakPolarHBondContact O-CG 3.43Å; S162-Q166 PolarHBondContact O-N 3.35Å; V163-Q166 PolarHBondContact O-N 3.09Å; L164-Q166 VanDerWaalsContact C-N 3.27Å; L164-Q166 PolarHBondContact O-N 3.01Å
167	K	86.4	Confident	91.5	Very high	166 Å²	166	52.2 Å²	52.2	72%	0.722	27%	0.271	S	S	*	.	H	α-helix	trans	-101.5	-30	-170.3	-67.1	-172.4	176.7	-175.8	0	114.6	V163	V163-K167 HydrophobicContact CG1-CD 4.11Å; V163-K167 PolarHBondContact O-N 3.1Å
168	S	83.1	Confident	91.5	Very high	29 Å²	29	54.5 Å²	54.5	20%	0.203	29%	0.286	C	S	.	.			trans	-140.1	36.9	-161.6	-55	0	0	0	0	112.3	L164 V170 V171 L172	L164-S168 CarbonylContact O-C 3.59Å; L164-S168 WeakPolarHBondContact O-CA 3.5Å; L164-S168 PolarHBondContact O-N 3.5Å; S168-V170 VanDerWaalsContact C-N 3.25Å; S168-V170 PolarHBondContact O-N 3.39Å; S168-V171 WeakPolarHBondContact O-CB 3.41Å; S168-V171 PolarHBondContact O-N 2.95Å; S168-L172 PolarHBondContact O-N 3.46Å
169	R	87	Confident	91.6	Very high	99 Å²	99	54.2 Å²	54.2	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-53.8	-41.4	-179.3	-171.5	177.4	-174.1	163.7	7.3	112.7	L164 V171 L172 L173 L200 D203	L164-R169 PolarHBondContact O-N 3Å; R169-V171 VanDerWaalsContact C-N 3.26Å; R169-V171 PolarHBondContact O-N 2.96Å; R169-L172 WeakPolarHBondContact O-CB 3.18Å; R169-L172 PolarHBondContact O-N 2.92Å; R169-L172 VanDerWaalsContact O-N 3.11Å; R169-L173 WeakPolarHBondContact O-CG 3.25Å; R169-L173 PolarHBondContact O-N 2.78Å; R169-L200 HydrophobicContact CG-CD1 4.45Å; R169-D203 IonicContact CZ-OD2 3.33Å; R169-D203 IonicContact NE-OD2 3.15Å; R169-D203 PolarHBondContact NE-OD2 3.07Å; R169-D203 IonicContact NH2-OD2 2.7Å; R169-D203 PolarHBondContact NH2-OD2 3.22Å
170	V	88.4	Confident	91.7	Very high	118 Å²	118	47.8 Å²	47.8	72%	0.715	26%	0.256	S	S	*	.	H	α-helix	trans	-59.1	-37.4	178	-178.3	0	0	0	0	111.9	S168 L172 L173 G174	S168-V170 VanDerWaalsContact C-N 3.25Å; S168-V170 PolarHBondContact O-N 3.39Å; V170-L172 VanDerWaalsContact C-N 3.32Å; V170-L172 PolarHBondContact O-N 2.8Å; V170-L173 PolarHBondContact O-N 3.4Å; V170-G174 PolarHBondContact O-N 2.88Å
171	V	89.3	Confident	91.9	Very high	69 Å²	69	46.6 Å²	46.6	42%	0.418	25%	0.252	S	S	.	.	H	α-helix	trans	-67.8	-35.7	179.1	-174.5	0	0	0	0	110.9	C135 S168 R169 L173 G174	C135-V171 HydrophobicContact CB-CG1 3.58Å; S168-V171 WeakPolarHBondContact O-CB 3.41Å; S168-V171 PolarHBondContact O-N 2.95Å; R169-V171 VanDerWaalsContact C-N 3.26Å; R169-V171 PolarHBondContact O-N 2.96Å; V171-L173 VanDerWaalsContact C-N 3.29Å; V171-L173 PolarHBondContact O-N 3.32Å; V171-G174 PolarHBondContact O-N 3.3Å
172	L	92	Very high	91.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.4	-31.1	174.5	-70.4	168.8	0	0	0	112.4	I157 M161 L164 L165 S168 R169 V170 G174 L175 L200	I157-L172 HydrophobicContact CG2-CD2 4.39Å; M161-L172 HydrophobicContact CE-CD2 4.21Å; M161-L172 HydrophobicContact SD-CD1 3.88Å; M161-L172 HydrophobicContact SD-CD2 4.2Å; L164-L172 HydrophobicContact CB-CD1 3.83Å; L164-L172 HydrophobicContact CB-CD2 4.29Å; L164-L172 HydrophobicContact CB-CG 4.19Å; L164-L172 HydrophobicContact CD1-CD2 4.14Å; L165-L172 HydrophobicContact CD2-CD1 4.01Å; L165-L172 HydrophobicContact CG-CD1 4.31Å; S168-L172 PolarHBondContact O-N 3.46Å; R169-L172 WeakPolarHBondContact O-CB 3.18Å; R169-L172 PolarHBondContact O-N 2.92Å; R169-L172 VanDerWaalsContact O-N 3.11Å; V170-L172 VanDerWaalsContact C-N 3.32Å; V170-L172 PolarHBondContact O-N 2.8Å; L172-G174 VanDerWaalsContact C-N 3.25Å; L172-G174 PolarHBondContact O-N 2.79Å; L172-L175 WeakPolarHBondContact O-CB 3.42Å; L172-L175 PolarHBondContact O-N 2.98Å; L172-L175 VanDerWaalsContact O-N 3.15Å; L172-L200 HydrophobicContact CB-CD1 3.91Å; L172-L200 HydrophobicContact CB-CD2 4.43Å; L172-L200 HydrophobicContact CD1-CD1 4.25Å; L172-L200 HydrophobicContact CD1-CD2 4.04Å
173	L	92.6	Very high	92.1	Very high	10 Å²	10	47.1 Å²	47.1	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-68.5	-27.3	176.8	-59.7	171.9	0	0	0	112.1	R169 V170 V171 L175 L200 D203 W204 E207 N208	R169-L173 WeakPolarHBondContact O-CG 3.25Å; R169-L173 PolarHBondContact O-N 2.78Å; V170-L173 PolarHBondContact O-N 3.4Å; V171-L173 VanDerWaalsContact C-N 3.29Å; V171-L173 PolarHBondContact O-N 3.32Å; L173-L175 VanDerWaalsContact C-N 3.34Å; L173-L200 HydrophobicContact CD2-CD1 4.02Å; L173-D203 HydrophobicContact CD2-CB 3.84Å; L173-W204 HydrophobicContact CD2-CB 4.08Å; L173-W204 PolarHBondContact O-NE1 3.2Å; L173-E207 WeakPolarHBondContact CB-OE2 3.39Å; L173-E207 VanDerWaalsContact CD1-CD 3.5Å; L173-E207 VanDerWaalsContact CD1-OE1 3.26Å; L173-E207 WeakPolarHBondContact CD1-OE1 3.3Å; L173-E207 WeakPolarHBondContact CD1-OE2 3.34Å; L173-N208 PolarHBondContact O-ND2 2.85Å
174	G	91.9	Very high	92.2	Very high	45 Å²	45	44.5 Å²	44.5	46%	0.464	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	6.4	171.3	0	0	0	0	0	115.2	N139 V170 V171 L172	N139-G174 PolarHBondContact ND2-O 3.35Å; V170-G174 PolarHBondContact O-N 2.88Å; V171-G174 PolarHBondContact O-N 3.3Å; L172-G174 VanDerWaalsContact C-N 3.25Å; L172-G174 PolarHBondContact O-N 2.79Å
175	L	95.3	Very high	92.3	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	26%	0.255	C	S	.	.			trans	-72.5	138.4	179.8	-172.6	65.6	0	0	0	111	C135 A138 I157 L172 L173 L180 W204	C135-L175 HydrophobicContact CB-CD1 4.19Å; A138-L175 HydrophobicContact CB-CD1 3.95Å; I157-L175 HydrophobicContact CD1-CD1 3.99Å; I157-L175 HydrophobicContact CD1-CD2 4.4Å; L172-L175 WeakPolarHBondContact O-CB 3.42Å; L172-L175 PolarHBondContact O-N 2.98Å; L172-L175 VanDerWaalsContact O-N 3.15Å; L173-L175 VanDerWaalsContact C-N 3.34Å; L175-L180 HydrophobicContact CD2-CB 4.14Å; L175-L180 HydrophobicContact CD2-CD1 4.38Å; L175-W204 PolarHBondContact O-NE1 3Å
176	N	94.8	Very high	92.3	Very high	25 Å²	25	46.6 Å²	46.6	13%	0.134	26%	0.258	C	S	.	.			trans	-61.6	149.5	176	68.3	80.9	0	0	0	112.2	A138 N139 E142 P178 S179 L180	A138-N176 VanDerWaalsContact C-ND2 3.34Å; A138-N176 PolarHBondContact O-ND2 3.44Å; N139-N176 WeakPolarHBondContact CA-ND2 3.34Å; N139-N176 PolarHBondContact N-ND2 2.93Å; N139-N176 WeakPolarHBondContact OD1-CB 3.37Å; N139-N176 PolarHBondContact OD1-N 3.43Å; N139-N176 PolarHBondContact OD1-ND2 3.2Å; E142-N176 HydrophobicContact CB-CB 4.5Å; E142-N176 HydrophobicContact CG-CB 4.3Å; N176-P178 WeakPolarHBondContact OD1-CD 3.32Å; N176-S179 PolarHBondContact ND2-OG 3.47Å; N176-S179 PolarHBondContact O-N 3.27Å; N176-S179 WeakPolarHBondContact OD1-CB 3.3Å; N176-S179 PolarHBondContact OD1-N 3.24Å; N176-S179 PolarHBondContact OD1-OG 3.02Å; N176-L180 PolarHBondContact O-N 3.42Å
177	F	94.1	Very high	92.4	Very high	33 Å²	33	43.4 Å²	43.4	15%	0.145	25%	0.246	C	C	.	.	H	α-helix	trans	-58.6	-45.9	-175.8	177.1	-94.5	0	0	0	114	S179 L180 M181 W204 K215 L219	F177-S179 VanDerWaalsContact C-N 3.34Å; F177-S179 PolarHBondContact O-N 3.17Å; F177-L180 PolarHBondContact O-N 3.15Å; F177-M181 HydrophobicContact CD1-CG 4.24Å; F177-M181 HydrophobicContact CD1-SD 4.24Å; F177-M181 HydrophobicContact CE1-CE 3.94Å; F177-M181 HydrophobicContact CE1-CG 3.84Å; F177-M181 HydrophobicContact CE1-SD 3.35Å; F177-M181 WeakPolarHBondContact CE1-SD 3.22Å; F177-M181 HydrophobicContact CE2-CG 4.18Å; F177-M181 HydrophobicContact CE2-SD 4.33Å; F177-M181 HydrophobicContact CZ-CG 3.81Å; F177-M181 HydrophobicContact CZ-SD 3.41Å; F177-M181 WeakPolarHBondContact CZ-SD 3.37Å; F177-M181 WeakPolarHBondContact O-CG 3.3Å; F177-M181 PolarHBondContact O-N 3.44Å; F177-W204 HydrophobicContact CB-CH2 3.96Å; F177-W204 HydrophobicContact CB-CZ2 4.27Å; F177-W204 AromaticContact CD2-CH2 3.74Å; F177-W204 HydrophobicContact CD2-CH2 3.74Å; F177-W204 AromaticContact CD2-CZ3 3.99Å; F177-W204 HydrophobicContact CD2-CZ3 3.99Å; F177-W204 HydrophobicContact CG-CH2 4.35Å; F177-K215 HydrophobicContact CE1-CD 4.48Å; F177-K215 HydrophobicContact CE2-CB 4.15Å; F177-K215 HydrophobicContact CZ-CB 3.96Å; F177-K215 HydrophobicContact CZ-CD 4.46Å; F177-K215 HydrophobicContact CZ-CG 4.23Å; F177-L219 HydrophobicContact CE2-CB 4.12Å; F177-L219 HydrophobicContact CE2-CD1 4.43Å
178	P	95	Very high	92.5	Very high	47 Å²	47	40.8 Å²	40.8	31%	0.305	24%	0.235	S	C	.	.	H	α-helix	trans	-58.6	-42.7	177.6	-27.4	37.4	0	0	0	113.4	E142 N176 M181 A182	E142-P178 HydrophobicContact CG-CG 4.39Å; E142-P178 WeakPolarHBondContact OE1-CG 3.43Å; N176-P178 WeakPolarHBondContact OD1-CD 3.32Å; P178-M181 PolarHBondContact O-N 3.41Å; P178-A182 WeakPolarHBondContact O-CB 3.44Å; P178-A182 PolarHBondContact O-N 2.96Å
179	S	96.6	Very high	92.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66	-45.4	178.3	-62.1	0	0	0	0	111.6	L150 N154 N176 F177 M181 A182 V183	L150-S179 VanDerWaalsContact CD1-OG 3.3Å; L150-S179 WeakPolarHBondContact CD1-OG 3.41Å; N154-S179 WeakPolarHBondContact OD1-CA 3.32Å; N154-S179 WeakPolarHBondContact OD1-CB 3.49Å; N154-S179 PolarHBondContact OD1-OG 2.92Å; N154-S179 VanDerWaalsContact OD1-OG 3.11Å; N176-S179 PolarHBondContact ND2-OG 3.47Å; N176-S179 PolarHBondContact O-N 3.27Å; N176-S179 WeakPolarHBondContact OD1-CB 3.3Å; N176-S179 PolarHBondContact OD1-N 3.24Å; N176-S179 PolarHBondContact OD1-OG 3.02Å; F177-S179 VanDerWaalsContact C-N 3.34Å; F177-S179 PolarHBondContact O-N 3.17Å; S179-M181 VanDerWaalsContact C-N 3.33Å; S179-M181 PolarHBondContact O-N 3.08Å; S179-A182 PolarHBondContact O-N 3.36Å; S179-V183 WeakPolarHBondContact O-CB 3.45Å; S179-V183 VanDerWaalsContact O-CG2 3.22Å; S179-V183 WeakPolarHBondContact O-CG2 3.49Å; S179-V183 PolarHBondContact O-N 2.81Å
180	L	95.8	Very high	92.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-44	176.1	-175.3	64.2	0	0	0	111.3	L175 N176 F177 V183 L184 W204 L219	L175-L180 HydrophobicContact CD2-CB 4.14Å; L175-L180 HydrophobicContact CD2-CD1 4.38Å; N176-L180 PolarHBondContact O-N 3.42Å; F177-L180 PolarHBondContact O-N 3.15Å; L180-V183 PolarHBondContact O-N 3.09Å; L180-L184 HydrophobicContact CD1-CD1 4.41Å; L180-L184 HydrophobicContact CD1-CG 4.39Å; L180-L184 HydrophobicContact CG-CD1 4.23Å; L180-L184 WeakPolarHBondContact O-CB 3.5Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.2Å; L180-L184 PolarHBondContact O-N 3.29Å; L180-W204 HydrophobicContact CD2-CB 4.22Å; L180-W204 HydrophobicContact CD2-CD2 3.55Å; L180-W204 HydrophobicContact CD2-CE3 3.98Å; L180-W204 HydrophobicContact CD2-CG 3.6Å; L180-L219 HydrophobicContact CD2-CD1 3.77Å; L180-L219 HydrophobicContact CD2-CD2 4.04Å; L180-L219 HydrophobicContact CG-CD1 3.88Å
181	M	95.6	Very high	92.7	Very high	47 Å²	47	33.1 Å²	33.1	23%	0.232	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-46.8	174.7	-72	-153.7	-40.6	0	0	112.2	F177 P178 S179 V183 L184 D185 L219	F177-M181 HydrophobicContact CD1-CG 4.24Å; F177-M181 HydrophobicContact CD1-SD 4.24Å; F177-M181 HydrophobicContact CE1-CE 3.94Å; F177-M181 HydrophobicContact CE1-CG 3.84Å; F177-M181 HydrophobicContact CE1-SD 3.35Å; F177-M181 WeakPolarHBondContact CE1-SD 3.22Å; F177-M181 HydrophobicContact CE2-CG 4.18Å; F177-M181 HydrophobicContact CE2-SD 4.33Å; F177-M181 HydrophobicContact CZ-CG 3.81Å; F177-M181 HydrophobicContact CZ-SD 3.41Å; F177-M181 WeakPolarHBondContact CZ-SD 3.37Å; F177-M181 WeakPolarHBondContact O-CG 3.3Å; F177-M181 PolarHBondContact O-N 3.44Å; P178-M181 PolarHBondContact O-N 3.41Å; S179-M181 VanDerWaalsContact C-N 3.33Å; S179-M181 PolarHBondContact O-N 3.08Å; M181-V183 VanDerWaalsContact C-N 3.31Å; M181-V183 PolarHBondContact O-N 3.4Å; M181-L184 PolarHBondContact O-N 3.11Å; M181-D185 WeakPolarHBondContact O-CB 3.25Å; M181-D185 PolarHBondContact O-N 3.31Å; M181-L219 HydrophobicContact CG-CD1 4.04Å
182	A	95.7	Very high	92.8	Very high	42 Å²	42	31 Å²	31	35%	0.347	19%	0.194	S	C	.	.	H	α-helix	trans	-61.2	-41.5	-179	0	0	0	0	0	111.6	N154 P178 S179 D185 A186	N154-A182 HydrophobicContact CB-CB 4.36Å; P178-A182 WeakPolarHBondContact O-CB 3.44Å; P178-A182 PolarHBondContact O-N 2.96Å; S179-A182 PolarHBondContact O-N 3.36Å; A182-D185 PolarHBondContact O-N 3.44Å; A182-A186 PolarHBondContact O-N 2.87Å
183	V	95.6	Very high	92.8	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-65.6	-44.8	176.8	172.4	0	0	0	0	111.3	N154 I157 A158 M161 S179 L180 M181 D185 A186 I189	N154-V183 HydrophobicContact CB-CG2 4.4Å; I157-V183 HydrophobicContact CB-CG2 3.91Å; I157-V183 HydrophobicContact CG2-CG1 4.11Å; I157-V183 HydrophobicContact CG2-CG2 3.66Å; A158-V183 HydrophobicContact CB-CG1 4.26Å; M161-V183 HydrophobicContact CE-CG1 3.33Å; S179-V183 WeakPolarHBondContact O-CB 3.45Å; S179-V183 VanDerWaalsContact O-CG2 3.22Å; S179-V183 WeakPolarHBondContact O-CG2 3.49Å; S179-V183 PolarHBondContact O-N 2.81Å; L180-V183 PolarHBondContact O-N 3.09Å; M181-V183 VanDerWaalsContact C-N 3.31Å; M181-V183 PolarHBondContact O-N 3.4Å; V183-D185 VanDerWaalsContact C-N 3.26Å; V183-D185 PolarHBondContact O-N 3.38Å; V183-A186 VanDerWaalsContact O-CB 3.3Å; V183-A186 WeakPolarHBondContact O-CB 3.48Å; V183-A186 PolarHBondContact O-N 3.1Å; V183-I189 WeakPolarHBondContact O-CD1 3.28Å
184	L	94.9	Very high	92.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-69.9	-21.9	176.5	-66.3	179.7	0	0	0	113.2	L180 M181 L197 S201 L219 R222 L223 R276	L180-L184 HydrophobicContact CD1-CD1 4.41Å; L180-L184 HydrophobicContact CD1-CG 4.39Å; L180-L184 HydrophobicContact CG-CD1 4.23Å; L180-L184 WeakPolarHBondContact O-CB 3.5Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.2Å; L180-L184 PolarHBondContact O-N 3.29Å; M181-L184 PolarHBondContact O-N 3.11Å; L184-L197 HydrophobicContact CD2-CB 4.13Å; L184-L197 HydrophobicContact CD2-CD1 4.43Å; L184-L197 HydrophobicContact CD2-CD2 4.24Å; L184-S201 WeakPolarHBondContact CD1-OG 3.44Å; L184-L219 HydrophobicContact CD1-CD1 3.69Å; L184-L219 HydrophobicContact CD1-CG 4.21Å; L184-R222 HydrophobicContact CB-CB 3.85Å; L184-L223 HydrophobicContact CD1-CD2 4.24Å; L184-L223 HydrophobicContact CD2-CD2 3.81Å; L184-R276 PolarHBondContact O-NH1 2.86Å; L184-R276 PolarHBondContact O-NH2 2.87Å
185	D	93.8	Very high	92.8	Very high	53 Å²	53	36.3 Å²	36.3	28%	0.283	21%	0.205	S	C	.	.	H	α-helix	trans	-79.6	-22.2	174.8	-155	69.1	0	0	0	112	M181 A182 V183 R222 R271	M181-D185 WeakPolarHBondContact O-CB 3.25Å; M181-D185 PolarHBondContact O-N 3.31Å; A182-D185 PolarHBondContact O-N 3.44Å; V183-D185 VanDerWaalsContact C-N 3.26Å; V183-D185 PolarHBondContact O-N 3.38Å; D185-R222 WeakPolarHBondContact OD1-CD 3.29Å; D185-R222 IonicContact OD1-CZ 3.95Å; D185-R222 IonicContact OD1-NE 2.77Å; D185-R222 IonicContact OD1-NH1 3.63Å; D185-R222 PolarHBondContact OD1-NH1 3.28Å; D185-R271 PolarHBondContact O-NH2 3.43Å; D185-R271 IonicContact OD1-CZ 3.9Å; D185-R271 VanDerWaalsContact OD1-CZ 3.23Å; D185-R271 IonicContact OD1-NH1 3.96Å; D185-R271 PolarHBondContact OD1-NH1 3.2Å; D185-R271 IonicContact OD1-NH2 2.92Å; D185-R271 PolarHBondContact OD1-NH2 3.33Å; D185-R271 IonicContact OD2-CZ 3.8Å; D185-R271 IonicContact OD2-NH1 2.8Å; D185-R271 IonicContact OD2-NH2 3.23Å; D185-R271 PolarHBondContact OD2-NH2 2.82Å
186	A	92.8	Very high	92.7	Very high	29 Å²	29	38.9 Å²	38.9	24%	0.24	22%	0.219	C	C	.	.			trans	-62	133.2	-176.6	0	0	0	0	0	113.7	A158 A182 V183 K188 R276	A158-A186 HydrophobicContact CB-CB 4.19Å; A182-A186 PolarHBondContact O-N 2.87Å; V183-A186 VanDerWaalsContact O-CB 3.3Å; V183-A186 WeakPolarHBondContact O-CB 3.48Å; V183-A186 PolarHBondContact O-N 3.1Å; A186-K188 PolarHBondContact O-N 3.42Å; A186-R276 PolarHBondContact O-NH1 2.87Å
187	D	89.7	Confident	92.7	Very high	97 Å²	97	37.7 Å²	37.7	52%	0.519	21%	0.212	S	C	.	.	S	Bend	trans	-73.9	-11.4	179	-70.5	-41.2	0	0	0	114.4	R224 R276 G277	D187-R224 IonicContact OD1-CZ 2.68Å; D187-R224 IonicContact OD1-NH2 3.74Å; D187-R224 PolarHBondContact OD1-NH2 2.71Å; D187-R276 CarbonylContact O-C 3.58Å; D187-R276 WeakPolarHBondContact O-CA 3.25Å; D187-R276 WeakPolarHBondContact O-CB 3.4Å; D187-G277 PolarHBondContact O-N 3.41Å
188	K	89.4	Confident	92.7	Very high	110 Å²	110	36.1 Å²	36.1	48%	0.478	21%	0.205	S	C	.	.			trans	-127.3	106.1	-175.6	-60.8	-174.6	-173.6	-168.9	0	110.1	A186 S278	A186-K188 PolarHBondContact O-N 3.42Å; K188-S278 PolarHBondContact NZ-OG 2.77Å
189	I	90.9	Very high	92.6	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.021	21%	0.209	C	C	.	.			trans	-133.3	83.8	175.4	-51.9	-179.2	0	0	0	107	M161 V183 V192 L197	M161-I189 HydrophobicContact CB-CG2 3.62Å; M161-I189 HydrophobicContact CG-CG2 3.87Å; V183-I189 WeakPolarHBondContact O-CD1 3.28Å; I189-V192 HydrophobicContact CG2-CB 3.92Å; I189-V192 HydrophobicContact CG2-CG2 3.89Å; I189-L197 HydrophobicContact CD1-CD1 3.8Å
190	P	86.9	Confident	92.5	Very high	38 Å²	38	38.7 Å²	38.7	25%	0.247	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	135.3	-170.1	28.1	-36	0	0	0	111.8	K159 V192 D597	K159-P190 WeakPolarHBondContact O-CG 3.34Å; P190-V192 PolarHBondContact O-N 3.25Å; P190-D597 WeakPolarHBondContact CA-OD2 3.25Å; P190-D597 HydrophobicContact CB-CB 4.06Å; P190-D597 WeakPolarHBondContact CB-OD2 3.38Å
191	G	85.3	Confident	92.4	Very high	43 Å²	43	38.7 Å²	38.7	44%	0.443	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	19.8	171.3	0	0	0	0	0	115	D597	G191-D597 WeakPolarHBondContact CA-O 3.16Å
192	V	91	Very high	92.1	Very high	25 Å²	25	36.7 Å²	36.7	15%	0.152	20%	0.199	C	C	.	.			trans	-125.1	127.1	-178.1	-174.6	0	0	0	0	110.7	M161 L165 I189 P190 D196 L197	M161-V192 HydrophobicContact CB-CG2 3.95Å; M161-V192 HydrophobicContact CG-CG1 4.43Å; M161-V192 HydrophobicContact CG-CG2 3.84Å; L165-V192 HydrophobicContact CD1-CB 4.46Å; L165-V192 HydrophobicContact CD1-CG1 3.46Å; L165-V192 VanDerWaalsContact CD1-CG1 3.46Å; L165-V192 HydrophobicContact CD1-CG2 4.12Å; I189-V192 HydrophobicContact CG2-CB 3.92Å; I189-V192 HydrophobicContact CG2-CG2 3.89Å; P190-V192 PolarHBondContact O-N 3.25Å; V192-D196 HydrophobicContact CG1-CB 4.47Å; V192-L197 HydrophobicContact CG1-CD1 4.4Å; V192-L197 HydrophobicContact CG1-CD2 3.73Å; V192-L197 HydrophobicContact CG1-CG 3.77Å
193	K	90.8	Very high	91.9	Very high	152 Å²	152	37.3 Å²	37.3	66%	0.661	20%	0.197	S	C	*	.			trans	-77	143.1	172.7	-64.3	-179.5	178.3	-179.5	0	109.9	V195 D196 L197	K193-V195 PolarHBondContact O-N 3.49Å; K193-V195 VanDerWaalsContact O-N 3.14Å; K193-D196 PolarHBondContact O-N 3.4Å; K193-L197 PolarHBondContact O-N 2.66Å
194	E	93.4	Very high	91.8	Very high	9 Å²	9	37.8 Å²	37.8	4%	0.042	20%	0.198	C	C	.	.	H	α-helix	trans	-60.7	-29.2	179.8	-160	76.2	-172.2	0	0	112.4	D196 L197 I198 L223 R224 L227 V228 R276	E194-D196 VanDerWaalsContact C-N 3.26Å; E194-D196 PolarHBondContact O-N 3.39Å; E194-L197 WeakPolarHBondContact O-CB 3.16Å; E194-L197 PolarHBondContact O-N 3.23Å; E194-I198 HydrophobicContact CG-CD1 4.43Å; E194-I198 WeakPolarHBondContact O-CG1 3.34Å; E194-I198 PolarHBondContact O-N 3.18Å; E194-L223 WeakPolarHBondContact OE1-CA 3.26Å; E194-R224 HydrophobicContact CG-CB 4.05Å; E194-R224 WeakPolarHBondContact CG-O 3.25Å; E194-R224 PolarHBondContact OE1-N 3.21Å; E194-L227 HydrophobicContact CB-CB 3.98Å; E194-L227 HydrophobicContact CG-CB 4.47Å; E194-V228 HydrophobicContact CB-CG2 4.05Å; E194-V228 HydrophobicContact CG-CG2 4.43Å; E194-R276 IonicContact OE1-CZ 3.8Å; E194-R276 IonicContact OE1-NE 2.81Å; E194-R276 PolarHBondContact OE1-NE 3.37Å; E194-R276 IonicContact OE1-NH2 3.88Å; E194-R276 PolarHBondContact OE1-NH2 2.73Å; E194-R276 WeakPolarHBondContact OE2-CD 3.49Å; E194-R276 IonicContact OE2-CZ 2.65Å; E194-R276 IonicContact OE2-NE 2.87Å; E194-R276 PolarHBondContact OE2-NE 2.87Å; E194-R276 IonicContact OE2-NH2 3.53Å
195	V	92.7	Very high	91.7	Very high	6 Å²	6	38.5 Å²	38.5	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-40.1	175	-167	0	0	0	0	111.8	K193 I198 R199 V228 L236	K193-V195 PolarHBondContact O-N 3.49Å; K193-V195 VanDerWaalsContact O-N 3.14Å; V195-I198 PolarHBondContact O-N 3.4Å; V195-R199 WeakPolarHBondContact O-CG 3.43Å; V195-R199 PolarHBondContact O-N 3.5Å; V195-V228 HydrophobicContact CG2-CB 4.16Å; V195-V228 HydrophobicContact CG2-CG1 3.57Å; V195-V228 HydrophobicContact CG2-CG2 3.8Å; V195-L236 HydrophobicContact CG1-CD1 4.3Å
196	D	92.9	Very high	91.4	Very high	56 Å²	56	41.5 Å²	41.5	30%	0.299	22%	0.218	S	C	.	.	H	α-helix	trans	-74.3	-32.5	-178.6	-60.1	-41.7	0	0	0	111.2	L165 V192 K193 E194 R199 L200	L165-D196 HydrophobicContact CD1-CB 4.25Å; V192-D196 HydrophobicContact CG1-CB 4.47Å; K193-D196 PolarHBondContact O-N 3.4Å; E194-D196 VanDerWaalsContact C-N 3.26Å; E194-D196 PolarHBondContact O-N 3.39Å; D196-R199 PolarHBondContact O-N 2.83Å; D196-R199 IonicContact OD1-NH1 3.03Å; D196-R199 PolarHBondContact OD1-NH1 2.95Å; D196-L200 WeakPolarHBondContact O-CB 3.22Å; D196-L200 PolarHBondContact O-N 3.35Å
197	L	94.6	Very high	91.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.6	-39.1	170.7	-61.8	178.2	0	0	0	111.9	M161 L184 I189 V192 K193 E194 L200 S201 L223	M161-L197 HydrophobicContact CG-CD2 4.04Å; L184-L197 HydrophobicContact CD2-CB 4.13Å; L184-L197 HydrophobicContact CD2-CD1 4.43Å; L184-L197 HydrophobicContact CD2-CD2 4.24Å; I189-L197 HydrophobicContact CD1-CD1 3.8Å; V192-L197 HydrophobicContact CG1-CD1 4.4Å; V192-L197 HydrophobicContact CG1-CD2 3.73Å; V192-L197 HydrophobicContact CG1-CG 3.77Å; K193-L197 PolarHBondContact O-N 2.66Å; E194-L197 WeakPolarHBondContact O-CB 3.16Å; E194-L197 PolarHBondContact O-N 3.23Å; L197-L200 PolarHBondContact O-N 2.99Å; L197-S201 WeakPolarHBondContact O-CB 3.49Å; L197-S201 PolarHBondContact O-N 2.91Å; L197-S201 PolarHBondContact O-OG 3.04Å; L197-L223 HydrophobicContact CB-CD2 3.75Å
198	I	93.6	Very high	91.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-48.1	175	-65.4	159.3	0	0	0	110.1	E194 V195 L200 S201 L202 L223 F225 V228 L236	E194-I198 HydrophobicContact CG-CD1 4.43Å; E194-I198 WeakPolarHBondContact O-CG1 3.34Å; E194-I198 PolarHBondContact O-N 3.18Å; V195-I198 PolarHBondContact O-N 3.4Å; I198-L200 PolarHBondContact O-N 3.29Å; I198-S201 PolarHBondContact O-N 3.23Å; I198-L202 HydrophobicContact CG2-CD1 3.82Å; I198-L202 HydrophobicContact CG2-CG 4.36Å; I198-L202 VanDerWaalsContact O-CG 3.29Å; I198-L202 WeakPolarHBondContact O-CG 3.35Å; I198-L202 PolarHBondContact O-N 3.43Å; I198-L223 HydrophobicContact CB-CD1 4.32Å; I198-L223 HydrophobicContact CG1-CB 4.09Å; I198-L223 HydrophobicContact CG1-CD1 3.83Å; I198-L223 HydrophobicContact CG1-CD2 4.12Å; I198-L223 HydrophobicContact CG1-CG 4.23Å; I198-F225 HydrophobicContact CD1-CD1 3.87Å; I198-F225 HydrophobicContact CD1-CE1 3.96Å; I198-F225 HydrophobicContact CG1-CE1 4.19Å; I198-V228 HydrophobicContact CD1-CG2 3.63Å; I198-L236 HydrophobicContact CB-CD1 4.49Å; I198-L236 HydrophobicContact CD1-CD1 4.48Å; I198-L236 HydrophobicContact CG2-CD1 3.94Å
199	R	92.3	Very high	90.6	Very high	100 Å²	100	41.3 Å²	41.3	38%	0.377	22%	0.224	S	C	.	.	H	α-helix	trans	-58.4	-46.4	176	-71.5	174	-175.9	144.3	0.6	111.8	V195 D196 S201 L202 D203 L236	V195-R199 WeakPolarHBondContact O-CG 3.43Å; V195-R199 PolarHBondContact O-N 3.5Å; D196-R199 PolarHBondContact O-N 2.83Å; D196-R199 IonicContact OD1-NH1 3.03Å; D196-R199 PolarHBondContact OD1-NH1 2.95Å; R199-S201 VanDerWaalsContact C-N 3.31Å; R199-S201 PolarHBondContact O-N 3.2Å; R199-L202 PolarHBondContact O-N 3.14Å; R199-D203 VanDerWaalsContact O-CG 3.3Å; R199-D203 PolarHBondContact O-N 3.29Å; R199-L236 HydrophobicContact CG-CD2 4.12Å
200	L	94.3	Very high	89.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.4	-44.5	175.4	176.5	67.9	0	0	0	111.8	M161 L165 R169 L172 L173 D196 L197 I198 L202 D203 W204	M161-L200 HydrophobicContact SD-CD2 4.33Å; L165-L200 HydrophobicContact CD2-CB 4.24Å; L165-L200 HydrophobicContact CD2-CD1 4.36Å; L165-L200 HydrophobicContact CD2-CD2 4.01Å; L165-L200 HydrophobicContact CD2-CG 4.43Å; R169-L200 HydrophobicContact CG-CD1 4.45Å; L172-L200 HydrophobicContact CB-CD1 3.91Å; L172-L200 HydrophobicContact CB-CD2 4.43Å; L172-L200 HydrophobicContact CD1-CD1 4.25Å; L172-L200 HydrophobicContact CD1-CD2 4.04Å; L173-L200 HydrophobicContact CD2-CD1 4.02Å; D196-L200 WeakPolarHBondContact O-CB 3.22Å; D196-L200 PolarHBondContact O-N 3.35Å; L197-L200 PolarHBondContact O-N 2.99Å; I198-L200 PolarHBondContact O-N 3.29Å; L200-L202 VanDerWaalsContact C-N 3.33Å; L200-L202 PolarHBondContact O-N 3.09Å; L200-D203 PolarHBondContact O-N 2.98Å; L200-W204 VanDerWaalsContact O-CB 3.29Å; L200-W204 WeakPolarHBondContact O-CB 3.48Å; L200-W204 PolarHBondContact O-N 3.16Å
201	S	93.4	Very high	89.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-35.9	-178.2	-56.7	0	0	0	0	112.2	L184 L197 I198 R199 L205	L184-S201 WeakPolarHBondContact CD1-OG 3.44Å; L197-S201 WeakPolarHBondContact O-CB 3.49Å; L197-S201 PolarHBondContact O-N 2.91Å; L197-S201 PolarHBondContact O-OG 3.04Å; I198-S201 PolarHBondContact O-N 3.23Å; R199-S201 VanDerWaalsContact C-N 3.31Å; R199-S201 PolarHBondContact O-N 3.2Å; S201-L205 VanDerWaalsContact O-CG 3.25Å; S201-L205 WeakPolarHBondContact O-CG 3.31Å; S201-L205 PolarHBondContact O-N 3.44Å; S201-L205 VanDerWaalsContact O-N 3.1Å
202	L	91.2	Very high	89.5	Confident	5 Å²	5	50 Å²	50	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-69.1	-48.3	176.1	-67.3	168.8	0	0	0	111	I198 R199 L200 W204 L205 D206 L220 L236 N240 A242 M243	I198-L202 HydrophobicContact CG2-CD1 3.82Å; I198-L202 HydrophobicContact CG2-CG 4.36Å; I198-L202 VanDerWaalsContact O-CG 3.29Å; I198-L202 WeakPolarHBondContact O-CG 3.35Å; I198-L202 PolarHBondContact O-N 3.43Å; R199-L202 PolarHBondContact O-N 3.14Å; L200-L202 VanDerWaalsContact C-N 3.33Å; L200-L202 PolarHBondContact O-N 3.09Å; L202-W204 VanDerWaalsContact C-N 3.28Å; L202-W204 PolarHBondContact O-N 3.48Å; L202-L205 WeakPolarHBondContact O-CB 3.45Å; L202-L205 PolarHBondContact O-N 3.39Å; L202-L205 VanDerWaalsContact O-N 3.09Å; L202-D206 PolarHBondContact O-N 3.34Å; L202-L220 HydrophobicContact CD2-CD2 4.23Å; L202-L236 HydrophobicContact CD1-CD2 4.48Å; L202-N240 HydrophobicContact CD1-CB 4.36Å; L202-N240 HydrophobicContact CD2-CB 4.12Å; L202-A242 HydrophobicContact CD2-CB 4.15Å; L202-M243 HydrophobicContact CD1-CG 4.39Å; L202-M243 HydrophobicContact CD2-CG 3.95Å; L202-M243 HydrophobicContact CD2-SD 4.16Å
203	D	91.2	Very high	89.2	Confident	56 Å²	56	54 Å²	54	30%	0.299	29%	0.289	S	S	.	.	H	α-helix	trans	-59.5	-40.4	176	-66.7	5.2	0	0	0	111.5	R169 L173 R199 L200 L205 D206 E207	R169-D203 IonicContact CZ-OD2 3.33Å; R169-D203 IonicContact NE-OD2 3.15Å; R169-D203 PolarHBondContact NE-OD2 3.07Å; R169-D203 IonicContact NH2-OD2 2.7Å; R169-D203 PolarHBondContact NH2-OD2 3.22Å; L173-D203 HydrophobicContact CD2-CB 3.84Å; R199-D203 VanDerWaalsContact O-CG 3.3Å; R199-D203 PolarHBondContact O-N 3.29Å; L200-D203 PolarHBondContact O-N 2.98Å; D203-L205 VanDerWaalsContact C-N 3.34Å; D203-L205 PolarHBondContact O-N 3.26Å; D203-D206 PolarHBondContact O-N 3.35Å; D203-E207 PolarHBondContact O-N 2.87Å
204	W	93.8	Very high	89	Confident	10 Å²	10	52.7 Å²	52.7	4%	0.038	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-38.9	176.3	-173.4	100.9	0	0	0	112	L173 L175 F177 L180 L200 L202 N208 L211 L219	L173-W204 HydrophobicContact CD2-CB 4.08Å; L173-W204 PolarHBondContact O-NE1 3.2Å; L175-W204 PolarHBondContact O-NE1 3Å; F177-W204 HydrophobicContact CB-CH2 3.96Å; F177-W204 HydrophobicContact CB-CZ2 4.27Å; F177-W204 AromaticContact CD2-CH2 3.74Å; F177-W204 HydrophobicContact CD2-CH2 3.74Å; F177-W204 AromaticContact CD2-CZ3 3.99Å; F177-W204 HydrophobicContact CD2-CZ3 3.99Å; F177-W204 HydrophobicContact CG-CH2 4.35Å; L180-W204 HydrophobicContact CD2-CB 4.22Å; L180-W204 HydrophobicContact CD2-CD2 3.55Å; L180-W204 HydrophobicContact CD2-CE3 3.98Å; L180-W204 HydrophobicContact CD2-CG 3.6Å; L200-W204 VanDerWaalsContact O-CB 3.29Å; L200-W204 WeakPolarHBondContact O-CB 3.48Å; L200-W204 PolarHBondContact O-N 3.16Å; L202-W204 VanDerWaalsContact C-N 3.28Å; L202-W204 PolarHBondContact O-N 3.48Å; W204-N208 HydrophobicContact CD2-CB 4.37Å; W204-N208 HydrophobicContact CE3-CB 4.38Å; W204-N208 HydrophobicContact CH2-CB 4.09Å; W204-N208 HydrophobicContact CZ2-CB 4.1Å; W204-N208 HydrophobicContact CZ3-CB 4.27Å; W204-N208 PolarHBondContact NE1-ND2 2.97Å; W204-N208 WeakPolarHBondContact O-CB 3.47Å; W204-N208 PolarHBondContact O-N 3.34Å; W204-N208 PolarHBondContact O-ND2 3.19Å; W204-L211 HydrophobicContact CE3-CD1 4.42Å; W204-L211 HydrophobicContact CH2-CD1 3.83Å; W204-L211 HydrophobicContact CZ3-CD1 3.38Å; W204-L219 HydrophobicContact CE3-CD2 3.92Å; W204-L219 HydrophobicContact CZ3-CD2 4.2Å
205	L	91	Very high	88.8	Confident	15 Å²	15	56.9 Å²	56.9	8%	0.079	31%	0.307	C	S	.	.	H	α-helix	trans	-68.2	-34.3	176.1	-75	172.4	0	0	0	112.6	S201 L202 D203 G209 L211 L219 L220 A242	S201-L205 VanDerWaalsContact O-CG 3.25Å; S201-L205 WeakPolarHBondContact O-CG 3.31Å; S201-L205 PolarHBondContact O-N 3.44Å; S201-L205 VanDerWaalsContact O-N 3.1Å; L202-L205 WeakPolarHBondContact O-CB 3.45Å; L202-L205 PolarHBondContact O-N 3.39Å; L202-L205 VanDerWaalsContact O-N 3.09Å; D203-L205 VanDerWaalsContact C-N 3.34Å; D203-L205 PolarHBondContact O-N 3.26Å; L205-G209 WeakPolarHBondContact O-CA 3.47Å; L205-G209 PolarHBondContact O-N 3.09Å; L205-G209 VanDerWaalsContact O-N 3.09Å; L205-L211 HydrophobicContact CD2-CD1 3.84Å; L205-L219 HydrophobicContact CD1-CD2 4.37Å; L205-L219 HydrophobicContact CD2-CD2 3.94Å; L205-L219 HydrophobicContact CG-CD2 3.98Å; L205-L220 HydrophobicContact CD1-CD1 4.05Å; L205-L220 HydrophobicContact CD1-CD2 4.05Å; L205-L220 HydrophobicContact CD1-CG 4Å; L205-A242 HydrophobicContact CD1-CB 4.06Å
206	D	88.8	Confident	88.6	Confident	117 Å²	117	57.2 Å²	57.2	63%	0.626	31%	0.31	S	S	*	.	H	α-helix	trans	-71.1	-40.5	177.5	-72.9	-20.9	0	0	0	111.4	L202 D203	L202-D206 PolarHBondContact O-N 3.34Å; D203-D206 PolarHBondContact O-N 3.35Å
207	E	89.2	Confident	88.4	Confident	126 Å²	126	55.5 Å²	55.5	59%	0.589	30%	0.3	S	S	*	.	H	α-helix	trans	-75.8	-34.1	178.2	-71.1	-167.7	-178.9	0	0	113.9	L173 D203	L173-E207 WeakPolarHBondContact CB-OE2 3.39Å; L173-E207 VanDerWaalsContact CD1-CD 3.5Å; L173-E207 VanDerWaalsContact CD1-OE1 3.26Å; L173-E207 WeakPolarHBondContact CD1-OE1 3.3Å; L173-E207 WeakPolarHBondContact CD1-OE2 3.34Å; D203-E207 PolarHBondContact O-N 2.87Å
208	N	87	Confident	88.3	Confident	67 Å²	67	58.7 Å²	58.7	36%	0.358	32%	0.317	S	S	.	.	S	Bend	trans	-103.5	11.1	-175.9	-63.1	-87.4	0	0	0	113.5	L173 W204	L173-N208 PolarHBondContact O-ND2 2.85Å; W204-N208 HydrophobicContact CD2-CB 4.37Å; W204-N208 HydrophobicContact CE3-CB 4.38Å; W204-N208 HydrophobicContact CH2-CB 4.09Å; W204-N208 HydrophobicContact CZ2-CB 4.1Å; W204-N208 HydrophobicContact CZ3-CB 4.27Å; W204-N208 PolarHBondContact NE1-ND2 2.97Å; W204-N208 WeakPolarHBondContact O-CB 3.47Å; W204-N208 PolarHBondContact O-N 3.34Å; W204-N208 PolarHBondContact O-ND2 3.19Å
209	G	78.3	Confident	88.2	Confident	39 Å²	39	58.7 Å²	58.7	40%	0.402	32%	0.317	S	S	.	.			trans	-82.6	166.4	-178.2	0	0	0	0	0	114.9	L205	L205-G209 WeakPolarHBondContact O-CA 3.47Å; L205-G209 PolarHBondContact O-N 3.09Å; L205-G209 VanDerWaalsContact O-N 3.09Å
210	P	74.9	Confident	88.2	Confident	138 Å²	138	53.9 Å²	53.9	90%	0.896	30%	0.299	S	S	*	.			cis	-89.9	116	1.8	32.7	-29.9	0	0	0	112.3
211	L	80.4	Confident	88	Confident	49 Å²	49	55.2 Å²	55.2	26%	0.257	31%	0.308	S	S	.	.			trans	-81.1	152.1	172.3	-73.6	158.5	0	0	0	111	W204 L205 L213 K215	W204-L211 HydrophobicContact CE3-CD1 4.42Å; W204-L211 HydrophobicContact CH2-CD1 3.83Å; W204-L211 HydrophobicContact CZ3-CD1 3.38Å; L205-L211 HydrophobicContact CD2-CD1 3.84Å; L211-L213 PolarHBondContact O-N 2.87Å; L211-K215 HydrophobicContact CB-CB 4.48Å; L211-K215 HydrophobicContact CD2-CD 4.23Å
212	P	85.5	Confident	88	Confident	79 Å²	79	58.8 Å²	58.8	51%	0.513	32%	0.321	S	S	.	.			trans	-52.2	138.4	169.5	-25.2	33.8	0	0	0	111	L214 K215 S216	P212-L214 PolarHBondContact O-N 2.74Å; P212-K215 PolarHBondContact O-N 3.48Å; P212-S216 PolarHBondContact O-N 2.9Å
213	L	84.1	Confident	88.2	Confident	110 Å²	110	58.5 Å²	58.5	58%	0.576	32%	0.32	S	S	*	.	H	α-helix	trans	-50	-33.9	-179.2	-170.8	77.8	0	0	0	112.8	L211 S216 N217 T245	L211-L213 PolarHBondContact O-N 2.87Å; L213-S216 PolarHBondContact O-OG 2.97Å; L213-N217 VanDerWaalsContact O-CB 3.31Å; L213-N217 WeakPolarHBondContact O-CB 3.3Å; L213-N217 PolarHBondContact O-N 3.31Å; L213-N217 PolarHBondContact O-ND2 3.48Å; L213-T245 HydrophobicContact CD1-CG2 3.68Å
214	L	86.9	Confident	88.3	Confident	124 Å²	124	56 Å²	56	65%	0.649	31%	0.307	S	S	*	.	H	α-helix	trans	-62.3	-45.5	176.3	-176.9	62.9	0	0	0	112.1	P212 L218	P212-L214 PolarHBondContact O-N 2.74Å; L214-L218 HydrophobicContact CD1-CD1 4.45Å; L214-L218 HydrophobicContact CD1-CG 4.5Å; L214-L218 HydrophobicContact CG-CD1 4.14Å; L214-L218 WeakPolarHBondContact O-CB 3.45Å; L214-L218 VanDerWaalsContact O-CG 3.22Å; L214-L218 WeakPolarHBondContact O-CG 3.19Å; L214-L218 PolarHBondContact O-N 3.1Å
215	K	88.3	Confident	88.3	Confident	97 Å²	97	55.6 Å²	55.6	42%	0.422	31%	0.305	S	S	.	.	H	α-helix	trans	-68.5	-41.8	-178.7	-74.2	-166.8	175	-173.9	0	111.9	F177 L211 P212 L218 L219	F177-K215 HydrophobicContact CE1-CD 4.48Å; F177-K215 HydrophobicContact CE2-CB 4.15Å; F177-K215 HydrophobicContact CZ-CB 3.96Å; F177-K215 HydrophobicContact CZ-CD 4.46Å; F177-K215 HydrophobicContact CZ-CG 4.23Å; L211-K215 HydrophobicContact CB-CB 4.48Å; L211-K215 HydrophobicContact CD2-CD 4.23Å; P212-K215 PolarHBondContact O-N 3.48Å; K215-L218 PolarHBondContact O-N 3.18Å; K215-L219 PolarHBondContact O-N 2.94Å
216	S	88.6	Confident	88.3	Confident	14 Å²	14	54.9 Å²	54.9	10%	0.098	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-42.6	176.5	57.2	0	0	0	0	112	P212 L213 L218 L219 L220	P212-S216 PolarHBondContact O-N 2.9Å; L213-S216 PolarHBondContact O-OG 2.97Å; S216-L218 PolarHBondContact O-N 3.02Å; S216-L219 PolarHBondContact O-N 3.4Å; S216-L220 WeakPolarHBondContact O-CG 3.3Å; S216-L220 PolarHBondContact O-N 3.47Å
217	N	89.9	Confident	88.5	Confident	19 Å²	19	50.3 Å²	50.3	10%	0.102	28%	0.277	C	S	.	.	H	α-helix	trans	-63	-41.7	174.2	-74.9	-22.3	0	0	0	112.1	L213 L219 S221 T245	L213-N217 VanDerWaalsContact O-CB 3.31Å; L213-N217 WeakPolarHBondContact O-CB 3.3Å; L213-N217 PolarHBondContact O-N 3.31Å; L213-N217 PolarHBondContact O-ND2 3.48Å; N217-L219 VanDerWaalsContact C-N 3.34Å; N217-L219 PolarHBondContact O-N 3.45Å; N217-S221 WeakPolarHBondContact O-CB 3.38Å; N217-S221 PolarHBondContact O-N 2.8Å; N217-S221 PolarHBondContact O-OG 2.87Å; N217-T245 WeakPolarHBondContact OD1-CB 3.43Å; N217-T245 PolarHBondContact OD1-OG1 2.9Å
218	L	90.9	Very high	88.7	Confident	67 Å²	67	44.3 Å²	44.3	35%	0.351	25%	0.249	S	C	.	.	H	α-helix	trans	-60.3	-44.4	177	-78	170.7	0	0	0	111.5	L214 K215 S216 S221 R222	L214-L218 HydrophobicContact CD1-CD1 4.45Å; L214-L218 HydrophobicContact CD1-CG 4.5Å; L214-L218 HydrophobicContact CG-CD1 4.14Å; L214-L218 WeakPolarHBondContact O-CB 3.45Å; L214-L218 VanDerWaalsContact O-CG 3.22Å; L214-L218 WeakPolarHBondContact O-CG 3.19Å; L214-L218 PolarHBondContact O-N 3.1Å; K215-L218 PolarHBondContact O-N 3.18Å; S216-L218 PolarHBondContact O-N 3.02Å; L218-S221 PolarHBondContact O-OG 2.71Å; L218-R222 WeakPolarHBondContact O-CG 3.4Å
219	L	92.1	Very high	88.9	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-55.8	177.4	-175.8	70.8	0	0	0	111.4	F177 L180 M181 L184 W204 L205 K215 S216 N217 S221 R222	F177-L219 HydrophobicContact CE2-CB 4.12Å; F177-L219 HydrophobicContact CE2-CD1 4.43Å; L180-L219 HydrophobicContact CD2-CD1 3.77Å; L180-L219 HydrophobicContact CD2-CD2 4.04Å; L180-L219 HydrophobicContact CG-CD1 3.88Å; M181-L219 HydrophobicContact CG-CD1 4.04Å; L184-L219 HydrophobicContact CD1-CD1 3.69Å; L184-L219 HydrophobicContact CD1-CG 4.21Å; W204-L219 HydrophobicContact CE3-CD2 3.92Å; W204-L219 HydrophobicContact CZ3-CD2 4.2Å; L205-L219 HydrophobicContact CD1-CD2 4.37Å; L205-L219 HydrophobicContact CD2-CD2 3.94Å; L205-L219 HydrophobicContact CG-CD2 3.98Å; K215-L219 PolarHBondContact O-N 2.94Å; S216-L219 PolarHBondContact O-N 3.4Å; N217-L219 VanDerWaalsContact C-N 3.34Å; N217-L219 PolarHBondContact O-N 3.45Å; L219-S221 PolarHBondContact O-N 3.32Å; L219-R222 WeakPolarHBondContact O-CB 3.4Å; L219-R222 PolarHBondContact O-N 2.7Å; L219-R222 VanDerWaalsContact O-N 3.1Å
220	L	91.4	Very high	89.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-28.4	-176.6	-66.7	177.8	0	0	0	112.4	L202 L205 S216 R222 L223 A242 I248	L202-L220 HydrophobicContact CD2-CD2 4.23Å; L205-L220 HydrophobicContact CD1-CD1 4.05Å; L205-L220 HydrophobicContact CD1-CD2 4.05Å; L205-L220 HydrophobicContact CD1-CG 4Å; S216-L220 WeakPolarHBondContact O-CG 3.3Å; S216-L220 PolarHBondContact O-N 3.47Å; L220-R222 PolarHBondContact O-N 2.68Å; L220-L223 HydrophobicContact CD2-CD1 3.77Å; L220-L223 WeakPolarHBondContact O-CB 3.32Å; L220-L223 PolarHBondContact O-N 2.65Å; L220-A242 HydrophobicContact CD1-CB 3.97Å; L220-I248 HydrophobicContact CB-CD1 3.41Å; L220-I248 VanDerWaalsContact CB-CD1 3.41Å; L220-I248 HydrophobicContact CB-CG1 4.03Å; L220-I248 HydrophobicContact CD1-CD1 4.4Å; L220-I248 HydrophobicContact CD1-CG1 4.09Å
221	S	91.7	Very high	90.3	Very high	27 Å²	27	40.3 Å²	40.3	19%	0.189	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.6	176.5	75.3	0	0	0	0	114.6	N217 L218 L219 L223 Q272	N217-S221 WeakPolarHBondContact O-CB 3.38Å; N217-S221 PolarHBondContact O-N 2.8Å; N217-S221 PolarHBondContact O-OG 2.87Å; L218-S221 PolarHBondContact O-OG 2.71Å; L219-S221 PolarHBondContact O-N 3.32Å; S221-L223 VanDerWaalsContact C-N 3.34Å; S221-Q272 PolarHBondContact O-NE2 2.92Å
222	R	93.6	Very high	90.7	Very high	75 Å²	75	41.6 Å²	41.6	28%	0.283	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-16	176.5	-54.8	-49.4	177	159.1	-11.5	113.3	L184 D185 L218 L219 L220 R276	L184-R222 HydrophobicContact CB-CB 3.85Å; D185-R222 WeakPolarHBondContact OD1-CD 3.29Å; D185-R222 IonicContact OD1-CZ 3.95Å; D185-R222 IonicContact OD1-NE 2.77Å; D185-R222 IonicContact OD1-NH1 3.63Å; D185-R222 PolarHBondContact OD1-NH1 3.28Å; L218-R222 WeakPolarHBondContact O-CG 3.4Å; L219-R222 WeakPolarHBondContact O-CB 3.4Å; L219-R222 PolarHBondContact O-N 2.7Å; L219-R222 VanDerWaalsContact O-N 3.1Å; L220-R222 PolarHBondContact O-N 2.68Å; R222-R276 PolarHBondContact O-NH2 2.81Å
223	L	94	Very high	90.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	-77.8	152.1	177.1	-60.6	160.5	0	0	0	110.3	L184 E194 L197 I198 L220 S221 F225 Q272	L184-L223 HydrophobicContact CD1-CD2 4.24Å; L184-L223 HydrophobicContact CD2-CD2 3.81Å; E194-L223 WeakPolarHBondContact OE1-CA 3.26Å; L197-L223 HydrophobicContact CB-CD2 3.75Å; I198-L223 HydrophobicContact CB-CD1 4.32Å; I198-L223 HydrophobicContact CG1-CB 4.09Å; I198-L223 HydrophobicContact CG1-CD1 3.83Å; I198-L223 HydrophobicContact CG1-CD2 4.12Å; I198-L223 HydrophobicContact CG1-CG 4.23Å; L220-L223 HydrophobicContact CD2-CD1 3.77Å; L220-L223 WeakPolarHBondContact O-CB 3.32Å; L220-L223 PolarHBondContact O-N 2.65Å; S221-L223 VanDerWaalsContact C-N 3.34Å; L223-F225 HydrophobicContact CB-CE2 4.38Å; L223-F225 HydrophobicContact CB-CZ 4.26Å; L223-Q272 VanDerWaalsContact O-CD 3.26Å; L223-Q272 PolarHBondContact O-NE2 2.9Å; L223-Q272 PolarHBondContact O-OE1 3.02Å
224	R	93.9	Very high	90.9	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.015	20%	0.197	C	C	.	.			trans	-107.1	79	-174.7	-60.9	-179.9	-170.7	-164.1	0	111.1	D187 E194 G226 L227 R271 Q272 T274 L275	D187-R224 IonicContact OD1-CZ 2.68Å; D187-R224 IonicContact OD1-NH2 3.74Å; D187-R224 PolarHBondContact OD1-NH2 2.71Å; E194-R224 HydrophobicContact CG-CB 4.05Å; E194-R224 WeakPolarHBondContact CG-O 3.25Å; E194-R224 PolarHBondContact OE1-N 3.21Å; R224-G226 PolarHBondContact O-N 3.2Å; R224-L227 HydrophobicContact CB-CD1 3.84Å; R224-L227 HydrophobicContact CB-CG 3.96Å; R224-L227 HydrophobicContact CG-CD1 4.47Å; R224-L227 WeakPolarHBondContact O-CB 3.37Å; R224-L227 PolarHBondContact O-N 3.47Å; R224-R271 WeakPolarHBondContact CD-O 3.43Å; R224-R271 WeakPolarHBondContact CG-O 3.27Å; R224-R271 PolarHBondContact NE-O 3.21Å; R224-Q272 CarbonylContact C-O 3.1Å; R224-Q272 WeakPolarHBondContact CB-O 3.41Å; R224-T274 WeakPolarHBondContact CD-O 3.32Å; R224-T274 PolarHBondContact NH1-O 3.19Å; R224-L275 PolarHBondContact NH1-O 3.36Å
225	F	93.1	Very high	90.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-59.4	-25.6	-174.3	-62.7	-75.9	0	0	0	113.9	I198 L223 L227 V228 L233 M243 I248 Q251 L252 A255	I198-F225 HydrophobicContact CD1-CD1 3.87Å; I198-F225 HydrophobicContact CD1-CE1 3.96Å; I198-F225 HydrophobicContact CG1-CE1 4.19Å; L223-F225 HydrophobicContact CB-CE2 4.38Å; L223-F225 HydrophobicContact CB-CZ 4.26Å; F225-L227 PolarHBondContact O-N 2.54Å; F225-V228 PolarHBondContact O-N 3.3Å; F225-V228 VanDerWaalsContact O-N 3.17Å; F225-L233 HydrophobicContact CB-CD2 4.31Å; F225-L233 HydrophobicContact CD1-CD2 3.96Å; F225-M243 HydrophobicContact CE1-CE 3.79Å; F225-M243 HydrophobicContact CE1-SD 4.38Å; F225-M243 HydrophobicContact CZ-CE 4.49Å; F225-I248 HydrophobicContact CE2-CG2 4.48Å; F225-I248 HydrophobicContact CZ-CG2 4.07Å; F225-Q251 HydrophobicContact CD2-CB 4Å; F225-Q251 HydrophobicContact CE2-CB 4.26Å; F225-L252 HydrophobicContact CB-CD2 4.38Å; F225-L252 HydrophobicContact CD1-CD2 3.69Å; F225-L252 HydrophobicContact CE1-CD2 4.19Å; F225-L252 HydrophobicContact CG-CD2 4.06Å; F225-A255 HydrophobicContact CB-CB 3.78Å
226	G	91.7	Very high	90.6	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.01	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-72.6	-3.7	176.6	0	0	0	0	0	115.1	R224 H259 Q272	R224-G226 PolarHBondContact O-N 3.2Å; G226-H259 PolarHBondContact O-CE1 3.07Å; G226-H259 PolarHBondContact O-NE2 2.9Å; G226-Q272 CarbonylContact C-O 3.59Å; G226-Q272 WeakPolarHBondContact CA-O 3.12Å; G226-Q272 PolarHBondContact N-O 2.83Å
227	L	92.8	Very high	90.2	Very high	21 Å²	21	30.2 Å²	30.2	11%	0.11	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-93.1	-1.3	170.6	-62.6	-175.5	0	0	0	113.2	E194 R224 F225 S273 L275 R361	E194-L227 HydrophobicContact CB-CB 3.98Å; E194-L227 HydrophobicContact CG-CB 4.47Å; R224-L227 HydrophobicContact CB-CD1 3.84Å; R224-L227 HydrophobicContact CB-CG 3.96Å; R224-L227 HydrophobicContact CG-CD1 4.47Å; R224-L227 WeakPolarHBondContact O-CB 3.37Å; R224-L227 PolarHBondContact O-N 3.47Å; F225-L227 PolarHBondContact O-N 2.54Å; L227-S273 WeakPolarHBondContact CD2-O 3.26Å; L227-L275 HydrophobicContact CD2-CD2 4.07Å; L227-L275 HydrophobicContact CD2-CG 4.34Å; L227-R361 HydrophobicContact CD2-CG 3.93Å
228	V	93.6	Very high	89.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.221	C	C	.	.	S	Bend	trans	-106.5	141.4	-177.3	-178.8	0	0	0	0	110.2	E194 V195 I198 F225 E232 L233 H259	E194-V228 HydrophobicContact CB-CG2 4.05Å; E194-V228 HydrophobicContact CG-CG2 4.43Å; V195-V228 HydrophobicContact CG2-CB 4.16Å; V195-V228 HydrophobicContact CG2-CG1 3.57Å; V195-V228 HydrophobicContact CG2-CG2 3.8Å; I198-V228 HydrophobicContact CD1-CG2 3.63Å; F225-V228 PolarHBondContact O-N 3.3Å; F225-V228 VanDerWaalsContact O-N 3.17Å; V228-E232 HydrophobicContact CG1-CB 3.72Å; V228-L233 HydrophobicContact CB-CD2 3.69Å; V228-L233 HydrophobicContact CB-CG 3.88Å; V228-L233 HydrophobicContact CG1-CD2 3.71Å; V228-L233 HydrophobicContact CG1-CG 3.74Å; V228-L233 HydrophobicContact CG2-CD2 4.29Å; V228-H259 PolarHBondContact O-NE2 2.99Å; V228-H259 VanDerWaalsContact O-NE2 3.15Å
229	A	91.6	Very high	88.4	Confident	19 Å²	19	37.2 Å²	37.2	16%	0.157	23%	0.234	C	C	.	.			trans	-63.7	142.3	177.5	0	0	0	0	0	111.3	S231 E232 L233 F362	A229-S231 PolarHBondContact O-N 3.15Å; A229-S231 VanDerWaalsContact O-N 3.14Å; A229-E232 HydrophobicContact CB-CG 4.37Å; A229-E232 PolarHBondContact O-N 2.88Å; A229-L233 PolarHBondContact O-N 3.31Å; A229-F362 HydrophobicContact CB-CE1 4.1Å
230	P	91.4	Very high	87.7	Confident	48 Å²	48	39.2 Å²	39.2	31%	0.312	25%	0.245	S	C	.	.	H	α-helix	trans	-55	-33.5	179.4	-29.7	35.9	0	0	0	115	S234 L256 H259	P230-S234 PolarHBondContact O-N 3.31Å; P230-S234 VanDerWaalsContact O-N 3.12Å; P230-S234 PolarHBondContact O-OG 2.96Å; P230-L256 HydrophobicContact CB-CD2 3.87Å; P230-L256 HydrophobicContact CG-CD2 4.41Å; P230-H259 HydrophobicContact CG-CB 3.93Å
231	S	90.1	Very high	87.1	Confident	92 Å²	92	50.5 Å²	50.5	64%	0.643	29%	0.287	S	S	*	.	H	α-helix	trans	-65.1	-41.8	176	48.8	0	0	0	0	112.2	A229 G235	A229-S231 PolarHBondContact O-N 3.15Å; A229-S231 VanDerWaalsContact O-N 3.14Å; S231-G235 PolarHBondContact O-N 3.24Å
232	E	89.3	Confident	86.6	Confident	77 Å²	77	50.4 Å²	50.4	36%	0.36	29%	0.288	S	S	.	.	H	α-helix	trans	-72.5	-40	178.6	-66	-174.9	104.7	0	0	111.9	V228 A229 S234 G235 L236	V228-E232 HydrophobicContact CG1-CB 3.72Å; A229-E232 HydrophobicContact CB-CG 4.37Å; A229-E232 PolarHBondContact O-N 2.88Å; E232-S234 VanDerWaalsContact C-N 3.28Å; E232-S234 PolarHBondContact O-N 3.22Å; E232-G235 PolarHBondContact O-N 3.32Å; E232-L236 WeakPolarHBondContact O-CG 3.4Å; E232-L236 PolarHBondContact O-N 3.44Å
233	L	88.8	Confident	86	Confident	3 Å²	3	47 Å²	47	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-57.2	-44.3	173.5	-73.3	179.9	0	0	0	111.3	F225 V228 A229 G235 L236 C237 L252 A255 L256	F225-L233 HydrophobicContact CB-CD2 4.31Å; F225-L233 HydrophobicContact CD1-CD2 3.96Å; V228-L233 HydrophobicContact CB-CD2 3.69Å; V228-L233 HydrophobicContact CB-CG 3.88Å; V228-L233 HydrophobicContact CG1-CD2 3.71Å; V228-L233 HydrophobicContact CG1-CG 3.74Å; V228-L233 HydrophobicContact CG2-CD2 4.29Å; A229-L233 PolarHBondContact O-N 3.31Å; L233-G235 VanDerWaalsContact C-N 3.34Å; L233-G235 PolarHBondContact O-N 3.11Å; L233-L236 PolarHBondContact O-N 3.34Å; L233-C237 PolarHBondContact O-N 3.46Å; L233-C237 PolarHBondContact O-SG 2.87Å; L233-L252 HydrophobicContact CD1-CD2 4.47Å; L233-L252 HydrophobicContact CD2-CD2 3.82Å; L233-A255 HydrophobicContact CD1-CB 4.26Å; L233-L256 HydrophobicContact CD1-CD2 4.33Å
234	S	85.6	Confident	85.5	Confident	59 Å²	59	49.9 Å²	49.9	41%	0.413	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-43.9	178.1	-58.8	0	0	0	0	111	P230 E232 L236 C237 H238	P230-S234 PolarHBondContact O-N 3.31Å; P230-S234 VanDerWaalsContact O-N 3.12Å; P230-S234 PolarHBondContact O-OG 2.96Å; E232-S234 VanDerWaalsContact C-N 3.28Å; E232-S234 PolarHBondContact O-N 3.22Å; S234-L236 PolarHBondContact O-N 2.98Å; S234-C237 PolarHBondContact O-N 2.95Å; S234-H238 PolarHBondContact O-CE1 2.9Å; S234-H238 PolarHBondContact O-ND1 3.44Å
235	G	85.2	Confident	85.1	Confident	51 Å²	51	50.4 Å²	50.4	53%	0.526	30%	0.303	S	S	.	.	H	α-helix	trans	-60.4	-43.3	176.3	0	0	0	0	0	113.6	S231 E232 L233 C237 H238	S231-G235 PolarHBondContact O-N 3.24Å; E232-G235 PolarHBondContact O-N 3.32Å; L233-G235 VanDerWaalsContact C-N 3.34Å; L233-G235 PolarHBondContact O-N 3.11Å; G235-C237 VanDerWaalsContact C-N 3.32Å; G235-C237 PolarHBondContact O-N 2.91Å; G235-H238 PolarHBondContact O-N 2.64Å
236	L	83.3	Confident	84.9	Confident	20 Å²	20	55.5 Å²	55.5	11%	0.105	34%	0.336	C	S	.	.	H	α-helix	trans	-65.9	-31.3	-179	-69.7	168.8	0	0	0	113.5	V195 I198 R199 L202 E232 L233 S234 N240 M243	V195-L236 HydrophobicContact CG1-CD1 4.3Å; I198-L236 HydrophobicContact CB-CD1 4.49Å; I198-L236 HydrophobicContact CD1-CD1 4.48Å; I198-L236 HydrophobicContact CG2-CD1 3.94Å; R199-L236 HydrophobicContact CG-CD2 4.12Å; L202-L236 HydrophobicContact CD1-CD2 4.48Å; E232-L236 WeakPolarHBondContact O-CG 3.4Å; E232-L236 PolarHBondContact O-N 3.44Å; L233-L236 PolarHBondContact O-N 3.34Å; S234-L236 PolarHBondContact O-N 2.98Å; L236-N240 PolarHBondContact O-ND2 3.42Å; L236-N240 VanDerWaalsContact O-ND2 3.16Å; L236-M243 HydrophobicContact CB-CE 4.48Å
237	C	79.8	Confident	84.8	Confident	52 Å²	52	59.2 Å²	59.2	35%	0.351	36%	0.355	S	S	.	.	H	α-helix	trans	-70.4	-33.1	-178.6	-66.8	0	0	0	0	113.5	L233 S234 G235 G239 L252	L233-C237 PolarHBondContact O-N 3.46Å; L233-C237 PolarHBondContact O-SG 2.87Å; S234-C237 PolarHBondContact O-N 2.95Å; G235-C237 VanDerWaalsContact C-N 3.32Å; G235-C237 PolarHBondContact O-N 2.91Å; C237-G239 VanDerWaalsContact C-N 3.3Å; C237-G239 PolarHBondContact O-N 3.31Å; C237-L252 VanDerWaalsContact SG-CD1 3.56Å
238	H	73.5	Confident	84.6	Confident	171 Å²	171	58.2 Å²	58.2	79%	0.792	35%	0.35	S	S	*	.	H	α-helix	trans	-75.2	-19.9	-175.5	-68.7	88.4	0	0	0	113.1	S234 G235	S234-H238 PolarHBondContact O-CE1 2.9Å; S234-H238 PolarHBondContact O-ND1 3.44Å; G235-H238 PolarHBondContact O-N 2.64Å
239	G	70.3	Confident	84.4	Confident	62 Å²	62	65.7 Å²	65.7	64%	0.639	38%	0.378	S	S	*	.	H	α-helix	trans	-96.2	-22	-174.8	0	0	0	0	0	116	C237	C237-G239 VanDerWaalsContact C-N 3.3Å; C237-G239 PolarHBondContact O-N 3.31Å
240	N	76.8	Confident	84.4	Confident	41 Å²	41	67.9 Å²	67.9	22%	0.219	39%	0.393	C	S	.	.			trans	-128.2	121.6	-159.8	-64.1	-65.4	0	0	0	114	L202 L236 A242 M243	L202-N240 HydrophobicContact CD1-CB 4.36Å; L202-N240 HydrophobicContact CD2-CB 4.12Å; L236-N240 PolarHBondContact O-ND2 3.42Å; L236-N240 VanDerWaalsContact O-ND2 3.16Å; N240-A242 VanDerWaalsContact C-N 3.29Å; N240-A242 PolarHBondContact O-N 3.12Å; N240-M243 HydrophobicContact CB-CB 4.44Å; N240-M243 HydrophobicContact CB-CG 3.91Å; N240-M243 WeakPolarHBondContact O-CB 3.17Å; N240-M243 PolarHBondContact O-N 2.98Å; N240-M243 VanDerWaalsContact O-N 3.16Å
241	R	79.7	Confident	84.4	Confident	238 Å²	238	67.3 Å²	67.3	90%	0.898	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-62.7	-34.4	178.9	-66.7	-178.3	-179.3	-177	1.2	112.7	M243 A244	R241-M243 PolarHBondContact O-N 2.94Å; R241-A244 WeakPolarHBondContact O-CB 3.48Å; R241-A244 PolarHBondContact O-N 3.4Å; R241-A244 VanDerWaalsContact O-N 3.07Å
242	A	80.8	Confident	84.5	Confident	24 Å²	24	63.5 Å²	63.5	20%	0.198	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-62.9	-24	178.7	0	0	0	0	0	113.1	L202 L205 L220 N240 A244	L202-A242 HydrophobicContact CD2-CB 4.15Å; L205-A242 HydrophobicContact CD1-CB 4.06Å; L220-A242 HydrophobicContact CD1-CB 3.97Å; N240-A242 VanDerWaalsContact C-N 3.29Å; N240-A242 PolarHBondContact O-N 3.12Å; A242-A244 VanDerWaalsContact C-N 3.34Å
243	M	81.3	Confident	84.6	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.02	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-81.8	-12.7	177.6	-63.7	-68.7	-81.4	0	0	113.1	L202 F225 L236 N240 R241 T245 I248 L252	L202-M243 HydrophobicContact CD1-CG 4.39Å; L202-M243 HydrophobicContact CD2-CG 3.95Å; L202-M243 HydrophobicContact CD2-SD 4.16Å; F225-M243 HydrophobicContact CE1-CE 3.79Å; F225-M243 HydrophobicContact CE1-SD 4.38Å; F225-M243 HydrophobicContact CZ-CE 4.49Å; L236-M243 HydrophobicContact CB-CE 4.48Å; N240-M243 HydrophobicContact CB-CB 4.44Å; N240-M243 HydrophobicContact CB-CG 3.91Å; N240-M243 WeakPolarHBondContact O-CB 3.17Å; N240-M243 PolarHBondContact O-N 2.98Å; N240-M243 VanDerWaalsContact O-N 3.16Å; R241-M243 PolarHBondContact O-N 2.94Å; M243-T245 VanDerWaalsContact C-N 3.29Å; M243-T245 PolarHBondContact O-N 2.86Å; M243-I248 HydrophobicContact CE-CG2 4.36Å; M243-I248 HydrophobicContact SD-CG2 3.87Å; M243-L252 HydrophobicContact CE-CD1 4.08Å; M243-L252 HydrophobicContact CE-CD2 4.13Å
244	A	83.1	Confident	84.8	Confident	61 Å²	61	70 Å²	70	50%	0.504	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-82.7	-3.5	-177.5	0	0	0	0	0	113.5	R241 A242 R249	R241-A244 WeakPolarHBondContact O-CB 3.48Å; R241-A244 PolarHBondContact O-N 3.4Å; R241-A244 VanDerWaalsContact O-N 3.07Å; A242-A244 VanDerWaalsContact C-N 3.34Å; A244-R249 VanDerWaalsContact O-CD 3.3Å; A244-R249 WeakPolarHBondContact O-CD 3.17Å
245	T	86.4	Confident	85.2	Confident	14 Å²	14	67.4 Å²	67.4	9%	0.086	37%	0.369	C	S	.	.	S	Bend	trans	-68.3	147.1	-177.2	70.6	0	0	0	0	111.3	L213 N217 M243 L247 I248 R249	L213-T245 HydrophobicContact CD1-CG2 3.68Å; N217-T245 WeakPolarHBondContact OD1-CB 3.43Å; N217-T245 PolarHBondContact OD1-OG1 2.9Å; M243-T245 VanDerWaalsContact C-N 3.29Å; M243-T245 PolarHBondContact O-N 2.86Å; T245-L247 VanDerWaalsContact C-N 3.25Å; T245-L247 PolarHBondContact O-N 3.1Å; T245-I248 PolarHBondContact O-N 3.39Å; T245-I248 VanDerWaalsContact OG1-CG1 3.3Å; T245-I248 WeakPolarHBondContact OG1-CG1 3.38Å; T245-R249 WeakPolarHBondContact O-CB 3.41Å; T245-R249 VanDerWaalsContact O-CG 3.31Å; T245-R249 WeakPolarHBondContact O-CG 3.44Å; T245-R249 PolarHBondContact O-N 3.11Å
246	P	88	Confident	85.5	Confident	107 Å²	107	67.8 Å²	67.8	70%	0.695	36%	0.359	S	S	*	.	H	α-helix	trans	-57	-36.9	-177.1	-27.1	34.8	0	0	0	113.9	S250	P246-S250 WeakPolarHBondContact O-CB 3.05Å; P246-S250 PolarHBondContact O-N 2.89Å
247	L	89	Confident	86	Confident	79 Å²	79	72.1 Å²	72.1	41%	0.414	38%	0.379	S	S	.	.	H	α-helix	trans	-66.2	-47.9	179.8	-172.3	150.4	0	0	0	111.3	T245 S250 Q251	T245-L247 VanDerWaalsContact C-N 3.25Å; T245-L247 PolarHBondContact O-N 3.1Å; L247-S250 WeakPolarHBondContact O-CB 3.49Å; L247-S250 PolarHBondContact O-N 2.98Å; L247-Q251 HydrophobicContact CD2-CG 4.49Å; L247-Q251 PolarHBondContact O-N 2.49Å; L247-Q251 VanDerWaalsContact O-N 3.09Å
248	I	89.4	Confident	86.7	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-70	-38.1	179.9	-59.3	-55.8	0	0	0	110.9	L220 F225 M243 T245 S250 Q251 L252	L220-I248 HydrophobicContact CB-CD1 3.41Å; L220-I248 VanDerWaalsContact CB-CD1 3.41Å; L220-I248 HydrophobicContact CB-CG1 4.03Å; L220-I248 HydrophobicContact CD1-CD1 4.4Å; L220-I248 HydrophobicContact CD1-CG1 4.09Å; F225-I248 HydrophobicContact CE2-CG2 4.48Å; F225-I248 HydrophobicContact CZ-CG2 4.07Å; M243-I248 HydrophobicContact CE-CG2 4.36Å; M243-I248 HydrophobicContact SD-CG2 3.87Å; T245-I248 PolarHBondContact O-N 3.39Å; T245-I248 VanDerWaalsContact OG1-CG1 3.3Å; T245-I248 WeakPolarHBondContact OG1-CG1 3.38Å; I248-S250 VanDerWaalsContact C-N 3.32Å; I248-S250 PolarHBondContact O-N 2.74Å; I248-Q251 PolarHBondContact O-N 3.37Å; I248-Q251 VanDerWaalsContact O-N 3.14Å; I248-L252 HydrophobicContact CG2-CD1 4.04Å; I248-L252 HydrophobicContact CG2-CG 4.34Å; I248-L252 VanDerWaalsContact O-CG 3.3Å; I248-L252 WeakPolarHBondContact O-CG 3.49Å; I248-L252 PolarHBondContact O-N 3.34Å
249	R	89.4	Confident	87.6	Confident	157 Å²	157	63.6 Å²	63.6	59%	0.592	33%	0.333	S	S	*	.	H	α-helix	trans	-57.4	-43.9	171.3	-72.1	-179.9	67	122.9	4.9	112.2	A244 T245 Q251 L252 T253	A244-R249 VanDerWaalsContact O-CD 3.3Å; A244-R249 WeakPolarHBondContact O-CD 3.17Å; T245-R249 WeakPolarHBondContact O-CB 3.41Å; T245-R249 VanDerWaalsContact O-CG 3.31Å; T245-R249 WeakPolarHBondContact O-CG 3.44Å; T245-R249 PolarHBondContact O-N 3.11Å; R249-Q251 VanDerWaalsContact C-N 3.34Å; R249-Q251 PolarHBondContact O-N 3.38Å; R249-L252 PolarHBondContact O-N 2.88Å; R249-T253 PolarHBondContact O-N 3.42Å; R249-T253 PolarHBondContact O-OG1 3.06Å; R249-T253 VanDerWaalsContact O-OG1 3.06Å
250	S	91.7	Very high	88.6	Confident	66 Å²	66	68 Å²	68	46%	0.462	34%	0.337	S	S	.	.	H	α-helix	trans	-61.4	-41.8	175.4	179.4	0	0	0	0	112	P246 L247 I248 T253 R254	P246-S250 WeakPolarHBondContact O-CB 3.05Å; P246-S250 PolarHBondContact O-N 2.89Å; L247-S250 WeakPolarHBondContact O-CB 3.49Å; L247-S250 PolarHBondContact O-N 2.98Å; I248-S250 VanDerWaalsContact C-N 3.32Å; I248-S250 PolarHBondContact O-N 2.74Å; S250-T253 PolarHBondContact O-N 2.82Å; S250-R254 WeakPolarHBondContact O-CG 3.44Å; S250-R254 PolarHBondContact O-N 2.76Å
251	Q	91.4	Very high	89.3	Confident	35 Å²	35	70 Å²	70	16%	0.164	35%	0.346	C	S	.	.	H	α-helix	trans	-65.1	-40.4	176.3	-69.8	-176.9	-27.8	0	0	112.5	F225 L247 I248 R249 R254 A255	F225-Q251 HydrophobicContact CD2-CB 4Å; F225-Q251 HydrophobicContact CE2-CB 4.26Å; L247-Q251 HydrophobicContact CD2-CG 4.49Å; L247-Q251 PolarHBondContact O-N 2.49Å; L247-Q251 VanDerWaalsContact O-N 3.09Å; I248-Q251 PolarHBondContact O-N 3.37Å; I248-Q251 VanDerWaalsContact O-N 3.14Å; R249-Q251 VanDerWaalsContact C-N 3.34Å; R249-Q251 PolarHBondContact O-N 3.38Å; Q251-R254 PolarHBondContact O-N 3.43Å; Q251-A255 PolarHBondContact O-N 3.22Å
252	L	91.5	Very high	89.8	Confident	12 Å²	12	59.6 Å²	59.6	6%	0.063	31%	0.312	C	S	.	.	H	α-helix	trans	-63.9	-45	175.3	-71.3	165.6	0	0	0	111.7	F225 L233 C237 M243 I248 R249 R254 A255 L256	F225-L252 HydrophobicContact CB-CD2 4.38Å; F225-L252 HydrophobicContact CD1-CD2 3.69Å; F225-L252 HydrophobicContact CE1-CD2 4.19Å; F225-L252 HydrophobicContact CG-CD2 4.06Å; L233-L252 HydrophobicContact CD1-CD2 4.47Å; L233-L252 HydrophobicContact CD2-CD2 3.82Å; C237-L252 VanDerWaalsContact SG-CD1 3.56Å; M243-L252 HydrophobicContact CE-CD1 4.08Å; M243-L252 HydrophobicContact CE-CD2 4.13Å; I248-L252 HydrophobicContact CG2-CD1 4.04Å; I248-L252 HydrophobicContact CG2-CG 4.34Å; I248-L252 VanDerWaalsContact O-CG 3.3Å; I248-L252 WeakPolarHBondContact O-CG 3.49Å; I248-L252 PolarHBondContact O-N 3.34Å; R249-L252 PolarHBondContact O-N 2.88Å; L252-R254 VanDerWaalsContact C-N 3.32Å; L252-R254 PolarHBondContact O-N 3.37Å; L252-A255 WeakPolarHBondContact O-CB 3.46Å; L252-A255 PolarHBondContact O-N 2.88Å; L252-L256 WeakPolarHBondContact O-CG 3.46Å; L252-L256 PolarHBondContact O-N 2.77Å
253	T	91.9	Very high	90.3	Very high	71 Å²	71	59.5 Å²	59.5	44%	0.436	31%	0.311	S	S	.	.	H	α-helix	trans	-57.7	-46.5	175.1	-60.6	0	0	0	0	110.8	R249 S250 A255 L256 E257	R249-T253 PolarHBondContact O-N 3.42Å; R249-T253 PolarHBondContact O-OG1 3.06Å; R249-T253 VanDerWaalsContact O-OG1 3.06Å; S250-T253 PolarHBondContact O-N 2.82Å; T253-A255 VanDerWaalsContact C-N 3.34Å; T253-A255 PolarHBondContact O-N 2.62Å; T253-L256 PolarHBondContact O-N 2.96Å; T253-E257 HydrophobicContact CG2-CG 4.4Å; T253-E257 WeakPolarHBondContact O-CB 3.41Å; T253-E257 WeakPolarHBondContact O-CG 3.28Å; T253-E257 PolarHBondContact O-N 2.97Å
254	R	92.8	Very high	90.9	Very high	146 Å²	146	60 Å²	60	55%	0.551	32%	0.315	S	S	*	.	H	α-helix	trans	-62	-38.7	176.6	-72	175	62.7	178.8	0.7	113	S250 Q251 L252 Y258	S250-R254 WeakPolarHBondContact O-CG 3.44Å; S250-R254 PolarHBondContact O-N 2.76Å; Q251-R254 PolarHBondContact O-N 3.43Å; L252-R254 VanDerWaalsContact C-N 3.32Å; L252-R254 PolarHBondContact O-N 3.37Å; R254-Y258 WeakPolarHBondContact O-CB 3.47Å; R254-Y258 PolarHBondContact O-N 2.83Å
255	A	93.1	Very high	91.4	Very high	5 Å²	5	57.5 Å²	57.5	4%	0.041	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-45.5	175.2	0	0	0	0	0	111.1	F225 L233 Q251 L252 T253 Y258 H259	F225-A255 HydrophobicContact CB-CB 3.78Å; L233-A255 HydrophobicContact CD1-CB 4.26Å; Q251-A255 PolarHBondContact O-N 3.22Å; L252-A255 WeakPolarHBondContact O-CB 3.46Å; L252-A255 PolarHBondContact O-N 2.88Å; T253-A255 VanDerWaalsContact C-N 3.34Å; T253-A255 PolarHBondContact O-N 2.62Å; A255-Y258 WeakPolarHBondContact O-CB 3.28Å; A255-Y258 PolarHBondContact O-N 3.12Å; A255-H259 PolarHBondContact O-CD2 2.98Å; A255-H259 PolarHBondContact O-N 2.99Å
256	L	92.6	Very high	91.7	Very high	58 Å²	58	57 Å²	57	30%	0.304	29%	0.29	S	S	.	.	H	α-helix	trans	-62.7	-46.1	176.1	-68.5	173.3	0	0	0	111.6	P230 L233 L252 T253 Y258 H259 H260	P230-L256 HydrophobicContact CB-CD2 3.87Å; P230-L256 HydrophobicContact CG-CD2 4.41Å; L233-L256 HydrophobicContact CD1-CD2 4.33Å; L252-L256 WeakPolarHBondContact O-CG 3.46Å; L252-L256 PolarHBondContact O-N 2.77Å; T253-L256 PolarHBondContact O-N 2.96Å; L256-Y258 VanDerWaalsContact C-N 3.3Å; L256-Y258 PolarHBondContact O-N 3.41Å; L256-H259 PolarHBondContact O-N 2.91Å; L256-H259 VanDerWaalsContact O-N 3.07Å; L256-H260 PolarHBondContact O-N 3.19Å; L256-H260 VanDerWaalsContact O-N 3.13Å; L256-H260 PolarHBondContact O-ND1 2.91Å
257	E	93.6	Very high	92	Very high	112 Å²	112	55.1 Å²	55.1	52%	0.523	28%	0.277	S	S	.	.	H	α-helix	trans	-54	-48.8	174.1	-75.4	169.9	176.8	0	0	110.7	T253 H259 H260 M261	T253-E257 HydrophobicContact CG2-CG 4.4Å; T253-E257 WeakPolarHBondContact O-CB 3.41Å; T253-E257 WeakPolarHBondContact O-CG 3.28Å; T253-E257 PolarHBondContact O-N 2.97Å; E257-H259 VanDerWaalsContact C-N 3.29Å; E257-H259 PolarHBondContact O-N 3.32Å; E257-H260 WeakPolarHBondContact O-CA 3.42Å; E257-H260 PolarHBondContact O-N 2.94Å; E257-M261 WeakPolarHBondContact O-CG 3.04Å; E257-M261 PolarHBondContact O-N 2.96Å; E257-M261 VanDerWaalsContact O-N 3.12Å
258	Y	93.8	Very high	92.1	Very high	12 Å²	12	52.8 Å²	52.8	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-56.8	-39.4	176.1	172.3	-88	0	0	0	112.7	R254 A255 L256 H260 M261 Q265 A268 Q269 F330 R361	R254-Y258 WeakPolarHBondContact O-CB 3.47Å; R254-Y258 PolarHBondContact O-N 2.83Å; A255-Y258 WeakPolarHBondContact O-CB 3.28Å; A255-Y258 PolarHBondContact O-N 3.12Å; L256-Y258 VanDerWaalsContact C-N 3.3Å; L256-Y258 PolarHBondContact O-N 3.41Å; Y258-H260 VanDerWaalsContact C-N 3.29Å; Y258-H260 PolarHBondContact O-N 3.49Å; Y258-M261 HydrophobicContact CD2-SD 4.4Å; Y258-M261 PolarHBondContact O-N 3.26Å; Y258-Q265 HydrophobicContact CE1-CG 4.32Å; Y258-Q265 HydrophobicContact CE2-CB 4.04Å; Y258-Q265 HydrophobicContact CE2-CG 4.12Å; Y258-Q265 WeakPolarHBondContact CE2-O 3.14Å; Y258-Q265 WeakPolarHBondContact O-CG 3.49Å; Y258-Q265 PolarHBondContact O-NE2 3.14Å; Y258-A268 HydrophobicContact CD2-CB 4.32Å; Y258-A268 HydrophobicContact CE2-CB 4.45Å; Y258-Q269 PolarHBondContact OH-NE2 2.84Å; Y258-F330 WeakPolarHBondContact OH-CZ 3.34Å; Y258-R361 VanDerWaalsContact CZ-NH1 3.25Å; Y258-R361 PolarHBondContact OH-NH1 3.23Å; Y258-R361 PolarHBondContact OH-NH2 2.95Å
259	H	91.9	Very high	92.1	Very high	32 Å²	32	55.3 Å²	55.3	15%	0.148	28%	0.28	C	S	.	.	H	α-helix	trans	-65.2	-30.6	174.2	-72.2	-62.3	0	0	0	113.3	G226 V228 P230 A255 L256 E257 Q265 F362	G226-H259 PolarHBondContact O-CE1 3.07Å; G226-H259 PolarHBondContact O-NE2 2.9Å; V228-H259 PolarHBondContact O-NE2 2.99Å; V228-H259 VanDerWaalsContact O-NE2 3.15Å; P230-H259 HydrophobicContact CG-CB 3.93Å; A255-H259 PolarHBondContact O-CD2 2.98Å; A255-H259 PolarHBondContact O-N 2.99Å; L256-H259 PolarHBondContact O-N 2.91Å; L256-H259 VanDerWaalsContact O-N 3.07Å; E257-H259 VanDerWaalsContact C-N 3.29Å; E257-H259 PolarHBondContact O-N 3.32Å; H259-Q265 PolarHBondContact O-NE2 2.73Å; H259-F362 AromaticContact CE1-CE2 3.81Å; H259-F362 AromaticContact CE1-CZ 3.57Å
260	H	92.1	Very high	92.2	Very high	154 Å²	154	49.9 Å²	49.9	71%	0.713	27%	0.266	S	S	*	.	H	α-helix	trans	-81.3	-16	178.2	-68.5	88.7	0	0	0	113.9	L256 E257 Y258 G262	L256-H260 PolarHBondContact O-N 3.19Å; L256-H260 VanDerWaalsContact O-N 3.13Å; L256-H260 PolarHBondContact O-ND1 2.91Å; E257-H260 WeakPolarHBondContact O-CA 3.42Å; E257-H260 PolarHBondContact O-N 2.94Å; Y258-H260 VanDerWaalsContact C-N 3.29Å; Y258-H260 PolarHBondContact O-N 3.49Å; H260-G262 PolarHBondContact O-N 3.06Å
261	M	91.6	Very high	92.1	Very high	84 Å²	84	51.6 Å²	51.6	41%	0.414	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-12.5	-177.8	-68.9	-179.5	91.2	0	0	115	E257 Y258 S263 A264 Q265 A268	E257-M261 WeakPolarHBondContact O-CG 3.04Å; E257-M261 PolarHBondContact O-N 2.96Å; E257-M261 VanDerWaalsContact O-N 3.12Å; Y258-M261 HydrophobicContact CD2-SD 4.4Å; Y258-M261 PolarHBondContact O-N 3.26Å; M261-S263 PolarHBondContact O-N 2.75Å; M261-A264 HydrophobicContact CB-CB 4.35Å; M261-A264 HydrophobicContact CE-CB 4.33Å; M261-A264 PolarHBondContact O-N 2.92Å; M261-Q265 HydrophobicContact CB-CG 4.03Å; M261-A268 HydrophobicContact CE-CB 3.45Å; M261-A268 VanDerWaalsContact CE-CB 3.45Å; M261-A268 HydrophobicContact SD-CB 3.48Å; M261-A268 WeakPolarHBondContact SD-CB 3.11Å
262	G	89.7	Confident	92.1	Very high	18 Å²	18	51.7 Å²	51.7	19%	0.186	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	58.1	-112.4	173	0	0	0	0	0	113.3	H260 A264 Q265 R357	H260-G262 PolarHBondContact O-N 3.06Å; G262-A264 VanDerWaalsContact C-N 3.32Å; G262-A264 PolarHBondContact O-N 3.35Å; G262-Q265 WeakPolarHBondContact O-CG 3.43Å; G262-Q265 PolarHBondContact O-OE1 2.99Å; G262-R357 PolarHBondContact O-NH1 2.96Å; G262-R357 PolarHBondContact O-NH2 3.41Å
263	S	91	Very high	92	Very high	23 Å²	23	51.2 Å²	51.2	16%	0.161	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-67.9	-26.2	-179.9	55.1	0	0	0	0	113.9	M261 Q265 P266 Y411 M413 G416	M261-S263 PolarHBondContact O-N 2.75Å; S263-Q265 VanDerWaalsContact C-N 3.28Å; S263-Q265 PolarHBondContact O-N 2.96Å; S263-P266 WeakPolarHBondContact O-CD 3.28Å; S263-Y411 VanDerWaalsContact CB-OH 3.32Å; S263-Y411 WeakPolarHBondContact CB-OH 3.38Å; S263-M413 CarbonylContact C-O 3.52Å; S263-M413 VanDerWaalsContact C-O 3.26Å; S263-M413 WeakPolarHBondContact CB-O 3.28Å; S263-M413 PolarHBondContact OG-O 3.3Å; S263-G416 WeakPolarHBondContact OG-CA 3.33Å
264	A	94.1	Very high	92	Very high	13 Å²	13	50.8 Å²	50.8	11%	0.107	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-83.1	-2.2	-175.8	0	0	0	0	0	113.8	M261 G262 T267 A268 M413	M261-A264 HydrophobicContact CB-CB 4.35Å; M261-A264 HydrophobicContact CE-CB 4.33Å; M261-A264 PolarHBondContact O-N 2.92Å; G262-A264 VanDerWaalsContact C-N 3.32Å; G262-A264 PolarHBondContact O-N 3.35Å; A264-T267 PolarHBondContact O-N 3.46Å; A264-T267 PolarHBondContact O-OG1 3.49Å; A264-A268 WeakPolarHBondContact O-CB 3.47Å; A264-A268 PolarHBondContact O-N 2.9Å; A264-M413 VanDerWaalsContact CA-O 3.31Å; A264-M413 WeakPolarHBondContact CA-O 3.27Å; A264-M413 PolarHBondContact N-O 2.56Å
265	Q	94	Very high	91.8	Very high	10 Å²	10	45.2 Å²	45.2	5%	0.047	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-40.9	177.4	-74.5	-179.7	-38.4	0	0	115.2	Y258 H259 M261 G262 S263 T267 A268 Q269 F330	Y258-Q265 HydrophobicContact CE1-CG 4.32Å; Y258-Q265 HydrophobicContact CE2-CB 4.04Å; Y258-Q265 HydrophobicContact CE2-CG 4.12Å; Y258-Q265 WeakPolarHBondContact CE2-O 3.14Å; Y258-Q265 WeakPolarHBondContact O-CG 3.49Å; Y258-Q265 PolarHBondContact O-NE2 3.14Å; H259-Q265 PolarHBondContact O-NE2 2.73Å; M261-Q265 HydrophobicContact CB-CG 4.03Å; G262-Q265 WeakPolarHBondContact O-CG 3.43Å; G262-Q265 PolarHBondContact O-OE1 2.99Å; S263-Q265 VanDerWaalsContact C-N 3.28Å; S263-Q265 PolarHBondContact O-N 2.96Å; Q265-T267 VanDerWaalsContact C-N 3.31Å; Q265-T267 PolarHBondContact O-N 2.55Å; Q265-A268 PolarHBondContact O-N 3.48Å; Q265-Q269 PolarHBondContact O-NE2 3.48Å; Q265-F330 HydrophobicContact CB-CE2 3.86Å; Q265-F330 HydrophobicContact CB-CZ 3.65Å
266	P	93.4	Very high	91.6	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.019	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-38.5	179.5	-24.2	36.1	0	0	0	113.1	S263 V327 G328 F330 F332 M413	S263-P266 WeakPolarHBondContact O-CD 3.28Å; P266-V327 HydrophobicContact CB-CB 4.25Å; P266-V327 HydrophobicContact CB-CG1 3.87Å; P266-G328 VanDerWaalsContact O-CA 3.28Å; P266-G328 WeakPolarHBondContact O-CA 3.41Å; P266-F330 HydrophobicContact CB-CD2 4Å; P266-F330 HydrophobicContact CB-CE2 4.39Å; P266-F330 HydrophobicContact CG-CD2 3.69Å; P266-F330 HydrophobicContact CG-CE2 4.02Å; P266-F330 HydrophobicContact CG-CG 4.34Å; P266-F332 HydrophobicContact CG-CE2 4.25Å; P266-F332 HydrophobicContact CG-CZ 3.97Å; P266-M413 HydrophobicContact CB-SD 4.37Å; P266-M413 HydrophobicContact CG-SD 3.96Å
267	T	93.3	Very high	91	Very high	68 Å²	68	43.7 Å²	43.7	42%	0.417	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-15.3	-179.3	51.1	0	0	0	0	113.2	A264 Q265 D385 M413	A264-T267 PolarHBondContact O-N 3.46Å; A264-T267 PolarHBondContact O-OG1 3.49Å; Q265-T267 VanDerWaalsContact C-N 3.31Å; Q265-T267 PolarHBondContact O-N 2.55Å; T267-D385 HydrophobicContact CG2-CB 3.75Å; T267-M413 HydrophobicContact CG2-CB 3.89Å; T267-M413 HydrophobicContact CG2-CG 4.04Å
268	A	92.4	Very high	90	Very high	30 Å²	30	39.2 Å²	39.2	25%	0.248	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	19	-177.6	0	0	0	0	0	113.4	Y258 M261 A264 Q265 S270	Y258-A268 HydrophobicContact CD2-CB 4.32Å; Y258-A268 HydrophobicContact CE2-CB 4.45Å; M261-A268 HydrophobicContact CE-CB 3.45Å; M261-A268 VanDerWaalsContact CE-CB 3.45Å; M261-A268 HydrophobicContact SD-CB 3.48Å; M261-A268 WeakPolarHBondContact SD-CB 3.11Å; A264-A268 WeakPolarHBondContact O-CB 3.47Å; A264-A268 PolarHBondContact O-N 2.9Å; Q265-A268 PolarHBondContact O-N 3.48Å; A268-S270 PolarHBondContact O-N 2.98Å
269	Q	89.8	Confident	88.9	Confident	52 Å²	52	42.3 Å²	42.3	24%	0.243	24%	0.235	C	C	.	.			trans	-60	139.6	178.7	-72.7	-52.5	-54.3	0	0	111.6	Y258 Q265 S273 G328	Y258-Q269 PolarHBondContact OH-NE2 2.84Å; Q265-Q269 PolarHBondContact O-NE2 3.48Å; Q269-S273 WeakPolarHBondContact CA-OG 3.39Å; Q269-S273 VanDerWaalsContact OE1-C 3.29Å; Q269-S273 PolarHBondContact OE1-O 2.74Å; Q269-S273 PolarHBondContact OE1-OG 3.07Å; Q269-G328 VanDerWaalsContact CD-O 3.27Å; Q269-G328 VanDerWaalsContact CG-O 3.27Å; Q269-G328 WeakPolarHBondContact CG-O 3.36Å; Q269-G328 PolarHBondContact NE2-O 3.06Å
270	S	91.2	Very high	88.4	Confident	43 Å²	43	42.6 Å²	42.6	30%	0.301	24%	0.238	S	C	.	.			trans	-137.4	174.1	166.1	69.6	0	0	0	0	109.3	A268 Q272 S273 T274	A268-S270 PolarHBondContact O-N 2.98Å; S270-Q272 PolarHBondContact O-N 2.82Å; S270-Q272 PolarHBondContact OG-N 2.97Å; S270-S273 PolarHBondContact N-OG 3.21Å; S270-S273 PolarHBondContact O-N 3.23Å; S270-S273 PolarHBondContact O-OG 2.88Å; S270-S273 VanDerWaalsContact O-OG 3.14Å; S270-T274 PolarHBondContact O-N 3.27Å; S270-T274 PolarHBondContact O-OG1 2.96Å
271	R	89.6	Confident	88.2	Confident	103 Å²	103	36.3 Å²	36.3	39%	0.389	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-30.8	172.8	-168.1	179.6	-169.8	-158.7	9.4	113	D185 R224 S273	D185-R271 PolarHBondContact O-NH2 3.43Å; D185-R271 IonicContact OD1-CZ 3.9Å; D185-R271 VanDerWaalsContact OD1-CZ 3.23Å; D185-R271 IonicContact OD1-NH1 3.96Å; D185-R271 PolarHBondContact OD1-NH1 3.2Å; D185-R271 IonicContact OD1-NH2 2.92Å; D185-R271 PolarHBondContact OD1-NH2 3.33Å; D185-R271 IonicContact OD2-CZ 3.8Å; D185-R271 IonicContact OD2-NH1 2.8Å; D185-R271 IonicContact OD2-NH2 3.23Å; D185-R271 PolarHBondContact OD2-NH2 2.82Å; R224-R271 WeakPolarHBondContact CD-O 3.43Å; R224-R271 WeakPolarHBondContact CG-O 3.27Å; R224-R271 PolarHBondContact NE-O 3.21Å; R271-S273 VanDerWaalsContact C-N 3.35Å
272	Q	90	Very high	88.3	Confident	37 Å²	37	32.3 Å²	32.3	17%	0.173	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.3	-179.5	-69.4	-71.2	-35.4	0	0	114.4	S221 L223 R224 G226 S270	S221-Q272 PolarHBondContact O-NE2 2.92Å; L223-Q272 VanDerWaalsContact O-CD 3.26Å; L223-Q272 PolarHBondContact O-NE2 2.9Å; L223-Q272 PolarHBondContact O-OE1 3.02Å; R224-Q272 CarbonylContact C-O 3.1Å; R224-Q272 WeakPolarHBondContact CB-O 3.41Å; G226-Q272 CarbonylContact C-O 3.59Å; G226-Q272 WeakPolarHBondContact CA-O 3.12Å; G226-Q272 PolarHBondContact N-O 2.83Å; S270-Q272 PolarHBondContact O-N 2.82Å; S270-Q272 PolarHBondContact OG-N 2.97Å
273	S	90.4	Very high	88.6	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.014	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	-10.7	-176.1	64.8	0	0	0	0	113.9	L227 Q269 S270 R271 R361	L227-S273 WeakPolarHBondContact CD2-O 3.26Å; Q269-S273 WeakPolarHBondContact CA-OG 3.39Å; Q269-S273 VanDerWaalsContact OE1-C 3.29Å; Q269-S273 PolarHBondContact OE1-O 2.74Å; Q269-S273 PolarHBondContact OE1-OG 3.07Å; S270-S273 PolarHBondContact N-OG 3.21Å; S270-S273 PolarHBondContact O-N 3.23Å; S270-S273 PolarHBondContact O-OG 2.88Å; S270-S273 VanDerWaalsContact O-OG 3.14Å; R271-S273 VanDerWaalsContact C-N 3.35Å; S273-R361 PolarHBondContact O-NH1 3.05Å
274	T	90.8	Very high	88.8	Confident	62 Å²	62	30.4 Å²	30.4	38%	0.38	17%	0.173	S	C	.	.	S	Bend	trans	-81.4	131.6	178	-56.4	0	0	0	0	110.8	R224 S270	R224-T274 WeakPolarHBondContact CD-O 3.32Å; R224-T274 PolarHBondContact NH1-O 3.19Å; S270-T274 PolarHBondContact O-N 3.27Å; S270-T274 PolarHBondContact O-OG1 2.96Å
275	L	90.1	Very high	88.7	Confident	29 Å²	29	30 Å²	30	15%	0.152	17%	0.169	C	C	.	.			trans	-58.4	145.8	179.1	-80.5	170.8	0	0	0	112.8	R224 L227 G277 P360 R361 P594	R224-L275 PolarHBondContact NH1-O 3.36Å; L227-L275 HydrophobicContact CD2-CD2 4.07Å; L227-L275 HydrophobicContact CD2-CG 4.34Å; L275-G277 PolarHBondContact O-N 3.04Å; L275-G277 VanDerWaalsContact O-N 3.07Å; L275-P360 HydrophobicContact CD1-CB 3.95Å; L275-P360 HydrophobicContact CD1-CG 3.72Å; L275-R361 HydrophobicContact CD1-CG 3.96Å; L275-R361 HydrophobicContact CD2-CB 4.41Å; L275-R361 HydrophobicContact CD2-CG 3.62Å; L275-R361 HydrophobicContact CG-CG 3.64Å; L275-P594 WeakPolarHBondContact CD1-O 3.28Å
276	R	88.1	Confident	88.4	Confident	18 Å²	18	29.9 Å²	29.9	7%	0.068	17%	0.17	C	C	.	.	S	Bend	trans	-82.4	61.5	171	-68.9	-175.1	-169.3	-95	7.1	111.4	L184 A186 D187 E194 R222	L184-R276 PolarHBondContact O-NH1 2.86Å; L184-R276 PolarHBondContact O-NH2 2.87Å; A186-R276 PolarHBondContact O-NH1 2.87Å; D187-R276 CarbonylContact O-C 3.58Å; D187-R276 WeakPolarHBondContact O-CA 3.25Å; D187-R276 WeakPolarHBondContact O-CB 3.4Å; E194-R276 IonicContact OE1-CZ 3.8Å; E194-R276 IonicContact OE1-NE 2.81Å; E194-R276 PolarHBondContact OE1-NE 3.37Å; E194-R276 IonicContact OE1-NH2 3.88Å; E194-R276 PolarHBondContact OE1-NH2 2.73Å; E194-R276 WeakPolarHBondContact OE2-CD 3.49Å; E194-R276 IonicContact OE2-CZ 2.65Å; E194-R276 IonicContact OE2-NE 2.87Å; E194-R276 PolarHBondContact OE2-NE 2.87Å; E194-R276 IonicContact OE2-NH2 3.53Å; R222-R276 PolarHBondContact O-NH2 2.81Å
277	G	80.2	Confident	88.1	Confident	12 Å²	12	29.9 Å²	29.9	12%	0.124	17%	0.17	C	C	.	.	S	Bend	trans	-132.2	155.7	-174.2	0	0	0	0	0	112.4	D187 L275	D187-G277 PolarHBondContact O-N 3.41Å; L275-G277 PolarHBondContact O-N 3.04Å; L275-G277 VanDerWaalsContact O-N 3.07Å
278	S	71.9	Confident	87.8	Confident	19 Å²	19	26.7 Å²	26.7	13%	0.133	15%	0.151	C	C	.	.			trans	-74.2	133.8	172.2	-153.9	0	0	0	0	109.9	K188 N280	K188-S278 PolarHBondContact NZ-OG 2.77Å; S278-N280 PolarHBondContact O-N 2.89Å; S278-N280 PolarHBondContact OG-ND2 3.38Å; S278-N280 PolarHBondContact OG-OD1 3.22Å
279	P	71.4	Confident	87.4	Confident	76 Å²	76	28.9 Å²	28.9	49%	0.494	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	25.4	175.5	34.2	-37.1	0	0	0	112.7
280	N	81.1	Confident	87	Confident	39 Å²	39	28.7 Å²	28.7	21%	0.209	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	4	-169.5	-63.8	-2.4	0	0	0	113	S278 T303 C304	S278-N280 PolarHBondContact O-N 2.89Å; S278-N280 PolarHBondContact OG-ND2 3.38Å; S278-N280 PolarHBondContact OG-OD1 3.22Å; N280-T303 WeakPolarHBondContact O-CG2 3.49Å; N280-T303 PolarHBondContact O-N 3.2Å; N280-T303 PolarHBondContact O-OG1 3.05Å; N280-C304 PolarHBondContact ND2-SG 3.05Å
281	H	88.8	Confident	86.2	Confident	21 Å²	21	28.9 Å²	28.9	10%	0.097	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	114.8	179.8	-68.9	103.7	0	0	0	110	F301 L593 D597	H281-F301 WeakPolarHBondContact CA-O 3.22Å; H281-L593 PolarHBondContact O-N 3.4Å; H281-D597 IonicContact CE1-OD1 3.01Å
282	V	94.2	Very high	85.6	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119.8	167	-175	0	0	0	0	107.8	L284 A300 F301 T303 L539 L547 F549 C590 L592	V282-L284 HydrophobicContact CG1-CD1 4.3Å; V282-A300 CarbonylContact O-C 3.59Å; V282-A300 WeakPolarHBondContact O-CA 3.46Å; V282-F301 HydrophobicContact CB-CB 4.31Å; V282-F301 HydrophobicContact CG2-CD1 4.4Å; V282-F301 PolarHBondContact N-O 3.29Å; V282-F301 PolarHBondContact O-N 2.99Å; V282-T303 HydrophobicContact CG2-CG2 3.67Å; V282-L539 HydrophobicContact CB-CD2 4.18Å; V282-L539 HydrophobicContact CG1-CB 4.41Å; V282-L539 HydrophobicContact CG1-CD2 3.77Å; V282-L539 HydrophobicContact CG2-CD2 3.46Å; V282-L539 VanDerWaalsContact CG2-CD2 3.46Å; V282-L547 HydrophobicContact CG2-CD1 4.37Å; V282-F549 HydrophobicContact CB-CZ 4.21Å; V282-F549 HydrophobicContact CG1-CE2 3.84Å; V282-F549 HydrophobicContact CG1-CZ 3.92Å; V282-F549 HydrophobicContact CG2-CZ 4.37Å; V282-C590 HydrophobicContact CG1-CB 4.17Å; V282-L592 HydrophobicContact CG2-CD2 3.92Å
283	L	94.9	Very high	85.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	129.9	171.9	-60.4	-170.8	0	0	0	110	V285 V298 L299 A300 F313 L331 C590 T591 L593 L595	L283-V285 HydrophobicContact CB-CG2 3.92Å; L283-V298 HydrophobicContact CB-CG1 4.34Å; L283-V298 HydrophobicContact CD2-CG1 4.38Å; L283-L299 WeakPolarHBondContact CA-O 3.38Å; L283-A300 HydrophobicContact CD2-CB 3.89Å; L283-F313 HydrophobicContact CD1-CZ 4.28Å; L283-L331 HydrophobicContact CD1-CD2 4.12Å; L283-C590 VanDerWaalsContact O-CA 3.25Å; L283-C590 WeakPolarHBondContact O-CA 3.36Å; L283-T591 HydrophobicContact CB-CG2 4.38Å; L283-T591 PolarHBondContact N-O 3.26Å; L283-T591 PolarHBondContact O-N 2.77Å; L283-T591 VanDerWaalsContact O-N 3.13Å; L283-L593 HydrophobicContact CD1-CB 3.51Å; L283-L593 HydrophobicContact CD1-CD2 3.54Å; L283-L593 HydrophobicContact CD1-CG 4.17Å; L283-L593 HydrophobicContact CG-CB 3.94Å; L283-L595 HydrophobicContact CD2-CD1 3.7Å; L283-L595 HydrophobicContact CD2-CD2 4.3Å; L283-L595 HydrophobicContact CD2-CG 4.15Å
284	L	94.6	Very high	84.8	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	105.2	170.8	-74.7	81.3	0	0	0	106.7	V282 V298 L299 F301 F308 F549 L581 L585 T588	V282-L284 HydrophobicContact CG1-CD1 4.3Å; L284-V298 WeakPolarHBondContact O-CA 3.48Å; L284-L299 HydrophobicContact CB-CB 4.11Å; L284-L299 PolarHBondContact N-O 2.98Å; L284-L299 PolarHBondContact O-N 3.33Å; L284-F301 HydrophobicContact CD1-CB 4.05Å; L284-F308 HydrophobicContact CD1-CE1 4.33Å; L284-F308 HydrophobicContact CD2-CE1 4.31Å; L284-F549 HydrophobicContact CD1-CD1 4.18Å; L284-F549 HydrophobicContact CD1-CE1 4.2Å; L284-F549 HydrophobicContact CD2-CB 3.92Å; L284-F549 HydrophobicContact CD2-CD1 3.87Å; L284-F549 HydrophobicContact CD2-CG 4.01Å; L284-F549 HydrophobicContact CG-CD1 4.39Å; L284-F549 HydrophobicContact CG-CG 4.39Å; L284-L581 HydrophobicContact CD2-CD2 3.53Å; L284-L585 HydrophobicContact CD2-CD2 4.02Å; L284-T588 HydrophobicContact CB-CG2 3.64Å; L284-T588 HydrophobicContact CD2-CG2 4.38Å; L284-T588 HydrophobicContact CG-CG2 4.13Å
285	V	93.1	Very high	84.6	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.024	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.6	-169.7	-177.4	0	0	0	0	109.6	L283 V298 L315 V324 L331 V333 E589	L283-V285 HydrophobicContact CB-CG2 3.92Å; V285-V298 HydrophobicContact CG1-CG2 4.38Å; V285-V298 HydrophobicContact CG2-CG1 4.07Å; V285-V298 HydrophobicContact CG2-CG2 4.42Å; V285-L315 HydrophobicContact CG1-CD1 3.96Å; V285-L315 HydrophobicContact CG1-CD2 3.68Å; V285-L315 HydrophobicContact CG1-CG 4.18Å; V285-V324 HydrophobicContact CB-CG1 4.25Å; V285-V324 HydrophobicContact CB-CG2 4Å; V285-V324 HydrophobicContact CG1-CG1 4.46Å; V285-V324 HydrophobicContact CG1-CG2 3.83Å; V285-V324 HydrophobicContact CG2-CG1 4.14Å; V285-L331 HydrophobicContact CG2-CD1 4.31Å; V285-L331 HydrophobicContact CG2-CD2 4.26Å; V285-V333 HydrophobicContact CG1-CG2 4.19Å; V285-E589 PolarHBondContact N-O 3.3Å; V285-E589 PolarHBondContact O-N 3.06Å; V285-E589 VanDerWaalsContact O-N 3.08Å
286	G	87.8	Confident	84.6	Confident	7 Å²	7	32.2 Å²	32.2	7%	0.072	18%	0.18	C	C	.	.	S	Bend	trans	71.2	-161.3	-178.4	0	0	0	0	0	113.6	T588	G286-T588 PolarHBondContact O-OG1 2.79Å
287	G	86	Confident	84.5	Confident	3 Å²	3	35 Å²	35	3%	0.031	19%	0.194	C	C	.	.			trans	74.1	174.6	-171.6	0	0	0	0	0	112.8	E295 T586 G587	G287-E295 WeakPolarHBondContact O-CB 3.33Å; G287-E295 PolarHBondContact O-N 2.82Å; G287-T586 CarbonylContact C-O 3.46Å; G287-T586 WeakPolarHBondContact CA-O 3.36Å; G287-G587 WeakPolarHBondContact CA-O 3.22Å; G287-G587 PolarHBondContact N-O 3.22Å
288	G	86.7	Confident	85.1	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.01	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-164.1	-173.5	-175.7	0	0	0	0	0	112.2	S290 T586	G288-S290 VanDerWaalsContact C-N 3.27Å; G288-T586 PolarHBondContact N-O 2.89Å; G288-T586 WeakPolarHBondContact O-CG2 3.42Å; G288-T586 PolarHBondContact O-N 2.76Å
289	V	84.1	Confident	86.1	Confident	76 Å²	76	34.1 Å²	34.1	46%	0.461	19%	0.185	S	C	.	.	S	Bend	trans	-66.2	-34.6	174.9	-177	0	0	0	0	111.1	T561	V289-T561 PolarHBondContact O-OG1 2.95Å
290	S	82.4	Confident	87.2	Confident	49 Å²	49	30.5 Å²	30.5	34%	0.343	16%	0.161	S	C	.	.	S	Bend	trans	-119.8	144.2	177.7	173.1	0	0	0	0	110.7	G288 D292 W293	G288-S290 VanDerWaalsContact C-N 3.27Å; S290-D292 PolarHBondContact O-N 2.85Å; S290-D292 PolarHBondContact OG-N 3.26Å; S290-W293 PolarHBondContact O-N 2.96Å
291	P	74.1	Confident	87.8	Confident	46 Å²	46	28.7 Å²	28.7	30%	0.299	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.3	174.2	23.3	-33.7	0	0	0	114.5	W293 R320	P291-W293 VanDerWaalsContact C-N 3.34Å; P291-R320 VanDerWaalsContact O-CD 3.22Å; P291-R320 WeakPolarHBondContact O-CD 3.42Å
292	D	77	Confident	87.9	Confident	97 Å²	97	29.3 Å²	29.3	52%	0.519	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-15.3	-173.8	-60.4	-43.2	0	0	0	112.7	S290 R320 M339	S290-D292 PolarHBondContact O-N 2.85Å; S290-D292 PolarHBondContact OG-N 3.26Å; D292-R320 IonicContact OD1-NH1 3.57Å; D292-M339 WeakPolarHBondContact O-CE 3.38Å
293	W	80.3	Confident	87.7	Confident	100 Å²	100	30.8 Å²	30.8	38%	0.379	16%	0.164	S	C	.	.	S	Bend	trans	-135	77.8	-176.8	-155.8	-107.1	0	0	0	110.6	S290 P291 R318 N341 V347	S290-W293 PolarHBondContact O-N 2.96Å; P291-W293 VanDerWaalsContact C-N 3.34Å; W293-R318 VanDerWaalsContact NE1-NH1 3.14Å; W293-N341 VanDerWaalsContact CH2-OD1 3.25Å; W293-N341 WeakPolarHBondContact CH2-OD1 3.48Å; W293-V347 HydrophobicContact CZ3-CG1 4.35Å; W293-V347 HydrophobicContact CZ3-CG2 3.98Å
294	P	83.9	Confident	87.3	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.032	19%	0.194	C	C	.	.			trans	-66.8	151.9	177.1	30.1	-33.9	0	0	0	109.3	R318 L319 R320 M339	P294-R318 HydrophobicContact CG-CG 3.84Å; P294-R318 WeakPolarHBondContact O-CD 3.36Å; P294-R318 WeakPolarHBondContact O-CG 3.49Å; P294-R318 PolarHBondContact O-NH1 3.12Å; P294-L319 WeakPolarHBondContact CB-O 3.44Å; P294-L319 WeakPolarHBondContact CG-O 3.21Å; P294-R320 HydrophobicContact CG-CB 4.06Å; P294-M339 HydrophobicContact CG-CG 4.31Å
295	E	86.3	Confident	87	Confident	41 Å²	41	37.9 Å²	37.9	19%	0.192	21%	0.213	C	C	.	.			trans	-101.1	157.3	179.8	-61.3	-171.3	-147.2	0	0	111.6	G287 R583	G287-E295 WeakPolarHBondContact O-CB 3.33Å; G287-E295 PolarHBondContact O-N 2.82Å; E295-R583 VanDerWaalsContact CD-CZ 3.5Å; E295-R583 VanDerWaalsContact CD-NH2 3.3Å; E295-R583 IonicContact OE1-CZ 2.77Å; E295-R583 IonicContact OE1-NH1 3.6Å; E295-R583 PolarHBondContact OE1-NH1 3.23Å; E295-R583 IonicContact OE1-NH2 3.7Å; E295-R583 IonicContact OE2-CZ 3.44Å; E295-R583 IonicContact OE2-NH1 2.92Å; E295-R583 PolarHBondContact OE2-NH1 3.09Å; E295-R583 IonicContact OE2-NH2 3.23Å; E295-R583 PolarHBondContact OE2-NH2 3.36Å
296	Q	89.4	Confident	86.9	Confident	61 Å²	61	43.2 Å²	43.2	29%	0.285	23%	0.233	S	C	.	.	S	Bend	trans	-88.9	-11.7	176.8	-68.2	173.5	-80.2	0	0	112.4	A314 L315 P316 R318	Q296-A314 HydrophobicContact CB-CB 4.29Å; Q296-A314 CarbonylContact O-C 3.59Å; Q296-A314 VanDerWaalsContact O-CA 3.27Å; Q296-A314 WeakPolarHBondContact O-CA 3.43Å; Q296-A314 WeakPolarHBondContact O-CB 3.19Å; Q296-L315 HydrophobicContact CB-CB 4.14Å; Q296-L315 HydrophobicContact CG-CB 4.35Å; Q296-L315 PolarHBondContact NE2-O 2.68Å; Q296-L315 PolarHBondContact O-N 2.79Å; Q296-P316 PolarHBondContact NE2-O 3.37Å; Q296-R318 HydrophobicContact CG-CB 4.19Å
297	Q	86.6	Confident	87.1	Confident	76 Å²	76	49.9 Å²	49.9	36%	0.355	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-69.8	138.3	-179.4	-172.4	174.7	12.5	0	0	110.8	S310	Q297-S310 PolarHBondContact NE2-OG 2.84Å
298	V	92.4	Very high	87.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.6	170.1	179.4	0	0	0	0	108.5	L283 L284 V285 P311 F313 L315	L283-V298 HydrophobicContact CB-CG1 4.34Å; L283-V298 HydrophobicContact CD2-CG1 4.38Å; L284-V298 WeakPolarHBondContact O-CA 3.48Å; V285-V298 HydrophobicContact CG1-CG2 4.38Å; V285-V298 HydrophobicContact CG2-CG1 4.07Å; V285-V298 HydrophobicContact CG2-CG2 4.42Å; V298-P311 HydrophobicContact CB-CG 4.19Å; V298-P311 HydrophobicContact CG1-CG 4.03Å; V298-P311 VanDerWaalsContact O-CD 3.22Å; V298-P311 WeakPolarHBondContact O-CD 3.29Å; V298-F313 HydrophobicContact CB-CE2 4.1Å; V298-F313 HydrophobicContact CB-CZ 4.38Å; V298-F313 HydrophobicContact CG1-CE2 4.21Å; V298-F313 HydrophobicContact CG1-CZ 4.09Å; V298-F313 HydrophobicContact CG2-CD2 4.21Å; V298-F313 HydrophobicContact CG2-CE2 3.77Å; V298-F313 HydrophobicContact CG2-CZ 4.48Å; V298-L315 HydrophobicContact CG2-CG 4.34Å
299	L	93.3	Very high	87.7	Confident	13 Å²	13	54.4 Å²	54.4	7%	0.068	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142	170	-63.1	172.2	0	0	0	109.1	L283 L284	L283-L299 WeakPolarHBondContact CA-O 3.38Å; L284-L299 HydrophobicContact CB-CB 4.11Å; L284-L299 PolarHBondContact N-O 2.98Å; L284-L299 PolarHBondContact O-N 3.33Å
300	A	93.8	Very high	88	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133.7	171.2	0	0	0	0	0	109.2	V282 L283 F308 S309 P311 L595	V282-A300 CarbonylContact O-C 3.59Å; V282-A300 WeakPolarHBondContact O-CA 3.46Å; L283-A300 HydrophobicContact CD2-CB 3.89Å; A300-F308 CarbonylContact O-C 3.56Å; A300-F308 VanDerWaalsContact O-CA 3.29Å; A300-F308 WeakPolarHBondContact O-CA 3.28Å; A300-S309 PolarHBondContact N-O 2.78Å; A300-S309 PolarHBondContact O-N 2.85Å; A300-P311 HydrophobicContact CB-CB 4.49Å; A300-L595 HydrophobicContact CB-CD1 3.85Å
301	F	94.3	Very high	88.1	Confident	1 Å²	1	53.5 Å²	53.5	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	115	175.1	177.1	-107.4	0	0	0	109.1	H281 V282 L284 T303 R306 F308 L547 F549 I578 A579	H281-F301 WeakPolarHBondContact CA-O 3.22Å; V282-F301 HydrophobicContact CB-CB 4.31Å; V282-F301 HydrophobicContact CG2-CD1 4.4Å; V282-F301 PolarHBondContact N-O 3.29Å; V282-F301 PolarHBondContact O-N 2.99Å; L284-F301 HydrophobicContact CD1-CB 4.05Å; F301-T303 HydrophobicContact CD1-CG2 4.17Å; F301-T303 HydrophobicContact CE1-CG2 4.24Å; F301-T303 PolarHBondContact O-N 2.86Å; F301-R306 HydrophobicContact CE2-CB 4.18Å; F301-R306 HydrophobicContact CZ-CB 4.07Å; F301-R306 HydrophobicContact CZ-CG 4.35Å; F301-F308 HydrophobicContact CB-CD1 4Å; F301-F308 HydrophobicContact CB-CE1 3.71Å; F301-F308 HydrophobicContact CB-CZ 4.32Å; F301-F308 HydrophobicContact CD2-CD1 4.01Å; F301-F308 HydrophobicContact CD2-CD2 4.01Å; F301-F308 AromaticContact CD2-CE1 3.62Å; F301-F308 HydrophobicContact CD2-CE1 3.62Å; F301-F308 AromaticContact CD2-CE2 3.62Å; F301-F308 HydrophobicContact CD2-CE2 3.62Å; F301-F308 HydrophobicContact CD2-CG 4.19Å; F301-F308 AromaticContact CD2-CZ 3.41Å; F301-F308 HydrophobicContact CD2-CZ 3.41Å; F301-F308 VanDerWaalsContact CD2-CZ 3.41Å; F301-F308 HydrophobicContact CE2-CD2 4.47Å; F301-F308 AromaticContact CE2-CE2 3.9Å; F301-F308 HydrophobicContact CE2-CE2 3.9Å; F301-F308 AromaticContact CE2-CZ 3.98Å; F301-F308 HydrophobicContact CE2-CZ 3.98Å; F301-F308 HydrophobicContact CG-CD1 4.48Å; F301-F308 AromaticContact CG-CE1 4Å; F301-F308 HydrophobicContact CG-CE1 4Å; F301-F308 HydrophobicContact CG-CZ 4.11Å; F301-L547 HydrophobicContact CE1-CD1 4.3Å; F301-F549 HydrophobicContact CB-CE1 4.13Å; F301-F549 AromaticContact CD1-CE1 3.7Å; F301-F549 HydrophobicContact CD1-CE1 3.7Å; F301-F549 AromaticContact CD1-CZ 3.78Å; F301-F549 HydrophobicContact CD1-CZ 3.78Å; F301-F549 HydrophobicContact CD2-CE1 4.5Å; F301-F549 HydrophobicContact CE1-CE1 4.19Å; F301-F549 HydrophobicContact CE1-CZ 4.3Å; F301-F549 AromaticContact CG-CE1 3.86Å; F301-F549 HydrophobicContact CG-CE1 3.86Å; F301-F549 HydrophobicContact CG-CZ 4.33Å; F301-I578 HydrophobicContact CE1-CD1 4.26Å; F301-I578 HydrophobicContact CZ-CD1 4.08Å; F301-A579 HydrophobicContact CE2-CB 3.94Å; F301-A579 HydrophobicContact CZ-CB 4.25Å
302	D	91.6	Very high	88.6	Confident	33 Å²	33	54.4 Å²	54.4	18%	0.176	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	116.4	172.8	171.8	11.5	0	0	0	109.5	C304 S305 R306 K307	D302-C304 PolarHBondContact O-N 3.5Å; D302-C304 WeakPolarHBondContact OD1-CB 3.45Å; D302-C304 PolarHBondContact OD1-N 3.23Å; D302-S305 WeakPolarHBondContact CB-OG 3.34Å; D302-S305 VanDerWaalsContact CG-OG 3.28Å; D302-S305 WeakPolarHBondContact OD2-CB 3.47Å; D302-S305 PolarHBondContact OD2-N 2.53Å; D302-S305 PolarHBondContact OD2-OG 3.36Å; D302-R306 WeakPolarHBondContact O-CA 3.46Å; D302-R306 PolarHBondContact O-N 2.59Å; D302-K307 PolarHBondContact N-O 2.81Å
303	T	89.1	Confident	89.1	Confident	31 Å²	31	50.6 Å²	50.6	19%	0.19	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-21.4	-177.5	62.2	0	0	0	0	113.9	N280 V282 F301 M541 L547	N280-T303 WeakPolarHBondContact O-CG2 3.49Å; N280-T303 PolarHBondContact O-N 3.2Å; N280-T303 PolarHBondContact O-OG1 3.05Å; V282-T303 HydrophobicContact CG2-CG2 3.67Å; F301-T303 HydrophobicContact CD1-CG2 4.17Å; F301-T303 HydrophobicContact CE1-CG2 4.24Å; F301-T303 PolarHBondContact O-N 2.86Å; T303-M541 HydrophobicContact CG2-CE 3.39Å; T303-M541 HydrophobicContact CG2-SD 3.88Å; T303-L547 HydrophobicContact CG2-CD1 4.16Å
304	C	86.4	Confident	89.7	Confident	92 Å²	92	48.3 Å²	48.3	62%	0.622	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-53.8	178.4	-73.7	0	0	0	0	111.6	N280 D302 R306	N280-C304 PolarHBondContact ND2-SG 3.05Å; D302-C304 PolarHBondContact O-N 3.5Å; D302-C304 WeakPolarHBondContact OD1-CB 3.45Å; D302-C304 PolarHBondContact OD1-N 3.23Å; C304-R306 VanDerWaalsContact C-N 3.34Å
305	S	88.1	Confident	90	Very high	59 Å²	59	48.4 Å²	48.4	41%	0.413	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-15.2	179.8	68.1	0	0	0	0	113.7	D302 K307	D302-S305 WeakPolarHBondContact CB-OG 3.34Å; D302-S305 VanDerWaalsContact CG-OG 3.28Å; D302-S305 WeakPolarHBondContact OD2-CB 3.47Å; D302-S305 PolarHBondContact OD2-N 2.53Å; D302-S305 PolarHBondContact OD2-OG 3.36Å; S305-K307 PolarHBondContact O-N 2.82Å; S305-K307 PolarHBondContact OG-N 3.08Å
306	R	91.6	Very high	90	Very high	117 Å²	117	48.5 Å²	48.5	44%	0.442	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	32.5	-173.6	-54.3	-178.1	-178	179.6	1.1	113.1	F301 D302 C304	F301-R306 HydrophobicContact CE2-CB 4.18Å; F301-R306 HydrophobicContact CZ-CB 4.07Å; F301-R306 HydrophobicContact CZ-CG 4.35Å; D302-R306 WeakPolarHBondContact O-CA 3.46Å; D302-R306 PolarHBondContact O-N 2.59Å; C304-R306 VanDerWaalsContact C-N 3.34Å
307	K	91.9	Very high	89.9	Confident	146 Å²	146	47.3 Å²	47.3	64%	0.635	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	148.6	179.6	-67.5	-176.8	180	-179.4	0	110.9	D302 S305	D302-K307 PolarHBondContact N-O 2.81Å; S305-K307 PolarHBondContact O-N 2.82Å; S305-K307 PolarHBondContact OG-N 3.08Å
308	F	93.6	Very high	90	Very high	44 Å²	44	46.3 Å²	46.3	19%	0.193	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	138.5	172.3	-70.8	-85.3	0	0	0	110.4	L284 A300 F301 F549 V565 A579 Q580 L581 P582	L284-F308 HydrophobicContact CD1-CE1 4.33Å; L284-F308 HydrophobicContact CD2-CE1 4.31Å; A300-F308 CarbonylContact O-C 3.56Å; A300-F308 VanDerWaalsContact O-CA 3.29Å; A300-F308 WeakPolarHBondContact O-CA 3.28Å; F301-F308 HydrophobicContact CB-CD1 4Å; F301-F308 HydrophobicContact CB-CE1 3.71Å; F301-F308 HydrophobicContact CB-CZ 4.32Å; F301-F308 HydrophobicContact CD2-CD1 4.01Å; F301-F308 HydrophobicContact CD2-CD2 4.01Å; F301-F308 AromaticContact CD2-CE1 3.62Å; F301-F308 HydrophobicContact CD2-CE1 3.62Å; F301-F308 AromaticContact CD2-CE2 3.62Å; F301-F308 HydrophobicContact CD2-CE2 3.62Å; F301-F308 HydrophobicContact CD2-CG 4.19Å; F301-F308 AromaticContact CD2-CZ 3.41Å; F301-F308 HydrophobicContact CD2-CZ 3.41Å; F301-F308 VanDerWaalsContact CD2-CZ 3.41Å; F301-F308 HydrophobicContact CE2-CD2 4.47Å; F301-F308 AromaticContact CE2-CE2 3.9Å; F301-F308 HydrophobicContact CE2-CE2 3.9Å; F301-F308 AromaticContact CE2-CZ 3.98Å; F301-F308 HydrophobicContact CE2-CZ 3.98Å; F301-F308 HydrophobicContact CG-CD1 4.48Å; F301-F308 AromaticContact CG-CE1 4Å; F301-F308 HydrophobicContact CG-CE1 4Å; F301-F308 HydrophobicContact CG-CZ 4.11Å; F308-F549 HydrophobicContact CZ-CD1 4.45Å; F308-F549 HydrophobicContact CZ-CE1 4.48Å; F308-V565 HydrophobicContact CE2-CG2 4.17Å; F308-V565 HydrophobicContact CZ-CG2 3.74Å; F308-A579 HydrophobicContact CE2-CB 4.46Å; F308-Q580 VanDerWaalsContact CE2-O 3.27Å; F308-Q580 WeakPolarHBondContact CE2-O 3.47Å; F308-L581 HydrophobicContact CD1-CD2 4.37Å; F308-L581 HydrophobicContact CE1-CD2 3.47Å; F308-L581 VanDerWaalsContact CE1-CD2 3.47Å; F308-L581 HydrophobicContact CE2-CD2 4.38Å; F308-L581 HydrophobicContact CZ-CD2 3.47Å; F308-L581 VanDerWaalsContact CZ-CD2 3.47Å; F308-L581 HydrophobicContact CZ-CG 4.13Å; F308-P582 HydrophobicContact CB-CG 3.83Å; F308-P582 HydrophobicContact CD2-CG 4.27Å; F308-P582 HydrophobicContact CG-CG 4.02Å
309	S	91.8	Very high	89.7	Confident	56 Å²	56	46.9 Å²	46.9	39%	0.392	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	159.2	171.1	61	0	0	0	0	110.1	A300	A300-S309 PolarHBondContact N-O 2.78Å; A300-S309 PolarHBondContact O-N 2.85Å
310	S	90	Very high	89.4	Confident	73 Å²	73	49 Å²	49	51%	0.51	28%	0.283	S	S	.	.			trans	-100	117	170.5	-68.6	0	0	0	0	107.9	Q297 G312	Q297-S310 PolarHBondContact NE2-OG 2.84Å; S310-G312 PolarHBondContact O-N 2.83Å
311	P	83.9	Confident	89.1	Confident	32 Å²	32	51.6 Å²	51.6	21%	0.208	30%	0.297	C	S	.	.			trans	-75.7	11.2	-172.6	34.2	-37.7	0	0	0	114	V298 A300 F313 L595	V298-P311 HydrophobicContact CB-CG 4.19Å; V298-P311 HydrophobicContact CG1-CG 4.03Å; V298-P311 VanDerWaalsContact O-CD 3.22Å; V298-P311 WeakPolarHBondContact O-CD 3.29Å; A300-P311 HydrophobicContact CB-CB 4.49Å; P311-F313 VanDerWaalsContact C-N 3.34Å; P311-F313 HydrophobicContact CB-CD1 3.85Å; P311-F313 HydrophobicContact CB-CE1 3.54Å; P311-F313 HydrophobicContact CB-CZ 4.5Å; P311-F313 HydrophobicContact CG-CD1 3.79Å; P311-F313 HydrophobicContact CG-CE1 3.46Å; P311-F313 VanDerWaalsContact CG-CE1 3.46Å; P311-F313 HydrophobicContact CG-CZ 4.03Å; P311-F313 WeakPolarHBondContact O-CD1 3.27Å; P311-F313 PolarHBondContact O-N 2.89Å; P311-L595 HydrophobicContact CB-CD1 3.54Å; P311-L595 HydrophobicContact CB-CD2 4.42Å; P311-L595 HydrophobicContact CG-CD1 4.47Å
312	G	84.8	Confident	89	Confident	65 Å²	65	52 Å²	52	67%	0.67	30%	0.301	S	S	*	.	S	Bend	trans	77.2	12.9	173.4	0	0	0	0	0	115.6	S310	S310-G312 PolarHBondContact O-N 2.83Å
313	F	89.3	Confident	89.2	Confident	18 Å²	18	51 Å²	51	8%	0.079	30%	0.297	C	S	.	.			trans	-134.4	158	174.4	69.1	-90.7	0	0	0	112.5	L283 V298 P311 L331 Y358 N363 W365 L595	L283-F313 HydrophobicContact CD1-CZ 4.28Å; V298-F313 HydrophobicContact CB-CE2 4.1Å; V298-F313 HydrophobicContact CB-CZ 4.38Å; V298-F313 HydrophobicContact CG1-CE2 4.21Å; V298-F313 HydrophobicContact CG1-CZ 4.09Å; V298-F313 HydrophobicContact CG2-CD2 4.21Å; V298-F313 HydrophobicContact CG2-CE2 3.77Å; V298-F313 HydrophobicContact CG2-CZ 4.48Å; P311-F313 VanDerWaalsContact C-N 3.34Å; P311-F313 HydrophobicContact CB-CD1 3.85Å; P311-F313 HydrophobicContact CB-CE1 3.54Å; P311-F313 HydrophobicContact CB-CZ 4.5Å; P311-F313 HydrophobicContact CG-CD1 3.79Å; P311-F313 HydrophobicContact CG-CE1 3.46Å; P311-F313 VanDerWaalsContact CG-CE1 3.46Å; P311-F313 HydrophobicContact CG-CZ 4.03Å; P311-F313 WeakPolarHBondContact O-CD1 3.27Å; P311-F313 PolarHBondContact O-N 2.89Å; F313-L331 HydrophobicContact CE2-CD2 4.17Å; F313-L331 HydrophobicContact CZ-CD2 4.39Å; F313-Y358 HydrophobicContact CB-CE2 4.04Å; F313-Y358 AromaticContact CD1-CE1 3.8Å; F313-Y358 HydrophobicContact CD1-CE1 3.8Å; F313-Y358 HydrophobicContact CD1-CE2 4.06Å; F313-Y358 AromaticContact CD1-CZ 3.37Å; F313-Y358 WeakPolarHBondContact CD1-OH 3.36Å; F313-Y358 HydrophobicContact CD2-CD2 4.21Å; F313-Y358 HydrophobicContact CD2-CE1 4.22Å; F313-Y358 AromaticContact CD2-CE2 3.9Å; F313-Y358 HydrophobicContact CD2-CE2 3.9Å; F313-Y358 HydrophobicContact CD2-CG 4.5Å; F313-Y358 AromaticContact CD2-CZ 3.91Å; F313-Y358 HydrophobicContact CE1-CD1 4.27Å; F313-Y358 AromaticContact CE1-CE1 3.41Å; F313-Y358 HydrophobicContact CE1-CE1 3.41Å; F313-Y358 VanDerWaalsContact CE1-CE1 3.41Å; F313-Y358 HydrophobicContact CE1-CE2 4.46Å; F313-Y358 AromaticContact CE1-CZ 3.53Å; F313-Y358 WeakPolarHBondContact CE1-OH 3.29Å; F313-Y358 AromaticContact CE2-CD1 3.99Å; F313-Y358 HydrophobicContact CE2-CD1 3.99Å; F313-Y358 HydrophobicContact CE2-CD2 4.43Å; F313-Y358 AromaticContact CE2-CE1 3.89Å; F313-Y358 HydrophobicContact CE2-CE1 3.89Å; F313-Y358 HydrophobicContact CE2-CE2 4.33Å; F313-Y358 HydrophobicContact CE2-CG 4.26Å; F313-Y358 HydrophobicContact CG-CE1 4.18Å; F313-Y358 AromaticContact CG-CE2 3.75Å; F313-Y358 HydrophobicContact CG-CE2 3.75Å; F313-Y358 AromaticContact CG-CZ 3.56Å; F313-Y358 AromaticContact CZ-CD1 3.86Å; F313-Y358 HydrophobicContact CZ-CD1 3.86Å; F313-Y358 AromaticContact CZ-CE1 3.47Å; F313-Y358 HydrophobicContact CZ-CE1 3.47Å; F313-Y358 VanDerWaalsContact CZ-CE1 3.47Å; F313-Y358 AromaticContact CZ-CZ 3.9Å; F313-N363 VanDerWaalsContact CB-OD1 3.29Å; F313-N363 WeakPolarHBondContact CB-OD1 3.4Å; F313-W365 AromaticContact CD2-CZ2 3.98Å; F313-W365 HydrophobicContact CD2-CZ2 3.98Å; F313-W365 AromaticContact CD2-NE1 3.93Å; F313-W365 AromaticContact CE2-CZ2 3.95Å; F313-W365 HydrophobicContact CE2-CZ2 3.95Å; F313-L595 HydrophobicContact CE1-CD2 3.97Å
314	A	91.2	Very high	89.5	Confident	52 Å²	52	50.3 Å²	50.3	43%	0.43	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-127.8	157.3	177.9	0	0	0	0	0	110.2	Q296 W365	Q296-A314 HydrophobicContact CB-CB 4.29Å; Q296-A314 CarbonylContact O-C 3.59Å; Q296-A314 VanDerWaalsContact O-CA 3.27Å; Q296-A314 WeakPolarHBondContact O-CA 3.43Å; Q296-A314 WeakPolarHBondContact O-CB 3.19Å; A314-W365 PolarHBondContact O-NE1 3.14Å
315	L	90.6	Very high	89.9	Confident	6 Å²	6	46.4 Å²	46.4	3%	0.031	27%	0.266	C	S	.	.			trans	-63.1	139.1	173.4	-69.4	173.3	0	0	0	110.6	V285 Q296 V298 L317 V333 W365	V285-L315 HydrophobicContact CG1-CD1 3.96Å; V285-L315 HydrophobicContact CG1-CD2 3.68Å; V285-L315 HydrophobicContact CG1-CG 4.18Å; Q296-L315 HydrophobicContact CB-CB 4.14Å; Q296-L315 HydrophobicContact CG-CB 4.35Å; Q296-L315 PolarHBondContact NE2-O 2.68Å; Q296-L315 PolarHBondContact O-N 2.79Å; V298-L315 HydrophobicContact CG2-CG 4.34Å; L315-L317 WeakPolarHBondContact CB-O 3.41Å; L315-L317 PolarHBondContact O-N 3.48Å; L315-V333 HydrophobicContact CD2-CG1 4.36Å; L315-V333 HydrophobicContact CD2-CG2 3.78Å; L315-W365 HydrophobicContact CD2-CH2 3.72Å; L315-W365 HydrophobicContact CD2-CZ2 3.83Å
316	P	87.4	Confident	90.2	Very high	43 Å²	43	45.4 Å²	45.4	28%	0.279	26%	0.259	S	S	.	.	S	Bend	trans	-63.7	-28.3	178.5	25	-32.9	0	0	0	112.2	Q296 W356 W365	Q296-P316 PolarHBondContact NE2-O 3.37Å; P316-W356 HydrophobicContact CB-CD2 4.15Å; P316-W356 HydrophobicContact CB-CE3 4.07Å; P316-W356 HydrophobicContact CB-CH2 4.19Å; P316-W356 HydrophobicContact CB-CZ2 4.28Å; P316-W356 HydrophobicContact CB-CZ3 4.08Å; P316-W356 HydrophobicContact CG-CB 4.21Å; P316-W356 HydrophobicContact CG-CD2 3.45Å; P316-W356 VanDerWaalsContact CG-CD2 3.45Å; P316-W356 HydrophobicContact CG-CE3 3.64Å; P316-W356 HydrophobicContact CG-CG 3.71Å; P316-W356 HydrophobicContact CG-CZ2 4.39Å; P316-W356 HydrophobicContact CG-CZ3 4.17Å; P316-W365 HydrophobicContact CG-CD2 4.28Å; P316-W365 HydrophobicContact CG-CE3 4.35Å; P316-W365 HydrophobicContact CG-CG 4.46Å
317	L	85.9	Confident	90.3	Very high	36 Å²	36	40 Å²	40	19%	0.188	24%	0.239	C	C	.	.	S	Bend	trans	-130.7	155.2	-177.7	-63.1	174.5	0	0	0	111.6	L315 L319 W356	L315-L317 WeakPolarHBondContact CB-O 3.41Å; L315-L317 PolarHBondContact O-N 3.48Å; L317-L319 HydrophobicContact CB-CD1 4.35Å; L317-L319 HydrophobicContact CB-CD2 3.92Å; L317-L319 HydrophobicContact CB-CG 3.87Å; L317-L319 HydrophobicContact CD1-CD2 4.36Å; L317-L319 PolarHBondContact O-N 2.94Å; L317-W356 HydrophobicContact CD1-CZ2 4.37Å
318	R	88.6	Confident	90.3	Very high	55 Å²	55	34.1 Å²	34.1	21%	0.208	22%	0.22	C	C	.	.			trans	-87.5	92.2	174.1	-175.1	171.3	-58	-102.1	-0.8	109.1	W293 P294 Q296 M339	W293-R318 VanDerWaalsContact NE1-NH1 3.14Å; P294-R318 HydrophobicContact CG-CG 3.84Å; P294-R318 WeakPolarHBondContact O-CD 3.36Å; P294-R318 WeakPolarHBondContact O-CG 3.49Å; P294-R318 PolarHBondContact O-NH1 3.12Å; Q296-R318 HydrophobicContact CG-CB 4.19Å; R318-M339 HydrophobicContact CB-CB 4.46Å; R318-M339 HydrophobicContact CG-CB 4.12Å; R318-M339 PolarHBondContact O-N 3.34Å
319	L	86.8	Confident	90.2	Very high	13 Å²	13	33.5 Å²	33.5	7%	0.068	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	131.6	-172.2	-59.9	172.5	0	0	0	112.1	P294 L317 A322 V333 E337 D338	P294-L319 WeakPolarHBondContact CB-O 3.44Å; P294-L319 WeakPolarHBondContact CG-O 3.21Å; L317-L319 HydrophobicContact CB-CD1 4.35Å; L317-L319 HydrophobicContact CB-CD2 3.92Å; L317-L319 HydrophobicContact CB-CG 3.87Å; L317-L319 HydrophobicContact CD1-CD2 4.36Å; L317-L319 PolarHBondContact O-N 2.94Å; L319-A322 HydrophobicContact CB-CB 3.76Å; L319-A322 HydrophobicContact CD1-CB 3.99Å; L319-A322 HydrophobicContact CG-CB 4.48Å; L319-V333 HydrophobicContact CD1-CG1 3.68Å; L319-E337 WeakPolarHBondContact CA-O 3.24Å; L319-D338 HydrophobicContact CD2-CB 4.13Å
320	R	87.2	Confident	90.3	Very high	57 Å²	57	30.9 Å²	30.9	22%	0.215	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	138.4	168.4	-171.5	173.9	68.6	-178.5	-1.1	109.7	P291 D292 P294 A322 G336 E337	P291-R320 VanDerWaalsContact O-CD 3.22Å; P291-R320 WeakPolarHBondContact O-CD 3.42Å; D292-R320 IonicContact OD1-NH1 3.57Å; P294-R320 HydrophobicContact CG-CB 4.06Å; R320-A322 PolarHBondContact O-N 2.73Å; R320-G336 CarbonylContact O-C 3.59Å; R320-G336 WeakPolarHBondContact O-CA 3.33Å; R320-E337 HydrophobicContact CB-CB 4.29Å; R320-E337 IonicContact CZ-OE2 2.82Å; R320-E337 PolarHBondContact N-O 3.3Å; R320-E337 IonicContact NE-OE2 3.86Å; R320-E337 PolarHBondContact NE-OE2 3.22Å; R320-E337 IonicContact NH2-OE1 2.68Å; R320-E337 IonicContact NH2-OE2 3.76Å; R320-E337 PolarHBondContact NH2-OE2 3.45Å; R320-E337 PolarHBondContact O-N 3.3Å
321	N	88.1	Confident	90.5	Very high	55 Å²	55	27.4 Å²	27.4	29%	0.294	18%	0.183	S	C	.	.	S	Bend	trans	52.1	30.2	178.1	-58.1	-40.2	0	0	0	113.6	G336 V376	N321-G336 WeakPolarHBondContact O-CA 3.36Å; N321-V376 HydrophobicContact CB-CG2 3.47Å; N321-V376 VanDerWaalsContact CB-CG2 3.47Å
322	A	92.2	Very high	91.1	Very high	10 Å²	10	25.9 Å²	25.9	8%	0.083	17%	0.173	C	C	.	.			trans	-72.2	148.6	166.5	0	0	0	0	0	108.8	L319 R320 V333 E589	L319-A322 HydrophobicContact CB-CB 3.76Å; L319-A322 HydrophobicContact CD1-CB 3.99Å; L319-A322 HydrophobicContact CG-CB 4.48Å; R320-A322 PolarHBondContact O-N 2.73Å; A322-V333 HydrophobicContact CB-CG1 4.06Å; A322-E589 WeakPolarHBondContact O-CG 3.32Å
323	C	94.5	Very high	91.7	Very high	12 Å²	12	23 Å²	23	8%	0.081	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	148.4	174.5	-63.3	0	0	0	0	110.2	I334 F378 L380	C323-I334 PolarHBondContact N-O 3.46Å; C323-I334 PolarHBondContact O-N 3.12Å; C323-F378 HydrophobicContact CB-CE2 3.96Å; C323-F378 HydrophobicContact CB-CZ 3.86Å; C323-F378 PolarHBondContact SG-O 2.92Å; C323-L380 HydrophobicContact CB-CB 4.34Å; C323-L380 HydrophobicContact CB-CD1 3.35Å; C323-L380 HydrophobicContact CB-CG 3.44Å; C323-L380 VanDerWaalsContact CB-CG 3.44Å
324	V	95.5	Very high	92	Very high	15 Å²	15	22.1 Å²	22.1	9%	0.091	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	138.3	-175.6	-179.2	0	0	0	0	109.8	V285 L331 F332 V333 E589 T591	V285-V324 HydrophobicContact CB-CG1 4.25Å; V285-V324 HydrophobicContact CB-CG2 4Å; V285-V324 HydrophobicContact CG1-CG1 4.46Å; V285-V324 HydrophobicContact CG1-CG2 3.83Å; V285-V324 HydrophobicContact CG2-CG1 4.14Å; V324-L331 HydrophobicContact CG1-CD1 3.29Å; V324-L331 HydrophobicContact CG1-CG 4.46Å; V324-F332 VanDerWaalsContact CA-O 3.29Å; V324-F332 WeakPolarHBondContact CA-O 3.12Å; V324-V333 HydrophobicContact CG2-CG1 4.44Å; V324-V333 HydrophobicContact CG2-CG2 4.21Å; V324-E589 HydrophobicContact CB-CB 3.73Å; V324-E589 HydrophobicContact CB-CG 4.38Å; V324-E589 HydrophobicContact CG2-CB 3.61Å; V324-E589 HydrophobicContact CG2-CG 4.07Å; V324-T591 HydrophobicContact CG1-CG2 3.81Å
325	C	95.4	Very high	92.1	Very high	11 Å²	11	19.7 Å²	19.7	7%	0.074	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	164.7	171.3	63.3	0	0	0	0	110.5	F332 L380 V382	C325-F332 PolarHBondContact N-O 3.13Å; C325-F332 VanDerWaalsContact N-O 3.1Å; C325-F332 PolarHBondContact O-N 3.07Å; C325-L380 HydrophobicContact CB-CD1 4.3Å; C325-V382 HydrophobicContact CB-CG2 3.92Å
326	S	94.6	Very high	92.2	Very high	37 Å²	37	19.4 Å²	19.4	26%	0.259	12%	0.117	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.5	170.6	57.4	0	0	0	0	111	F330 T591 L592	S326-F330 WeakPolarHBondContact CA-O 3.41Å; S326-F330 WeakPolarHBondContact CB-O 3.48Å; S326-T591 PolarHBondContact N-OG1 3.39Å; S326-T591 PolarHBondContact OG-OG1 3.14Å; S326-L592 WeakPolarHBondContact CB-O 3.37Å; S326-L592 PolarHBondContact OG-O 2.71Å
327	V	94.1	Very high	92.2	Very high	4 Å²	4	17.7 Å²	17.7	2%	0.024	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	129.4	176.3	-173.4	0	0	0	0	107.8	P266 G329 F330 F332 V382 D385 I387 M413	P266-V327 HydrophobicContact CB-CB 4.25Å; P266-V327 HydrophobicContact CB-CG1 3.87Å; V327-G329 PolarHBondContact O-N 3.4Å; V327-G329 VanDerWaalsContact O-N 3.13Å; V327-F330 PolarHBondContact N-O 3.47Å; V327-F330 PolarHBondContact O-N 3.39Å; V327-F332 HydrophobicContact CB-CE2 4.1Å; V327-F332 HydrophobicContact CG2-CE2 4.49Å; V327-V382 HydrophobicContact CG2-CG1 3.85Å; V327-V382 HydrophobicContact CG2-CG2 3.91Å; V327-D385 HydrophobicContact CG1-CB 3.98Å; V327-I387 HydrophobicContact CG2-CD1 3.94Å; V327-I387 HydrophobicContact CG2-CG1 3.73Å; V327-M413 HydrophobicContact CB-CE 4.29Å; V327-M413 HydrophobicContact CG1-CE 4.25Å; V327-M413 HydrophobicContact CG2-CE 4.33Å
328	G	90.8	Very high	92.2	Very high	23 Å²	23	16.5 Å²	16.5	24%	0.237	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	30.7	174.8	0	0	0	0	0	115.6	P266 Q269 F330	P266-G328 VanDerWaalsContact O-CA 3.28Å; P266-G328 WeakPolarHBondContact O-CA 3.41Å; Q269-G328 VanDerWaalsContact CD-O 3.27Å; Q269-G328 VanDerWaalsContact CG-O 3.27Å; Q269-G328 WeakPolarHBondContact CG-O 3.36Å; Q269-G328 PolarHBondContact NE2-O 3.06Å; G328-F330 VanDerWaalsContact C-N 3.33Å; G328-F330 VanDerWaalsContact O-CD2 3.28Å; G328-F330 WeakPolarHBondContact O-CD2 3.32Å
329	G	91.1	Very high	91.8	Very high	31 Å²	31	14.6 Å²	14.6	32%	0.32	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	13.6	-176.9	0	0	0	0	0	114.9	V327 P360	V327-G329 PolarHBondContact O-N 3.4Å; V327-G329 VanDerWaalsContact O-N 3.13Å; G329-P360 VanDerWaalsContact O-CD 3.26Å; G329-P360 WeakPolarHBondContact O-CD 3.47Å; G329-P360 WeakPolarHBondContact O-CG 3.23Å
330	F	93.9	Very high	91.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	150.2	170.8	-61.4	-93.9	0	0	0	110.7	Y258 Q265 P266 S326 V327 G328 F332 R357 D359	Y258-F330 WeakPolarHBondContact OH-CZ 3.34Å; Q265-F330 HydrophobicContact CB-CE2 3.86Å; Q265-F330 HydrophobicContact CB-CZ 3.65Å; P266-F330 HydrophobicContact CB-CD2 4Å; P266-F330 HydrophobicContact CB-CE2 4.39Å; P266-F330 HydrophobicContact CG-CD2 3.69Å; P266-F330 HydrophobicContact CG-CE2 4.02Å; P266-F330 HydrophobicContact CG-CG 4.34Å; S326-F330 WeakPolarHBondContact CA-O 3.41Å; S326-F330 WeakPolarHBondContact CB-O 3.48Å; V327-F330 PolarHBondContact N-O 3.47Å; V327-F330 PolarHBondContact O-N 3.39Å; G328-F330 VanDerWaalsContact C-N 3.33Å; G328-F330 VanDerWaalsContact O-CD2 3.28Å; G328-F330 WeakPolarHBondContact O-CD2 3.32Å; F330-F332 HydrophobicContact CB-CD2 4.44Å; F330-F332 HydrophobicContact CB-CE2 3.86Å; F330-R357 HydrophobicContact CB-CG 3.97Å; F330-R357 HydrophobicContact CD1-CG 4.1Å; F330-R357 HydrophobicContact CG-CG 4.35Å; F330-D359 HydrophobicContact CD1-CB 4.03Å; F330-D359 HydrophobicContact CE1-CB 3.91Å; F330-D359 WeakPolarHBondContact CE1-OD2 3.35Å
331	L	95.5	Very high	90	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131	173.8	168	74.3	0	0	0	109.5	L283 V285 F313 V324 V333 R357 Y358 W365 T591 L593	L283-L331 HydrophobicContact CD1-CD2 4.12Å; V285-L331 HydrophobicContact CG2-CD1 4.31Å; V285-L331 HydrophobicContact CG2-CD2 4.26Å; F313-L331 HydrophobicContact CE2-CD2 4.17Å; F313-L331 HydrophobicContact CZ-CD2 4.39Å; V324-L331 HydrophobicContact CG1-CD1 3.29Å; V324-L331 HydrophobicContact CG1-CG 4.46Å; L331-V333 HydrophobicContact CG-CG2 4.47Å; L331-R357 CarbonylContact O-C 3.5Å; L331-R357 VanDerWaalsContact O-CA 3.3Å; L331-R357 WeakPolarHBondContact O-CA 3.43Å; L331-Y358 HydrophobicContact CB-CD1 4.33Å; L331-Y358 HydrophobicContact CD2-CD1 4.34Å; L331-Y358 PolarHBondContact N-O 2.69Å; L331-Y358 VanDerWaalsContact N-O 3.11Å; L331-Y358 PolarHBondContact O-N 3.27Å; L331-W365 HydrophobicContact CD2-CH2 3.8Å; L331-W365 HydrophobicContact CD2-CZ2 4.28Å; L331-W365 HydrophobicContact CG-CH2 4.35Å; L331-T591 HydrophobicContact CD1-CG2 3.47Å; L331-T591 VanDerWaalsContact CD1-CG2 3.47Å; L331-L593 HydrophobicContact CB-CD1 4.35Å; L331-L593 HydrophobicContact CB-CD2 3.88Å
332	F	96.6	Very high	88.4	Confident	1 Å²	1	21.9 Å²	21.9	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.1	175.7	-70.2	-98.1	0	0	0	110.1	P266 V324 C325 V327 F330 I334 V355 W356 R357 I387 M413	P266-F332 HydrophobicContact CG-CE2 4.25Å; P266-F332 HydrophobicContact CG-CZ 3.97Å; V324-F332 VanDerWaalsContact CA-O 3.29Å; V324-F332 WeakPolarHBondContact CA-O 3.12Å; C325-F332 PolarHBondContact N-O 3.13Å; C325-F332 VanDerWaalsContact N-O 3.1Å; C325-F332 PolarHBondContact O-N 3.07Å; V327-F332 HydrophobicContact CB-CE2 4.1Å; V327-F332 HydrophobicContact CG2-CE2 4.49Å; F330-F332 HydrophobicContact CB-CD2 4.44Å; F330-F332 HydrophobicContact CB-CE2 3.86Å; F332-I334 HydrophobicContact CB-CD1 4.25Å; F332-I334 HydrophobicContact CB-CG1 4.28Å; F332-V355 HydrophobicContact CD1-CG1 4.16Å; F332-W356 CarbonylContact C-O 3.53Å; F332-W356 WeakPolarHBondContact CA-O 3.19Å; F332-R357 HydrophobicContact CD1-CB 4.12Å; F332-R357 HydrophobicContact CD1-CG 4.18Å; F332-R357 HydrophobicContact CE1-CB 3.94Å; F332-R357 HydrophobicContact CE1-CG 3.76Å; F332-R357 HydrophobicContact CE2-CG 4.14Å; F332-R357 HydrophobicContact CZ-CB 4.43Å; F332-R357 VanDerWaalsContact CZ-CD 3.49Å; F332-R357 HydrophobicContact CZ-CG 3.74Å; F332-I387 HydrophobicContact CB-CD1 4.25Å; F332-I387 HydrophobicContact CD1-CD1 3.97Å; F332-I387 HydrophobicContact CD2-CD1 3.94Å; F332-I387 HydrophobicContact CE1-CD1 4.26Å; F332-I387 HydrophobicContact CE2-CD1 4.24Å; F332-I387 HydrophobicContact CG-CD1 3.79Å; F332-I387 HydrophobicContact CZ-CD1 4.39Å; F332-M413 HydrophobicContact CE1-CE 4.21Å; F332-M413 HydrophobicContact CE2-CE 4.07Å; F332-M413 HydrophobicContact CZ-CE 3.69Å; F332-M413 HydrophobicContact CZ-SD 4.1Å
333	V	96.1	Very high	86.4	Confident	3 Å²	3	28.9 Å²	28.9	2%	0.018	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	119.5	174	-176.6	0	0	0	0	107.7	V285 L315 L319 A322 V324 L331 W356 W365	V285-V333 HydrophobicContact CG1-CG2 4.19Å; L315-V333 HydrophobicContact CD2-CG1 4.36Å; L315-V333 HydrophobicContact CD2-CG2 3.78Å; L319-V333 HydrophobicContact CD1-CG1 3.68Å; A322-V333 HydrophobicContact CB-CG1 4.06Å; V324-V333 HydrophobicContact CG2-CG1 4.44Å; V324-V333 HydrophobicContact CG2-CG2 4.21Å; L331-V333 HydrophobicContact CG-CG2 4.47Å; V333-W356 HydrophobicContact CB-CB 4.44Å; V333-W356 PolarHBondContact N-O 3.07Å; V333-W356 PolarHBondContact O-N 3.02Å; V333-W365 HydrophobicContact CB-CZ3 4.41Å; V333-W365 HydrophobicContact CG2-CH2 3.61Å; V333-W365 HydrophobicContact CG2-CZ3 3.83Å
334	I	96.1	Very high	84.4	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.4	-163.9	-54.5	-173.7	0	0	0	110.1	C323 F332 V355 M371 F378 L380 I387 W418	C323-I334 PolarHBondContact N-O 3.46Å; C323-I334 PolarHBondContact O-N 3.12Å; F332-I334 HydrophobicContact CB-CD1 4.25Å; F332-I334 HydrophobicContact CB-CG1 4.28Å; I334-V355 HydrophobicContact CD1-CG1 4.45Å; I334-V355 HydrophobicContact CG1-CG1 4.14Å; I334-V355 HydrophobicContact CG1-CG2 4.36Å; I334-V355 HydrophobicContact CG2-CG2 4.07Å; I334-M371 HydrophobicContact CG2-CE 3.62Å; I334-M371 HydrophobicContact CG2-CG 3.97Å; I334-M371 HydrophobicContact CG2-SD 3.32Å; I334-M371 WeakPolarHBondContact CG2-SD 3.34Å; I334-F378 HydrophobicContact CB-CZ 4.37Å; I334-F378 HydrophobicContact CG2-CE2 4.24Å; I334-F378 HydrophobicContact CG2-CZ 3.97Å; I334-F378 WeakPolarHBondContact O-CZ 3.41Å; I334-L380 HydrophobicContact CB-CD1 4.19Å; I334-L380 HydrophobicContact CD1-CD1 3.88Å; I334-L380 HydrophobicContact CD1-CD2 4.11Å; I334-L380 HydrophobicContact CG1-CD1 4.2Å; I334-I387 HydrophobicContact CD1-CD1 4.42Å; I334-I387 HydrophobicContact CD1-CG2 3.91Å; I334-W418 HydrophobicContact CD1-CH2 4.02Å; I334-W418 HydrophobicContact CD1-CZ2 4.06Å; I334-W418 HydrophobicContact CG2-CH2 4.45Å; I334-W418 HydrophobicContact CG2-CZ2 4.41Å
335	G	93.9	Very high	82.3	Confident	1 Å²	1	47 Å²	47	1%	0.01	25%	0.249	C	C	.	.			trans	61.2	-145.1	170.8	0	0	0	0	0	114.3	S352 Q354	G335-S352 WeakPolarHBondContact CA-O 3.38Å; G335-Q354 PolarHBondContact N-O 2.99Å
336	G	91.4	Very high	80.3	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.			trans	87.9	-161.6	-177.4	0	0	0	0	0	112.7	R320 N321 S352 R375	R320-G336 CarbonylContact O-C 3.59Å; R320-G336 WeakPolarHBondContact O-CA 3.33Å; N321-G336 WeakPolarHBondContact O-CA 3.36Å; G336-S352 PolarHBondContact O-N 3.3Å; G336-R375 PolarHBondContact N-O 3.47Å
337	E	88.5	Confident	78.7	Confident	8 Å²	8	51.1 Å²	51.1	4%	0.037	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.6	178.8	-75.1	167.8	158.9	0	0	110	L319 R320 V349 S350 V376	L319-E337 WeakPolarHBondContact CA-O 3.24Å; R320-E337 HydrophobicContact CB-CB 4.29Å; R320-E337 IonicContact CZ-OE2 2.82Å; R320-E337 PolarHBondContact N-O 3.3Å; R320-E337 IonicContact NE-OE2 3.86Å; R320-E337 PolarHBondContact NE-OE2 3.22Å; R320-E337 IonicContact NH2-OE1 2.68Å; R320-E337 IonicContact NH2-OE2 3.76Å; R320-E337 PolarHBondContact NH2-OE2 3.45Å; R320-E337 PolarHBondContact O-N 3.3Å; E337-V349 HydrophobicContact CB-CG1 3.69Å; E337-V349 HydrophobicContact CG-CG1 3.8Å; E337-S350 WeakPolarHBondContact CA-O 3.33Å; E337-V376 HydrophobicContact CG-CB 4.15Å; E337-V376 HydrophobicContact CG-CG1 4.49Å; E337-V376 HydrophobicContact CG-CG2 3.81Å
338	D	85.1	Confident	77.3	Confident	10 Å²	10	54.3 Å²	54.3	5%	0.053	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	123.3	173.3	-172.6	12.2	0	0	0	109.5	L319 K340 S350	L319-D338 HydrophobicContact CD2-CB 4.13Å; D338-K340 WeakPolarHBondContact OD2-CE 3.38Å; D338-K340 IonicContact OD2-NZ 3.49Å; D338-S350 PolarHBondContact N-O 3.35Å; D338-S350 PolarHBondContact O-N 3.03Å
339	M	80.8	Confident	76.5	Confident	15 Å²	15	56.4 Å²	56.4	7%	0.074	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	95.3	179.9	-60.1	-63.4	-83.3	0	0	108.6	D292 P294 R318 V347 V349	D292-M339 WeakPolarHBondContact O-CE 3.38Å; P294-M339 HydrophobicContact CG-CG 4.31Å; R318-M339 HydrophobicContact CB-CB 4.46Å; R318-M339 HydrophobicContact CG-CB 4.12Å; R318-M339 PolarHBondContact O-N 3.34Å; M339-V347 HydrophobicContact CB-CG1 4.45Å; M339-V347 HydrophobicContact CE-CG1 3.55Å; M339-V347 HydrophobicContact SD-CG1 4.2Å; M339-V349 HydrophobicContact CE-CG2 4.04Å; M339-V349 HydrophobicContact SD-CB 4.26Å; M339-V349 HydrophobicContact SD-CG1 3.94Å; M339-V349 HydrophobicContact SD-CG2 3.62Å
340	K	73.7	Confident	76.1	Confident	116 Å²	116	57.6 Å²	57.6	50%	0.504	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.9	175.5	-65.3	-173.1	-174.3	-177.8	0	110.5	D338 S342 T348	D338-K340 WeakPolarHBondContact OD2-CE 3.38Å; D338-K340 IonicContact OD2-NZ 3.49Å; K340-S342 PolarHBondContact O-N 3.47Å; K340-T348 PolarHBondContact N-O 3.21Å; K340-T348 PolarHBondContact O-N 3.31Å; K340-T348 PolarHBondContact O-OG1 2.92Å
341	N	63.1	Low	75.7	Confident	123 Å²	123	58.5 Å²	58.5	66%	0.658	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	113.9	164.6	-86.4	-14	0	0	0	108.6	W293	W293-N341 VanDerWaalsContact CH2-OD1 3.25Å; W293-N341 WeakPolarHBondContact CH2-OD1 3.48Å
342	S	53.3	Low	75.5	Confident	39 Å²	39	59 Å²	59	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	135.2	156.8	37.1	0	0	0	0	107.9	K340 E344 S346 T348	K340-S342 PolarHBondContact O-N 3.47Å; S342-E344 PolarHBondContact O-N 3.16Å; S342-S346 PolarHBondContact N-O 3.38Å; S342-S346 PolarHBondContact OG-O 3.42Å; S342-S346 PolarHBondContact OG-OG 3.04Å; S342-T348 WeakPolarHBondContact OG-CG2 3.39Å
343	D	49.5	Very low	75.3	Confident	158 Å²	158	60.7 Å²	60.7	85%	0.845	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	0	106	-179.9	-67.2	-21.2	0	0	0	116.2	K345	D343-K345 PolarHBondContact O-N 3.26Å
344	E	52.6	Low	75.3	Confident	202 Å²	202	63.3 Å²	63.3	94%	0.944	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	30.8	-5.6	167.2	-68.8	-171.6	165.3	0	0	122.3	S342	S342-E344 PolarHBondContact O-N 3.16Å
345	K	51.5	Low	75.3	Confident	205 Å²	205	63.3 Å²	63.3	89%	0.891	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.7	-2.7	-175.1	-69.8	-173.9	-179.2	175.3	0	115.2	D343	D343-K345 PolarHBondContact O-N 3.26Å
346	S	54.5	Low	75.4	Confident	68 Å²	68	65.2 Å²	65.2	48%	0.476	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	126.4	175.2	67	0	0	0	0	113.7	S342	S342-S346 PolarHBondContact N-O 3.38Å; S342-S346 PolarHBondContact OG-O 3.42Å; S342-S346 PolarHBondContact OG-OG 3.04Å
347	V	61.5	Low	75.6	Confident	67 Å²	67	65.7 Å²	65.7	41%	0.406	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	116.8	171.6	-178.9	0	0	0	0	107.9	W293 M339 V349	W293-V347 HydrophobicContact CZ3-CG1 4.35Å; W293-V347 HydrophobicContact CZ3-CG2 3.98Å; M339-V347 HydrophobicContact CB-CG1 4.45Å; M339-V347 HydrophobicContact CE-CG1 3.55Å; M339-V347 HydrophobicContact SD-CG1 4.2Å; V347-V349 HydrophobicContact CG1-CG2 4.29Å
348	T	63.7	Low	75.9	Confident	70 Å²	70	65.5 Å²	65.5	43%	0.429	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.4	173.5	41.8	0	0	0	0	109	K340 S342	K340-T348 PolarHBondContact N-O 3.21Å; K340-T348 PolarHBondContact O-N 3.31Å; K340-T348 PolarHBondContact O-OG1 2.92Å; S342-T348 WeakPolarHBondContact OG-CG2 3.39Å
349	V	75	Confident	76.3	Confident	67 Å²	67	65.7 Å²	65.7	41%	0.406	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.1	179.2	-171.9	0	0	0	0	108	E337 M339 V347	E337-V349 HydrophobicContact CB-CG1 3.69Å; E337-V349 HydrophobicContact CG-CG1 3.8Å; M339-V349 HydrophobicContact CE-CG2 4.04Å; M339-V349 HydrophobicContact SD-CB 4.26Å; M339-V349 HydrophobicContact SD-CG1 3.94Å; M339-V349 HydrophobicContact SD-CG2 3.62Å; V347-V349 HydrophobicContact CG1-CG2 4.29Å
350	S	80.9	Confident	76.8	Confident	57 Å²	57	65 Å²	65	40%	0.399	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129	178.3	65	0	0	0	0	111.4	E337 D338 S352	E337-S350 WeakPolarHBondContact CA-O 3.33Å; D338-S350 PolarHBondContact N-O 3.35Å; D338-S350 PolarHBondContact O-N 3.03Å; S350-S352 PolarHBondContact O-N 3.5Å
351	T	87	Confident	77.5	Confident	18 Å²	18	61.1 Å²	61.1	11%	0.11	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	125.7	173.7	-48.3	0	0	0	0	109.4	R374 R375 V376 S395	T351-R374 HydrophobicContact CG2-CB 4.12Å; T351-R375 VanDerWaalsContact CG2-C 3.49Å; T351-V376 HydrophobicContact CG2-CB 4.23Å; T351-V376 HydrophobicContact CG2-CG1 4.41Å; T351-S395 WeakPolarHBondContact OG1-CB 3.49Å; T351-S395 PolarHBondContact OG1-N 3.41Å; T351-S395 PolarHBondContact OG1-OG 2.93Å
352	S	90.6	Very high	78.7	Confident	12 Å²	12	58.9 Å²	58.9	8%	0.084	31%	0.311	C	S	.	.			trans	-102.9	148.9	-174.5	-171.9	0	0	0	0	112	G335 G336 S350 Q354 R375	G335-S352 WeakPolarHBondContact CA-O 3.38Å; G336-S352 PolarHBondContact O-N 3.3Å; S350-S352 PolarHBondContact O-N 3.5Å; S352-Q354 WeakPolarHBondContact OG-CB 3.16Å; S352-Q354 WeakPolarHBondContact OG-CG 3.45Å; S352-Q354 PolarHBondContact OG-N 3.15Å; S352-R375 PolarHBondContact O-N 3.02Å
353	S	93.4	Very high	80.5	Confident	35 Å²	35	61.2 Å²	61.2	25%	0.245	32%	0.32	C	S	.	.			trans	-107.1	4.5	164.8	56	0	0	0	0	112.1	S370 M371	S353-S370 CarbonylContact O-C 3.51Å; S353-S370 WeakPolarHBondContact O-CA 3.26Å; S353-M371 WeakPolarHBondContact CB-O 3.31Å; S353-M371 WeakPolarHBondContact O-CB 3.39Å; S353-M371 PolarHBondContact O-N 3.37Å
354	Q	94.8	Very high	82.5	Confident	59 Å²	59	59.2 Å²	59.2	28%	0.276	31%	0.306	S	S	.	.			trans	-68.7	148	-173.1	-66.5	-178	-16.3	0	0	112.3	G335 S352	G335-Q354 PolarHBondContact N-O 2.99Å; S352-Q354 WeakPolarHBondContact OG-CB 3.16Å; S352-Q354 WeakPolarHBondContact OG-CG 3.45Å; S352-Q354 PolarHBondContact OG-N 3.15Å
355	V	96.2	Very high	84.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124.3	177.3	178.4	0	0	0	0	108.3	F332 I334 M368 E369 M371 W418	F332-V355 HydrophobicContact CD1-CG1 4.16Å; I334-V355 HydrophobicContact CD1-CG1 4.45Å; I334-V355 HydrophobicContact CG1-CG1 4.14Å; I334-V355 HydrophobicContact CG1-CG2 4.36Å; I334-V355 HydrophobicContact CG2-CG2 4.07Å; V355-M368 HydrophobicContact CB-CB 4.08Å; V355-M368 HydrophobicContact CG1-CB 3.79Å; V355-M368 HydrophobicContact CG1-CG 4.19Å; V355-M368 PolarHBondContact O-N 3.08Å; V355-E369 WeakPolarHBondContact CB-O 3.46Å; V355-E369 WeakPolarHBondContact CG2-O 3.37Å; V355-M371 HydrophobicContact CG2-CG 4.18Å; V355-W418 HydrophobicContact CG2-CZ2 3.69Å
356	W	96.2	Very high	86.6	Confident	41 Å²	41	46.3 Å²	46.3	16%	0.155	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.8	176.7	-71	92.9	0	0	0	109.5	P316 L317 F332 V333 W365 Q367	P316-W356 HydrophobicContact CB-CD2 4.15Å; P316-W356 HydrophobicContact CB-CE3 4.07Å; P316-W356 HydrophobicContact CB-CH2 4.19Å; P316-W356 HydrophobicContact CB-CZ2 4.28Å; P316-W356 HydrophobicContact CB-CZ3 4.08Å; P316-W356 HydrophobicContact CG-CB 4.21Å; P316-W356 HydrophobicContact CG-CD2 3.45Å; P316-W356 VanDerWaalsContact CG-CD2 3.45Å; P316-W356 HydrophobicContact CG-CE3 3.64Å; P316-W356 HydrophobicContact CG-CG 3.71Å; P316-W356 HydrophobicContact CG-CZ2 4.39Å; P316-W356 HydrophobicContact CG-CZ3 4.17Å; L317-W356 HydrophobicContact CD1-CZ2 4.37Å; F332-W356 CarbonylContact C-O 3.53Å; F332-W356 WeakPolarHBondContact CA-O 3.19Å; V333-W356 HydrophobicContact CB-CB 4.44Å; V333-W356 PolarHBondContact N-O 3.07Å; V333-W356 PolarHBondContact O-N 3.02Å; W356-W365 HydrophobicContact CB-CE3 3.82Å; W356-W365 HydrophobicContact CB-CZ3 3.9Å; W356-W365 HydrophobicContact CE3-CB 4.32Å; W356-Q367 HydrophobicContact CD2-CB 4.4Å; W356-Q367 HydrophobicContact CE3-CB 4.04Å; W356-Q367 HydrophobicContact CH2-CB 3.94Å; W356-Q367 HydrophobicContact CH2-CG 4.43Å; W356-Q367 HydrophobicContact CZ2-CB 4.28Å; W356-Q367 HydrophobicContact CZ2-CG 4.29Å; W356-Q367 HydrophobicContact CZ3-CB 3.81Å
357	R	96.2	Very high	88.6	Confident	10 Å²	10	47.7 Å²	47.7	4%	0.038	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.3	175.4	-173.2	-175.7	75.2	170	9.8	109.8	G262 F330 L331 F332 W365 K366 M368	G262-R357 PolarHBondContact O-NH1 2.96Å; G262-R357 PolarHBondContact O-NH2 3.41Å; F330-R357 HydrophobicContact CB-CG 3.97Å; F330-R357 HydrophobicContact CD1-CG 4.1Å; F330-R357 HydrophobicContact CG-CG 4.35Å; L331-R357 CarbonylContact O-C 3.5Å; L331-R357 VanDerWaalsContact O-CA 3.3Å; L331-R357 WeakPolarHBondContact O-CA 3.43Å; F332-R357 HydrophobicContact CD1-CB 4.12Å; F332-R357 HydrophobicContact CD1-CG 4.18Å; F332-R357 HydrophobicContact CE1-CB 3.94Å; F332-R357 HydrophobicContact CE1-CG 3.76Å; F332-R357 HydrophobicContact CE2-CG 4.14Å; F332-R357 HydrophobicContact CZ-CB 4.43Å; F332-R357 VanDerWaalsContact CZ-CD 3.49Å; F332-R357 HydrophobicContact CZ-CG 3.74Å; R357-W365 CarbonylContact O-C 3.6Å; R357-W365 WeakPolarHBondContact O-CA 3.23Å; R357-K366 PolarHBondContact N-O 3.02Å; R357-K366 PolarHBondContact O-N 3.37Å; R357-M368 HydrophobicContact CB-CG 3.59Å; R357-M368 HydrophobicContact CB-SD 3.86Å
358	Y	95.3	Very high	90.2	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.016	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.9	172.2	176.4	-107.6	0	0	0	110.7	F313 L331 P360 N363 W365 L593	F313-Y358 HydrophobicContact CB-CE2 4.04Å; F313-Y358 AromaticContact CD1-CE1 3.8Å; F313-Y358 HydrophobicContact CD1-CE1 3.8Å; F313-Y358 HydrophobicContact CD1-CE2 4.06Å; F313-Y358 AromaticContact CD1-CZ 3.37Å; F313-Y358 WeakPolarHBondContact CD1-OH 3.36Å; F313-Y358 HydrophobicContact CD2-CD2 4.21Å; F313-Y358 HydrophobicContact CD2-CE1 4.22Å; F313-Y358 AromaticContact CD2-CE2 3.9Å; F313-Y358 HydrophobicContact CD2-CE2 3.9Å; F313-Y358 HydrophobicContact CD2-CG 4.5Å; F313-Y358 AromaticContact CD2-CZ 3.91Å; F313-Y358 HydrophobicContact CE1-CD1 4.27Å; F313-Y358 AromaticContact CE1-CE1 3.41Å; F313-Y358 HydrophobicContact CE1-CE1 3.41Å; F313-Y358 VanDerWaalsContact CE1-CE1 3.41Å; F313-Y358 HydrophobicContact CE1-CE2 4.46Å; F313-Y358 AromaticContact CE1-CZ 3.53Å; F313-Y358 WeakPolarHBondContact CE1-OH 3.29Å; F313-Y358 AromaticContact CE2-CD1 3.99Å; F313-Y358 HydrophobicContact CE2-CD1 3.99Å; F313-Y358 HydrophobicContact CE2-CD2 4.43Å; F313-Y358 AromaticContact CE2-CE1 3.89Å; F313-Y358 HydrophobicContact CE2-CE1 3.89Å; F313-Y358 HydrophobicContact CE2-CE2 4.33Å; F313-Y358 HydrophobicContact CE2-CG 4.26Å; F313-Y358 HydrophobicContact CG-CE1 4.18Å; F313-Y358 AromaticContact CG-CE2 3.75Å; F313-Y358 HydrophobicContact CG-CE2 3.75Å; F313-Y358 AromaticContact CG-CZ 3.56Å; F313-Y358 AromaticContact CZ-CD1 3.86Å; F313-Y358 HydrophobicContact CZ-CD1 3.86Å; F313-Y358 AromaticContact CZ-CE1 3.47Å; F313-Y358 HydrophobicContact CZ-CE1 3.47Å; F313-Y358 VanDerWaalsContact CZ-CE1 3.47Å; F313-Y358 AromaticContact CZ-CZ 3.9Å; L331-Y358 HydrophobicContact CB-CD1 4.33Å; L331-Y358 HydrophobicContact CD2-CD1 4.34Å; L331-Y358 PolarHBondContact N-O 2.69Å; L331-Y358 VanDerWaalsContact N-O 3.11Å; L331-Y358 PolarHBondContact O-N 3.27Å; Y358-P360 HydrophobicContact CD1-CB 4.41Å; Y358-P360 HydrophobicContact CE1-CB 3.83Å; Y358-N363 VanDerWaalsContact CE2-OD1 3.28Å; Y358-N363 WeakPolarHBondContact CE2-OD1 3.45Å; Y358-N363 PolarHBondContact OH-OD1 2.77Å; Y358-W365 AromaticContact CD2-CD1 3.83Å; Y358-W365 AromaticContact CD2-CD2 3.88Å; Y358-W365 HydrophobicContact CD2-CD2 3.88Å; Y358-W365 AromaticContact CD2-CE2 3.6Å; Y358-W365 HydrophobicContact CD2-CG 4.02Å; Y358-W365 HydrophobicContact CD2-CZ2 4.11Å; Y358-W365 AromaticContact CD2-NE1 3.58Å; Y358-W365 HydrophobicContact CG-CD2 4.23Å; Y358-W365 AromaticContact CG-CE2 3.95Å; Y358-W365 HydrophobicContact CG-CH2 4.37Å; Y358-W365 HydrophobicContact CG-CZ2 4.03Å; Y358-L593 HydrophobicContact CD1-CD2 4.31Å
359	D	93.3	Very high	91.7	Very high	13 Å²	13	47.5 Å²	47.5	7%	0.07	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	107.1	171.3	-170.1	-19.7	0	0	0	109.8	F330 R361 F362 N363 H364	F330-D359 HydrophobicContact CD1-CB 4.03Å; F330-D359 HydrophobicContact CE1-CB 3.91Å; F330-D359 WeakPolarHBondContact CE1-OD2 3.35Å; D359-R361 PolarHBondContact O-N 3.39Å; D359-R361 VanDerWaalsContact OD1-CB 3.25Å; D359-R361 WeakPolarHBondContact OD1-CB 3.44Å; D359-R361 WeakPolarHBondContact OD1-CG 3.45Å; D359-R361 IonicContact OD1-CZ 3.42Å; D359-R361 PolarHBondContact OD1-N 3.35Å; D359-R361 IonicContact OD1-NE 3.48Å; D359-R361 PolarHBondContact OD1-NE 3.24Å; D359-R361 IonicContact OD1-NH2 3.14Å; D359-R361 IonicContact OD2-CZ 2.71Å; D359-R361 IonicContact OD2-NE 2.55Å; D359-R361 PolarHBondContact OD2-NE 3.17Å; D359-R361 IonicContact OD2-NH2 2.62Å; D359-R361 PolarHBondContact OD2-NH2 3.13Å; D359-F362 PolarHBondContact O-N 3.4Å; D359-F362 WeakPolarHBondContact OD2-CD2 3.28Å; D359-N363 PolarHBondContact O-N 3.37Å; D359-H364 PolarHBondContact N-O 2.73Å; D359-H364 PolarHBondContact O-N 2.69Å
360	P	90.9	Very high	92.8	Very high	2 Å²	2	46 Å²	46	1%	0.013	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.1	-179.6	26.6	-33.9	0	0	0	112.9	L275 G329 Y358 L593 L595 P596	L275-P360 HydrophobicContact CD1-CB 3.95Å; L275-P360 HydrophobicContact CD1-CG 3.72Å; G329-P360 VanDerWaalsContact O-CD 3.26Å; G329-P360 WeakPolarHBondContact O-CD 3.47Å; G329-P360 WeakPolarHBondContact O-CG 3.23Å; Y358-P360 HydrophobicContact CD1-CB 4.41Å; Y358-P360 HydrophobicContact CE1-CB 3.83Å; P360-L593 HydrophobicContact CB-CD2 4.2Å; P360-L593 HydrophobicContact CG-CD2 4.08Å; P360-L593 HydrophobicContact CG-CG 4.45Å; P360-L595 HydrophobicContact CB-CD2 4.33Å; P360-P596 WeakPolarHBondContact O-CD 3.43Å; P360-P596 VanDerWaalsContact O-CG 3.27Å; P360-P596 WeakPolarHBondContact O-CG 3.48Å
361	R	87.8	Confident	93.5	Very high	33 Å²	33	43.7 Å²	43.7	13%	0.125	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-35.4	-176.9	-60.5	165.4	-65.5	168	18.5	112.4	L227 Y258 S273 L275 D359	L227-R361 HydrophobicContact CD2-CG 3.93Å; Y258-R361 VanDerWaalsContact CZ-NH1 3.25Å; Y258-R361 PolarHBondContact OH-NH1 3.23Å; Y258-R361 PolarHBondContact OH-NH2 2.95Å; S273-R361 PolarHBondContact O-NH1 3.05Å; L275-R361 HydrophobicContact CD1-CG 3.96Å; L275-R361 HydrophobicContact CD2-CB 4.41Å; L275-R361 HydrophobicContact CD2-CG 3.62Å; L275-R361 HydrophobicContact CG-CG 3.64Å; D359-R361 PolarHBondContact O-N 3.39Å; D359-R361 VanDerWaalsContact OD1-CB 3.25Å; D359-R361 WeakPolarHBondContact OD1-CB 3.44Å; D359-R361 WeakPolarHBondContact OD1-CG 3.45Å; D359-R361 IonicContact OD1-CZ 3.42Å; D359-R361 PolarHBondContact OD1-N 3.35Å; D359-R361 IonicContact OD1-NE 3.48Å; D359-R361 PolarHBondContact OD1-NE 3.24Å; D359-R361 IonicContact OD1-NH2 3.14Å; D359-R361 IonicContact OD2-CZ 2.71Å; D359-R361 IonicContact OD2-NE 2.55Å; D359-R361 PolarHBondContact OD2-NE 3.17Å; D359-R361 IonicContact OD2-NH2 2.62Å; D359-R361 PolarHBondContact OD2-NH2 3.13Å
362	F	88.9	Confident	93.9	Very high	77 Å²	77	46.9 Å²	46.9	34%	0.338	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	4.4	-176.9	-56	-61.9	0	0	0	113	A229 H259 D359 H364	A229-F362 HydrophobicContact CB-CE1 4.1Å; H259-F362 AromaticContact CE1-CE2 3.81Å; H259-F362 AromaticContact CE1-CZ 3.57Å; D359-F362 PolarHBondContact O-N 3.4Å; D359-F362 WeakPolarHBondContact OD2-CD2 3.28Å; F362-H364 VanDerWaalsContact C-N 3.29Å; F362-H364 HydrophobicContact CB-CB 4.34Å; F362-H364 PolarHBondContact O-N 3Å
363	N	90.9	Very high	94	Very high	87 Å²	87	48.2 Å²	48.2	47%	0.465	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	50.2	-174	-168.9	22.8	0	0	0	112.5	F313 Y358 D359	F313-N363 VanDerWaalsContact CB-OD1 3.29Å; F313-N363 WeakPolarHBondContact CB-OD1 3.4Å; Y358-N363 VanDerWaalsContact CE2-OD1 3.28Å; Y358-N363 WeakPolarHBondContact CE2-OD1 3.45Å; Y358-N363 PolarHBondContact OH-OD1 2.77Å; D359-N363 PolarHBondContact O-N 3.37Å
364	H	92.2	Very high	93.9	Very high	117 Å²	117	51.6 Å²	51.6	54%	0.542	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.8	-170.4	-172	69.8	0	0	0	112.4	D359 F362	D359-H364 PolarHBondContact N-O 2.73Å; D359-H364 PolarHBondContact O-N 2.69Å; F362-H364 VanDerWaalsContact C-N 3.29Å; F362-H364 HydrophobicContact CB-CB 4.34Å; F362-H364 PolarHBondContact O-N 3Å
365	W	95.1	Very high	93.8	Very high	37 Å²	37	48.9 Å²	48.9	14%	0.14	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	133.7	171.1	-73.6	98.8	0	0	0	110.6	F313 A314 L315 P316 L331 V333 W356 R357 Y358	F313-W365 AromaticContact CD2-CZ2 3.98Å; F313-W365 HydrophobicContact CD2-CZ2 3.98Å; F313-W365 AromaticContact CD2-NE1 3.93Å; F313-W365 AromaticContact CE2-CZ2 3.95Å; F313-W365 HydrophobicContact CE2-CZ2 3.95Å; A314-W365 PolarHBondContact O-NE1 3.14Å; L315-W365 HydrophobicContact CD2-CH2 3.72Å; L315-W365 HydrophobicContact CD2-CZ2 3.83Å; P316-W365 HydrophobicContact CG-CD2 4.28Å; P316-W365 HydrophobicContact CG-CE3 4.35Å; P316-W365 HydrophobicContact CG-CG 4.46Å; L331-W365 HydrophobicContact CD2-CH2 3.8Å; L331-W365 HydrophobicContact CD2-CZ2 4.28Å; L331-W365 HydrophobicContact CG-CH2 4.35Å; V333-W365 HydrophobicContact CB-CZ3 4.41Å; V333-W365 HydrophobicContact CG2-CH2 3.61Å; V333-W365 HydrophobicContact CG2-CZ3 3.83Å; W356-W365 HydrophobicContact CB-CE3 3.82Å; W356-W365 HydrophobicContact CB-CZ3 3.9Å; W356-W365 HydrophobicContact CE3-CB 4.32Å; R357-W365 CarbonylContact O-C 3.6Å; R357-W365 WeakPolarHBondContact O-CA 3.23Å; Y358-W365 AromaticContact CD2-CD1 3.83Å; Y358-W365 AromaticContact CD2-CD2 3.88Å; Y358-W365 HydrophobicContact CD2-CD2 3.88Å; Y358-W365 AromaticContact CD2-CE2 3.6Å; Y358-W365 HydrophobicContact CD2-CG 4.02Å; Y358-W365 HydrophobicContact CD2-CZ2 4.11Å; Y358-W365 AromaticContact CD2-NE1 3.58Å; Y358-W365 HydrophobicContact CG-CD2 4.23Å; Y358-W365 AromaticContact CG-CE2 3.95Å; Y358-W365 HydrophobicContact CG-CH2 4.37Å; Y358-W365 HydrophobicContact CG-CZ2 4.03Å
366	K	94.6	Very high	93.5	Very high	99 Å²	99	48.9 Å²	48.9	43%	0.43	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.8	173.2	-173.2	175.3	-179.9	178.7	0	109.6	R357 M368	R357-K366 PolarHBondContact N-O 3.02Å; R357-K366 PolarHBondContact O-N 3.37Å; K366-M368 HydrophobicContact CB-SD 4.44Å; K366-M368 HydrophobicContact CD-SD 4.2Å; K366-M368 HydrophobicContact CG-SD 4.16Å
367	Q	95.4	Very high	93.3	Very high	97 Å²	97	48.9 Å²	48.9	45%	0.453	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	129.7	168.7	-169	175.8	-3.9	0	0	109	W356	W356-Q367 HydrophobicContact CD2-CB 4.4Å; W356-Q367 HydrophobicContact CE3-CB 4.04Å; W356-Q367 HydrophobicContact CH2-CB 3.94Å; W356-Q367 HydrophobicContact CH2-CG 4.43Å; W356-Q367 HydrophobicContact CZ2-CB 4.28Å; W356-Q367 HydrophobicContact CZ2-CG 4.29Å; W356-Q367 HydrophobicContact CZ3-CB 3.81Å
368	M	95.9	Very high	93.3	Very high	19 Å²	19	48.7 Å²	48.7	9%	0.094	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	178.6	178.8	-54.5	-58.4	-61.8	0	0	110.2	V355 R357 K366 S370 Y411	V355-M368 HydrophobicContact CB-CB 4.08Å; V355-M368 HydrophobicContact CG1-CB 3.79Å; V355-M368 HydrophobicContact CG1-CG 4.19Å; V355-M368 PolarHBondContact O-N 3.08Å; R357-M368 HydrophobicContact CB-CG 3.59Å; R357-M368 HydrophobicContact CB-SD 3.86Å; K366-M368 HydrophobicContact CB-SD 4.44Å; K366-M368 HydrophobicContact CD-SD 4.2Å; K366-M368 HydrophobicContact CG-SD 4.16Å; M368-S370 PolarHBondContact O-N 3.06Å; M368-Y411 WeakPolarHBondContact CE-OH 3.47Å
369	E	96.1	Very high	93.3	Very high	114 Å²	114	49.5 Å²	49.5	53%	0.533	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-55.6	133.8	172.8	-167.4	56.2	-135.4	0	0	110.5	V355 Y411 G416 W418	V355-E369 WeakPolarHBondContact CB-O 3.46Å; V355-E369 WeakPolarHBondContact CG2-O 3.37Å; E369-Y411 HydrophobicContact CB-CE2 4.22Å; E369-G416 VanDerWaalsContact CB-O 3.28Å; E369-G416 WeakPolarHBondContact CB-O 3.45Å; E369-W418 PolarHBondContact O-NE1 3.04Å
370	S	96.6	Very high	93.5	Very high	36 Å²	36	50.2 Å²	50.2	25%	0.252	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-76.4	149.6	-177.7	-62.9	0	0	0	0	110.8	S353 M368 W418	S353-S370 CarbonylContact O-C 3.51Å; S353-S370 WeakPolarHBondContact O-CA 3.26Å; M368-S370 PolarHBondContact O-N 3.06Å; S370-W418 VanDerWaalsContact C-CD1 3.49Å
371	M	96.3	Very high	93.7	Very high	7 Å²	7	50.4 Å²	50.4	3%	0.034	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-54.4	152.9	170.7	-76.9	-169.2	-57.7	0	0	111.5	I334 S353 V355 E373 R375 F378 A389 E409 W418	I334-M371 HydrophobicContact CG2-CE 3.62Å; I334-M371 HydrophobicContact CG2-CG 3.97Å; I334-M371 HydrophobicContact CG2-SD 3.32Å; I334-M371 WeakPolarHBondContact CG2-SD 3.34Å; S353-M371 WeakPolarHBondContact CB-O 3.31Å; S353-M371 WeakPolarHBondContact O-CB 3.39Å; S353-M371 PolarHBondContact O-N 3.37Å; V355-M371 HydrophobicContact CG2-CG 4.18Å; M371-E373 VanDerWaalsContact C-N 3.33Å; M371-E373 WeakPolarHBondContact CB-O 3.43Å; M371-R375 HydrophobicContact CE-CB 4.37Å; M371-F378 HydrophobicContact CE-CZ 4.13Å; M371-F378 HydrophobicContact SD-CE2 4.35Å; M371-F378 HydrophobicContact SD-CZ 4.41Å; M371-A389 HydrophobicContact SD-CB 3.92Å; M371-E409 WeakPolarHBondContact CA-OE1 3.06Å; M371-E409 WeakPolarHBondContact CB-OE1 3.28Å; M371-E409 VanDerWaalsContact CG-OE1 3.24Å; M371-E409 WeakPolarHBondContact CG-OE1 3.47Å; M371-W418 HydrophobicContact CG-CD2 3.99Å; M371-W418 HydrophobicContact CG-CE3 4.23Å; M371-W418 HydrophobicContact CG-CH2 3.93Å; M371-W418 HydrophobicContact CG-CZ2 3.67Å; M371-W418 HydrophobicContact CG-CZ3 4.2Å; M371-W418 HydrophobicContact SD-CH2 4.34Å
372	L	95.6	Very high	94.1	Very high	86 Å²	86	51.1 Å²	51.1	45%	0.45	25%	0.245	S	C	.	.	S	Bend	trans	-67.1	-39.3	178.4	-61	177.9	0	0	0	111	E409 W418 R420	L372-E409 PolarHBondContact N-OE1 2.64Å; L372-W418 HydrophobicContact CD2-CB 4.29Å; L372-W418 HydrophobicContact CG-CB 3.95Å; L372-R420 HydrophobicContact CD1-CG 3.68Å
373	E	91.8	Very high	94.3	Very high	39 Å²	39	47.6 Å²	47.6	18%	0.182	23%	0.23	C	C	.	.	S	Bend	trans	-113.7	147.9	176.3	-51.8	-65.4	164.4	0	0	110.7	M371 R375 L405 Y407 E409 R420	M371-E373 VanDerWaalsContact C-N 3.33Å; M371-E373 WeakPolarHBondContact CB-O 3.43Å; E373-R375 HydrophobicContact CB-CG 4.17Å; E373-L405 HydrophobicContact CB-CD1 4.25Å; E373-Y407 HydrophobicContact CG-CD2 4.5Å; E373-E409 PolarHBondContact N-OE2 3.02Å; E373-R420 IonicContact OE1-CZ 3.69Å; E373-R420 IonicContact OE1-NH2 2.73Å; E373-R420 PolarHBondContact OE1-NH2 3.01Å
374	R	91.8	Very high	94.2	Very high	107 Å²	107	49.5 Å²	49.5	40%	0.404	24%	0.236	S	C	.	.			trans	-84.3	125.6	171.2	53	-177.7	118.4	133.6	2.9	109.7	T351 Q394	T351-R374 HydrophobicContact CG2-CB 4.12Å; R374-Q394 HydrophobicContact CG-CG 3.89Å; R374-Q394 VanDerWaalsContact NH1-NE2 3.16Å
375	R	92.1	Very high	94.1	Very high	1 Å²	1	47.7 Å²	47.7	0%	0.004	23%	0.23	C	C	.	.			trans	-138.1	140.9	-166.6	-54.8	174.3	-175.4	-107.8	4.5	112.4	G336 T351 S352 M371 E373 F378 G391 L405 Y407 E409	G336-R375 PolarHBondContact N-O 3.47Å; T351-R375 VanDerWaalsContact CG2-C 3.49Å; S352-R375 PolarHBondContact O-N 3.02Å; M371-R375 HydrophobicContact CE-CB 4.37Å; E373-R375 HydrophobicContact CB-CG 4.17Å; R375-F378 HydrophobicContact CB-CB 4.25Å; R375-F378 HydrophobicContact CB-CD1 3.55Å; R375-F378 HydrophobicContact CB-CE1 4.03Å; R375-F378 HydrophobicContact CB-CG 3.94Å; R375-F378 WeakPolarHBondContact O-CE1 3.42Å; R375-G391 WeakPolarHBondContact CD-O 3.45Å; R375-G391 PolarHBondContact NH1-O 2.88Å; R375-L405 HydrophobicContact CG-CD1 3.86Å; R375-Y407 PolarHBondContact NH1-O 2.88Å; R375-E409 IonicContact CZ-OE2 2.77Å; R375-E409 IonicContact NE-OE2 3.17Å; R375-E409 PolarHBondContact NE-OE2 2.92Å; R375-E409 VanDerWaalsContact NE-OE2 3.15Å; R375-E409 IonicContact NH2-OE2 3.02Å; R375-E409 PolarHBondContact NH2-OE2 3.29Å
376	V	91.4	Very high	94	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-132.2	154.5	165.6	70.2	0	0	0	0	109.6	N321 E337 T351 F378 G392 R393	N321-V376 HydrophobicContact CB-CG2 3.47Å; N321-V376 VanDerWaalsContact CB-CG2 3.47Å; E337-V376 HydrophobicContact CG-CB 4.15Å; E337-V376 HydrophobicContact CG-CG1 4.49Å; E337-V376 HydrophobicContact CG-CG2 3.81Å; T351-V376 HydrophobicContact CG2-CB 4.23Å; T351-V376 HydrophobicContact CG2-CG1 4.41Å; V376-F378 PolarHBondContact O-N 2.84Å; V376-G392 WeakPolarHBondContact O-CA 3.28Å; V376-R393 HydrophobicContact CG1-CG 3.59Å; V376-R393 PolarHBondContact N-O 3.42Å; V376-R393 PolarHBondContact O-N 3.47Å
377	Q	91.3	Very high	94.1	Very high	41 Å²	41	42.9 Å²	42.9	19%	0.192	21%	0.213	C	C	.	.	S	Bend	trans	54.4	34	-177.4	-56.1	-173.9	-57.3	0	0	113.1	R393 H429 G430	Q377-R393 VanDerWaalsContact OE1-NH1 3.17Å; Q377-H429 PolarHBondContact OE1-CD2 2.77Å; Q377-G430 PolarHBondContact O-N 3.46Å
378	F	95.3	Very high	94.2	Very high	7 Å²	7	39.4 Å²	39.4	3%	0.031	20%	0.196	C	C	.	.			trans	-95.1	177.8	168.5	69.9	-77.6	0	0	0	108.7	C323 I334 M371 R375 V376 L380 A389 I390 G391	C323-F378 HydrophobicContact CB-CE2 3.96Å; C323-F378 HydrophobicContact CB-CZ 3.86Å; C323-F378 PolarHBondContact SG-O 2.92Å; I334-F378 HydrophobicContact CB-CZ 4.37Å; I334-F378 HydrophobicContact CG2-CE2 4.24Å; I334-F378 HydrophobicContact CG2-CZ 3.97Å; I334-F378 WeakPolarHBondContact O-CZ 3.41Å; M371-F378 HydrophobicContact CE-CZ 4.13Å; M371-F378 HydrophobicContact SD-CE2 4.35Å; M371-F378 HydrophobicContact SD-CZ 4.41Å; R375-F378 HydrophobicContact CB-CB 4.25Å; R375-F378 HydrophobicContact CB-CD1 3.55Å; R375-F378 HydrophobicContact CB-CE1 4.03Å; R375-F378 HydrophobicContact CB-CG 3.94Å; R375-F378 WeakPolarHBondContact O-CE1 3.42Å; V376-F378 PolarHBondContact O-N 2.84Å; F378-L380 HydrophobicContact CD2-CD2 4.38Å; F378-L380 HydrophobicContact CE2-CD2 3.71Å; F378-L380 HydrophobicContact CE2-CG 4.03Å; F378-A389 HydrophobicContact CD2-CB 4.04Å; F378-A389 HydrophobicContact CE2-CB 4.01Å; F378-I390 WeakPolarHBondContact CB-O 3.34Å; F378-G391 WeakPolarHBondContact CB-O 3.33Å
379	T	96.1	Very high	94.2	Very high	20 Å²	20	38.5 Å²	38.5	12%	0.123	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	157.2	174.3	59.6	0	0	0	0	111.6	I390 H431 S433	T379-I390 PolarHBondContact N-O 2.87Å; T379-I390 PolarHBondContact O-N 3.47Å; T379-H431 WeakPolarHBondContact CG2-O 3.02Å; T379-H431 PolarHBondContact OG1-NE2 2.95Å; T379-S433 WeakPolarHBondContact CB-OG 3.46Å; T379-S433 VanDerWaalsContact OG1-CB 3.28Å; T379-S433 WeakPolarHBondContact OG1-CB 3.19Å; T379-S433 PolarHBondContact OG1-OG 2.9Å
380	L	96.9	Very high	94.3	Very high	28 Å²	28	33.1 Å²	33.1	15%	0.147	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143	174	-68.6	177.6	0	0	0	110.8	C323 C325 I334 F378 I387 Y388 A389	C323-L380 HydrophobicContact CB-CB 4.34Å; C323-L380 HydrophobicContact CB-CD1 3.35Å; C323-L380 HydrophobicContact CB-CG 3.44Å; C323-L380 VanDerWaalsContact CB-CG 3.44Å; C325-L380 HydrophobicContact CB-CD1 4.3Å; I334-L380 HydrophobicContact CB-CD1 4.19Å; I334-L380 HydrophobicContact CD1-CD1 3.88Å; I334-L380 HydrophobicContact CD1-CD2 4.11Å; I334-L380 HydrophobicContact CG1-CD1 4.2Å; F378-L380 HydrophobicContact CD2-CD2 4.38Å; F378-L380 HydrophobicContact CE2-CD2 3.71Å; F378-L380 HydrophobicContact CE2-CG 4.03Å; L380-I387 HydrophobicContact CD2-CG2 3.84Å; L380-Y388 CarbonylContact C-O 3.58Å; L380-Y388 VanDerWaalsContact CA-O 3.27Å; L380-Y388 WeakPolarHBondContact CA-O 3.35Å; L380-A389 HydrophobicContact CD2-CB 3.87Å
381	C	96.1	Very high	94.2	Very high	6 Å²	6	31.4 Å²	31.4	4%	0.041	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.7	167.5	-77.2	0	0	0	0	109.3	Y388 I390 S433 V435 I440	C381-Y388 PolarHBondContact N-O 3.01Å; C381-Y388 PolarHBondContact O-N 3.04Å; C381-I390 HydrophobicContact CB-CD1 4.15Å; C381-S433 PolarHBondContact SG-OG 3Å; C381-V435 HydrophobicContact CB-CG2 3.65Å; C381-I440 HydrophobicContact CB-CD1 4.26Å; C381-I440 HydrophobicContact CB-CG1 4.25Å
382	V	95.3	Very high	94.1	Very high	48 Å²	48	31 Å²	31	29%	0.291	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	116.7	172.8	-178.2	0	0	0	0	107.5	C325 V327 V386 I387	C325-V382 HydrophobicContact CB-CG2 3.92Å; V327-V382 HydrophobicContact CG2-CG1 3.85Å; V327-V382 HydrophobicContact CG2-CG2 3.91Å; V382-V386 WeakPolarHBondContact CA-O 3.41Å; V382-I387 HydrophobicContact CG2-CG1 4.32Å
383	V	93.8	Very high	93.8	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.024	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	122.1	175.8	-169.3	0	0	0	0	108.2	D385 V386 Y388 V435 K438 I440 L473	V383-D385 VanDerWaalsContact C-N 3.28Å; V383-D385 PolarHBondContact O-N 2.73Å; V383-V386 PolarHBondContact N-O 3.29Å; V383-V386 WeakPolarHBondContact O-CB 3.48Å; V383-V386 PolarHBondContact O-N 2.81Å; V383-Y388 HydrophobicContact CB-CD2 4.39Å; V383-Y388 HydrophobicContact CB-CE2 3.99Å; V383-Y388 HydrophobicContact CG2-CD2 4.26Å; V383-Y388 HydrophobicContact CG2-CE2 4.26Å; V383-V435 HydrophobicContact CG2-CB 4.47Å; V383-V435 HydrophobicContact CG2-CG1 3.93Å; V383-V435 HydrophobicContact CG2-CG2 3.64Å; V383-K438 HydrophobicContact CG1-CB 4.12Å; V383-I440 HydrophobicContact CG2-CD1 4.04Å; V383-I440 HydrophobicContact CG2-CG1 3.77Å; V383-L473 HydrophobicContact CB-CD1 3.94Å; V383-L473 HydrophobicContact CG1-CD1 3.48Å; V383-L473 VanDerWaalsContact CG1-CD1 3.48Å; V383-L473 HydrophobicContact CG2-CD1 4.46Å
384	E	89.3	Confident	93.5	Very high	126 Å²	126	28.7 Å²	28.7	59%	0.589	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	49.2	-179.6	-60.3	-173.8	146.8	0	0	112.5	V386 K438	E384-V386 PolarHBondContact O-N 3.28Å; E384-V386 VanDerWaalsContact O-N 3.12Å; E384-K438 HydrophobicContact CG-CD 4.46Å; E384-K438 WeakPolarHBondContact OE1-CD 3.36Å; E384-K438 VanDerWaalsContact OE1-CE 3.25Å; E384-K438 WeakPolarHBondContact OE1-CE 3.13Å; E384-K438 IonicContact OE1-NZ 2.78Å; E384-K438 PolarHBondContact OE1-NZ 3.24Å
385	D	88.9	Confident	92.9	Very high	80 Å²	80	25.3 Å²	25.3	43%	0.428	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	12.2	-178.7	-55.5	-48.9	0	0	0	116.2	T267 V327 V383	T267-D385 HydrophobicContact CG2-CB 3.75Å; V327-D385 HydrophobicContact CG1-CB 3.98Å; V383-D385 VanDerWaalsContact C-N 3.28Å; V383-D385 PolarHBondContact O-N 2.73Å
386	V	93.6	Very high	91.7	Very high	35 Å²	35	28.7 Å²	28.7	21%	0.212	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.4	172.9	-179.5	0	0	0	0	109.8	V382 V383 E384 Y388 Y410	V382-V386 WeakPolarHBondContact CA-O 3.41Å; V383-V386 PolarHBondContact N-O 3.29Å; V383-V386 WeakPolarHBondContact O-CB 3.48Å; V383-V386 PolarHBondContact O-N 2.81Å; E384-V386 PolarHBondContact O-N 3.28Å; E384-V386 VanDerWaalsContact O-N 3.12Å; V386-Y388 HydrophobicContact CB-CD2 4.5Å; V386-Y388 HydrophobicContact CB-CE2 3.79Å; V386-Y388 HydrophobicContact CG1-CD2 4.17Å; V386-Y388 HydrophobicContact CG1-CE2 3.59Å; V386-Y388 WeakPolarHBondContact O-CD2 3.37Å; V386-Y410 HydrophobicContact CG1-CD2 3.7Å; V386-Y410 HydrophobicContact CG1-CG 4.15Å
387	I	96.8	Very high	90.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	124.1	177.6	-57	171.1	0	0	0	108.8	V327 F332 I334 L380 V382 Y410 Y411 M413 W418	V327-I387 HydrophobicContact CG2-CD1 3.94Å; V327-I387 HydrophobicContact CG2-CG1 3.73Å; F332-I387 HydrophobicContact CB-CD1 4.25Å; F332-I387 HydrophobicContact CD1-CD1 3.97Å; F332-I387 HydrophobicContact CD2-CD1 3.94Å; F332-I387 HydrophobicContact CE1-CD1 4.26Å; F332-I387 HydrophobicContact CE2-CD1 4.24Å; F332-I387 HydrophobicContact CG-CD1 3.79Å; F332-I387 HydrophobicContact CZ-CD1 4.39Å; I334-I387 HydrophobicContact CD1-CD1 4.42Å; I334-I387 HydrophobicContact CD1-CG2 3.91Å; L380-I387 HydrophobicContact CD2-CG2 3.84Å; V382-I387 HydrophobicContact CG2-CG1 4.32Å; I387-Y410 CarbonylContact O-C 3.6Å; I387-Y410 WeakPolarHBondContact O-CA 3.38Å; I387-Y411 PolarHBondContact O-N 3.46Å; I387-M413 HydrophobicContact CD1-CE 3.41Å; I387-M413 VanDerWaalsContact CD1-CE 3.41Å; I387-M413 HydrophobicContact CG1-CE 3.77Å; I387-W418 HydrophobicContact CG2-CH2 4.26Å
388	Y	97.1	Very high	88.7	Confident	24 Å²	24	39.3 Å²	39.3	9%	0.094	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.3	173.5	-67	-97.7	0	0	0	110.1	L380 C381 V383 V386 V408 E409 Y410 A421 I440 W471 L473	L380-Y388 CarbonylContact C-O 3.58Å; L380-Y388 VanDerWaalsContact CA-O 3.27Å; L380-Y388 WeakPolarHBondContact CA-O 3.35Å; C381-Y388 PolarHBondContact N-O 3.01Å; C381-Y388 PolarHBondContact O-N 3.04Å; V383-Y388 HydrophobicContact CB-CD2 4.39Å; V383-Y388 HydrophobicContact CB-CE2 3.99Å; V383-Y388 HydrophobicContact CG2-CD2 4.26Å; V383-Y388 HydrophobicContact CG2-CE2 4.26Å; V386-Y388 HydrophobicContact CB-CD2 4.5Å; V386-Y388 HydrophobicContact CB-CE2 3.79Å; V386-Y388 HydrophobicContact CG1-CD2 4.17Å; V386-Y388 HydrophobicContact CG1-CE2 3.59Å; V386-Y388 WeakPolarHBondContact O-CD2 3.37Å; Y388-V408 HydrophobicContact CD1-CG1 4.23Å; Y388-E409 CarbonylContact C-O 3.54Å; Y388-E409 WeakPolarHBondContact CA-O 3.25Å; Y388-Y410 HydrophobicContact CE1-CD1 4.34Å; Y388-Y410 HydrophobicContact CE1-CG 4.11Å; Y388-A421 HydrophobicContact CE1-CB 4.48Å; Y388-I440 HydrophobicContact CD1-CD1 4.14Å; Y388-I440 HydrophobicContact CD2-CD1 4.08Å; Y388-I440 HydrophobicContact CG-CD1 3.83Å; Y388-W471 HydrophobicContact CD1-CH2 4.48Å; Y388-W471 AromaticContact CD1-CZ3 3.95Å; Y388-W471 HydrophobicContact CD1-CZ3 3.95Å; Y388-W471 AromaticContact CE1-CH2 3.94Å; Y388-W471 HydrophobicContact CE1-CH2 3.94Å; Y388-W471 AromaticContact CE1-CZ3 3.82Å; Y388-W471 HydrophobicContact CE1-CZ3 3.82Å; Y388-L473 HydrophobicContact CE1-CD2 3.84Å; Y388-L473 HydrophobicContact CE2-CD2 4.21Å
389	A	97.3	Very high	87	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.8	170.4	0	0	0	0	0	110	M371 F378 L380 V408 E409 W418	M371-A389 HydrophobicContact SD-CB 3.92Å; F378-A389 HydrophobicContact CD2-CB 4.04Å; F378-A389 HydrophobicContact CE2-CB 4.01Å; L380-A389 HydrophobicContact CD2-CB 3.87Å; A389-V408 WeakPolarHBondContact O-CA 3.43Å; A389-E409 HydrophobicContact CB-CG 3.94Å; A389-E409 PolarHBondContact N-O 2.84Å; A389-E409 PolarHBondContact O-N 3Å; A389-W418 HydrophobicContact CB-CH2 4.33Å; A389-W418 HydrophobicContact CB-CZ3 3.99Å
390	I	96.9	Very high	85.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	119.4	-165.8	-57.8	159.1	0	0	0	110	F378 T379 C381 V408 M424 H431 I440 V442	F378-I390 WeakPolarHBondContact CB-O 3.34Å; T379-I390 PolarHBondContact N-O 2.87Å; T379-I390 PolarHBondContact O-N 3.47Å; C381-I390 HydrophobicContact CB-CD1 4.15Å; I390-V408 HydrophobicContact CG1-CG1 3.95Å; I390-V408 HydrophobicContact CG1-CG2 4.42Å; I390-V408 HydrophobicContact CG2-CG2 4.11Å; I390-M424 HydrophobicContact CG2-CE 4.33Å; I390-M424 HydrophobicContact CG2-CG 4.35Å; I390-M424 HydrophobicContact CG2-SD 3.61Å; I390-H431 PolarHBondContact O-CE1 2.86Å; I390-H431 VanDerWaalsContact O-CE1 3.24Å; I390-H431 PolarHBondContact O-NE2 2.91Å; I390-I440 HydrophobicContact CD1-CD1 4.44Å; I390-I440 HydrophobicContact CD1-CG2 3.5Å; I390-I440 VanDerWaalsContact CD1-CG2 3.5Å; I390-V442 HydrophobicContact CG2-CG2 3.91Å
391	G	94.8	Very high	84.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.25	C	C	.	.			trans	58.6	-135.5	172.5	0	0	0	0	0	114.8	R375 F378 L405 Y407	R375-G391 WeakPolarHBondContact CD-O 3.45Å; R375-G391 PolarHBondContact NH1-O 2.88Å; F378-G391 WeakPolarHBondContact CB-O 3.33Å; G391-L405 VanDerWaalsContact CA-O 3.26Å; G391-L405 WeakPolarHBondContact CA-O 3.39Å; G391-Y407 PolarHBondContact N-O 2.92Å; G391-Y407 VanDerWaalsContact N-O 3.14Å
392	G	93.4	Very high	83.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.252	C	S	.	.			trans	97	-166.2	-177.4	0	0	0	0	0	112.7	V376 S404 L405 L428	V376-G392 WeakPolarHBondContact O-CA 3.28Å; G392-S404 CarbonylContact O-C 3.52Å; G392-S404 WeakPolarHBondContact O-CA 3.4Å; G392-L405 PolarHBondContact O-N 2.94Å; G392-L428 PolarHBondContact N-O 2.83Å
393	R	89.8	Confident	82.7	Confident	46 Å²	46	49.5 Å²	49.5	17%	0.174	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	157.2	174.8	69.5	-179.3	-169.8	-168.9	-0.8	112	V376 Q377 Y402 I403 H429	V376-R393 HydrophobicContact CG1-CG 3.59Å; V376-R393 PolarHBondContact N-O 3.42Å; V376-R393 PolarHBondContact O-N 3.47Å; Q377-R393 VanDerWaalsContact OE1-NH1 3.17Å; R393-Y402 HydrophobicContact CB-CD2 4.24Å; R393-I403 CarbonylContact C-O 3.57Å; R393-I403 WeakPolarHBondContact CA-O 3.49Å; R393-I403 WeakPolarHBondContact CB-O 3.26Å; R393-H429 HydrophobicContact CB-CB 3.92Å; R393-H429 HydrophobicContact CG-CB 4.29Å
394	Q	85.9	Confident	82.5	Confident	29 Å²	29	49.8 Å²	49.8	14%	0.136	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	128	172	175.3	173.4	-7.7	0	0	109.3	R374 Y402 I403	R374-Q394 HydrophobicContact CG-CG 3.89Å; R374-Q394 VanDerWaalsContact NH1-NE2 3.16Å; Q394-Y402 CarbonylContact O-C 3.26Å; Q394-Y402 VanDerWaalsContact O-CA 3.25Å; Q394-Y402 WeakPolarHBondContact O-CA 3.47Å; Q394-I403 PolarHBondContact N-O 3.49Å; Q394-I403 PolarHBondContact O-N 2.83Å
395	S	78.1	Confident	82.6	Confident	36 Å²	36	44.3 Å²	44.3	25%	0.252	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	135.6	171.2	-57	0	0	0	0	109.7	T351	T351-S395 WeakPolarHBondContact OG1-CB 3.49Å; T351-S395 PolarHBondContact OG1-N 3.41Å; T351-S395 PolarHBondContact OG1-OG 2.93Å
396	H	68.6	Low	82.8	Confident	73 Å²	73	41.3 Å²	41.3	34%	0.338	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-76.2	131.9	173.7	-82.4	-76.8	0	0	0	110.7	N398 S399 T401 I403	H396-N398 PolarHBondContact O-N 2.98Å; H396-S399 PolarHBondContact O-N 2.92Å; H396-T401 PolarHBondContact N-O 3.08Å; H396-I403 WeakPolarHBondContact NE2-CD1 3.43Å; H396-I403 WeakPolarHBondContact NE2-CG1 3.17Å
397	P	59.8	Low	82.8	Confident	88 Å²	88	44.4 Å²	44.4	57%	0.571	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	126.3	167.1	-16.1	28.8	0	0	0	108.2
398	N	58.5	Low	82.7	Confident	175 Å²	175	44.5 Å²	44.5	94%	0.936	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.6	15.5	176.1	-45.5	-26.4	0	0	0	116.7	H396	H396-N398 PolarHBondContact O-N 2.98Å
399	S	60.3	Low	82.7	Confident	54 Å²	54	43.4 Å²	43.4	38%	0.378	23%	0.228	S	C	.	.	S	Bend	trans	-141.2	142.9	171.2	177.8	0	0	0	0	110.7	H396 T401	H396-S399 PolarHBondContact O-N 2.92Å; S399-T401 WeakPolarHBondContact CB-OG1 3.18Å; S399-T401 PolarHBondContact O-N 3.02Å; S399-T401 VanDerWaalsContact O-N 3.09Å; S399-T401 WeakPolarHBondContact OG-CB 3.25Å; S399-T401 VanDerWaalsContact OG-CG2 3.28Å; S399-T401 WeakPolarHBondContact OG-CG2 3.17Å; S399-T401 PolarHBondContact OG-N 2.77Å; S399-T401 PolarHBondContact OG-OG1 3.23Å
400	M	61.7	Low	82.6	Confident	143 Å²	143	46.5 Å²	46.5	70%	0.704	24%	0.24	S	C	*	.	S	Bend	trans	-72.7	6.3	173.2	-156.5	65.6	76.8	0	0	112.7	V455	M400-V455 HydrophobicContact CB-CG2 4.43Å; M400-V455 HydrophobicContact CG-CB 3.67Å; M400-V455 HydrophobicContact CG-CG2 3.45Å; M400-V455 VanDerWaalsContact CG-CG2 3.45Å
401	T	69.9	Low	82.6	Confident	12 Å²	12	46.6 Å²	46.6	7%	0.074	24%	0.241	C	C	.	.			trans	-86.5	141.6	177.7	58.5	0	0	0	0	111.5	H396 S399 R452 I453	H396-T401 PolarHBondContact N-O 3.08Å; S399-T401 WeakPolarHBondContact CB-OG1 3.18Å; S399-T401 PolarHBondContact O-N 3.02Å; S399-T401 VanDerWaalsContact O-N 3.09Å; S399-T401 WeakPolarHBondContact OG-CB 3.25Å; S399-T401 VanDerWaalsContact OG-CG2 3.28Å; S399-T401 WeakPolarHBondContact OG-CG2 3.17Å; S399-T401 PolarHBondContact OG-N 2.77Å; S399-T401 PolarHBondContact OG-OG1 3.23Å; T401-R452 HydrophobicContact CG2-CB 4.1Å; T401-I453 WeakPolarHBondContact CG2-O 3.44Å
402	Y	78.4	Confident	82.5	Confident	26 Å²	26	48.5 Å²	48.5	10%	0.102	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	158	172.4	59.8	-89.8	0	0	0	111.2	R393 Q394 H429 I453	R393-Y402 HydrophobicContact CB-CD2 4.24Å; Q394-Y402 CarbonylContact O-C 3.26Å; Q394-Y402 VanDerWaalsContact O-CA 3.25Å; Q394-Y402 WeakPolarHBondContact O-CA 3.47Å; Y402-H429 AromaticContact CE2-CE1 3.49Å; Y402-H429 VanDerWaalsContact CE2-CE1 3.49Å; Y402-H429 WeakPolarHBondContact CE2-CE1 3.35Å; Y402-H429 AromaticContact CE2-NE2 3.97Å; Y402-I453 HydrophobicContact CE1-CG2 4.47Å; Y402-I453 HydrophobicContact CE2-CD1 4.29Å
403	I	84.8	Confident	82.5	Confident	89 Å²	89	48.8 Å²	48.8	46%	0.456	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.2	172.5	-64.1	178.4	0	0	0	108.3	R393 Q394 H396	R393-I403 CarbonylContact C-O 3.57Å; R393-I403 WeakPolarHBondContact CA-O 3.49Å; R393-I403 WeakPolarHBondContact CB-O 3.26Å; Q394-I403 PolarHBondContact N-O 3.49Å; Q394-I403 PolarHBondContact O-N 2.83Å; H396-I403 WeakPolarHBondContact NE2-CD1 3.43Å; H396-I403 WeakPolarHBondContact NE2-CG1 3.17Å
404	S	88.9	Confident	82.5	Confident	9 Å²	9	50.2 Å²	50.2	6%	0.063	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	145.7	169.8	-46.9	0	0	0	0	110	G392 P427 H429	G392-S404 CarbonylContact O-C 3.52Å; G392-S404 WeakPolarHBondContact O-CA 3.4Å; S404-P427 WeakPolarHBondContact O-CB 3Å; S404-H429 PolarHBondContact OG-ND1 2.81Å
405	L	90.7	Very high	82.8	Confident	11 Å²	11	51.8 Å²	51.8	6%	0.058	29%	0.288	C	S	.	.			trans	-111.3	138.2	-176.1	-59	171.2	0	0	0	110.3	E373 R375 G391 G392 Y407 L428	E373-L405 HydrophobicContact CB-CD1 4.25Å; R375-L405 HydrophobicContact CG-CD1 3.86Å; G391-L405 VanDerWaalsContact CA-O 3.26Å; G391-L405 WeakPolarHBondContact CA-O 3.39Å; G392-L405 PolarHBondContact O-N 2.94Å; L405-Y407 HydrophobicContact CD2-CD2 4.34Å; L405-L428 PolarHBondContact O-N 2.82Å
406	A	92.8	Very high	83.5	Confident	17 Å²	17	50.7 Å²	50.7	14%	0.14	28%	0.282	C	S	.	.			trans	-94	-14.6	169.7	0	0	0	0	0	112.4	A423 M424 P427	A406-A423 WeakPolarHBondContact O-CA 3.36Å; A406-M424 HydrophobicContact CB-CB 4.47Å; A406-M424 PolarHBondContact O-N 2.82Å; A406-P427 HydrophobicContact CB-CB 4.25Å; A406-P427 HydrophobicContact CB-CG 4.06Å
407	Y	93.9	Very high	84.8	Confident	101 Å²	101	48.7 Å²	48.7	40%	0.396	28%	0.278	S	S	.	.			trans	-66.9	140.9	-171.7	-58.8	-58.1	0	0	0	111.9	E373 R375 G391 L405 A423	E373-Y407 HydrophobicContact CG-CD2 4.5Å; R375-Y407 PolarHBondContact NH1-O 2.88Å; G391-Y407 PolarHBondContact N-O 2.92Å; G391-Y407 VanDerWaalsContact N-O 3.14Å; L405-Y407 HydrophobicContact CD2-CD2 4.34Å; Y407-A423 HydrophobicContact CD1-CB 4.3Å
408	V	95.7	Very high	86.6	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	135.1	168.1	-175.4	0	0	0	0	107.6	Y388 A389 I390 A421 A422 M424 W471 W478	Y388-V408 HydrophobicContact CD1-CG1 4.23Å; A389-V408 WeakPolarHBondContact O-CA 3.43Å; I390-V408 HydrophobicContact CG1-CG1 3.95Å; I390-V408 HydrophobicContact CG1-CG2 4.42Å; I390-V408 HydrophobicContact CG2-CG2 4.11Å; V408-A421 HydrophobicContact CB-CB 4.02Å; V408-A421 HydrophobicContact CG1-CB 3.89Å; V408-A421 PolarHBondContact O-N 3.2Å; V408-A422 WeakPolarHBondContact CG2-O 3.42Å; V408-M424 HydrophobicContact CG2-CG 4.15Å; V408-W471 HydrophobicContact CG1-CZ3 4.38Å; V408-W478 HydrophobicContact CG2-CZ2 4.02Å
409	E	96.3	Very high	88.4	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	150.5	174.5	58.2	-175.1	-99.2	0	0	110	M371 L372 E373 R375 Y388 A389 W418 R419	M371-E409 WeakPolarHBondContact CA-OE1 3.06Å; M371-E409 WeakPolarHBondContact CB-OE1 3.28Å; M371-E409 VanDerWaalsContact CG-OE1 3.24Å; M371-E409 WeakPolarHBondContact CG-OE1 3.47Å; L372-E409 PolarHBondContact N-OE1 2.64Å; E373-E409 PolarHBondContact N-OE2 3.02Å; R375-E409 IonicContact CZ-OE2 2.77Å; R375-E409 IonicContact NE-OE2 3.17Å; R375-E409 PolarHBondContact NE-OE2 2.92Å; R375-E409 VanDerWaalsContact NE-OE2 3.15Å; R375-E409 IonicContact NH2-OE2 3.02Å; R375-E409 PolarHBondContact NH2-OE2 3.29Å; Y388-E409 CarbonylContact C-O 3.54Å; Y388-E409 WeakPolarHBondContact CA-O 3.25Å; A389-E409 HydrophobicContact CB-CG 3.94Å; A389-E409 PolarHBondContact N-O 2.84Å; A389-E409 PolarHBondContact O-N 3Å; E409-W418 HydrophobicContact CB-CE3 4.15Å; E409-W418 HydrophobicContact CG-CE3 3.78Å; E409-W418 HydrophobicContact CG-CZ3 4.03Å; E409-R419 CarbonylContact C-O 3.51Å; E409-R419 WeakPolarHBondContact CA-O 3.48Å; E409-R419 WeakPolarHBondContact CB-O 3.25Å
410	Y	96.3	Very high	90	Very high	66 Å²	66	46.6 Å²	46.6	26%	0.259	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	147.3	179.2	71.8	-87.7	0	0	0	111.4	V386 I387 Y388 D412 W418 R419 A421	V386-Y410 HydrophobicContact CG1-CD2 3.7Å; V386-Y410 HydrophobicContact CG1-CG 4.15Å; I387-Y410 CarbonylContact O-C 3.6Å; I387-Y410 WeakPolarHBondContact O-CA 3.38Å; Y388-Y410 HydrophobicContact CE1-CD1 4.34Å; Y388-Y410 HydrophobicContact CE1-CG 4.11Å; Y410-D412 HydrophobicContact CE2-CB 4.14Å; Y410-W418 VanDerWaalsContact C-CE3 3.48Å; Y410-W418 CarbonylContact O-C 3.56Å; Y410-W418 WeakPolarHBondContact O-CA 3.39Å; Y410-R419 HydrophobicContact CD1-CB 4.12Å; Y410-R419 WeakPolarHBondContact CD1-O 3.4Å; Y410-R419 HydrophobicContact CE1-CB 3.57Å; Y410-R419 HydrophobicContact CE2-CB 4.05Å; Y410-R419 PolarHBondContact N-O 3.42Å; Y410-R419 PolarHBondContact O-N 3.46Å; Y410-R419 VanDerWaalsContact OH-CD 3.26Å; Y410-R419 WeakPolarHBondContact OH-CD 3.29Å; Y410-A421 HydrophobicContact CD1-CB 3.97Å
411	Y	97	Very high	91.6	Very high	2 Å²	2	41 Å²	41	1%	0.008	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	108.1	177.5	-171.2	-119.8	0	0	0	110.2	S263 M368 E369 I387 M413 G416 W418	S263-Y411 VanDerWaalsContact CB-OH 3.32Å; S263-Y411 WeakPolarHBondContact CB-OH 3.38Å; M368-Y411 WeakPolarHBondContact CE-OH 3.47Å; E369-Y411 HydrophobicContact CB-CE2 4.22Å; I387-Y411 PolarHBondContact O-N 3.46Å; Y411-M413 HydrophobicContact CD1-CE 3.64Å; Y411-M413 HydrophobicContact CD1-CG 4.21Å; Y411-M413 HydrophobicContact CD1-SD 3.38Å; Y411-M413 WeakPolarHBondContact CD1-SD 3.44Å; Y411-M413 HydrophobicContact CE1-CE 4.13Å; Y411-M413 HydrophobicContact CE1-CG 4.44Å; Y411-M413 HydrophobicContact CE1-SD 3.36Å; Y411-M413 WeakPolarHBondContact CE1-SD 3.37Å; Y411-M413 PolarHBondContact O-N 2.84Å; Y411-G416 VanDerWaalsContact CE2-C 3.42Å; Y411-G416 VanDerWaalsContact CE2-O 3.31Å; Y411-G416 WeakPolarHBondContact CE2-O 3.47Å; Y411-G416 WeakPolarHBondContact OH-CA 3.45Å; Y411-G416 PolarHBondContact OH-O 3.2Å; Y411-W418 AromaticContact CD2-CD1 3.65Å; Y411-W418 AromaticContact CD2-CD2 3.97Å; Y411-W418 HydrophobicContact CD2-CD2 3.97Å; Y411-W418 AromaticContact CD2-CE2 3.68Å; Y411-W418 AromaticContact CD2-CG 3.96Å; Y411-W418 HydrophobicContact CD2-CG 3.96Å; Y411-W418 HydrophobicContact CD2-CZ2 4.31Å; Y411-W418 AromaticContact CD2-NE1 3.46Å; Y411-W418 AromaticContact CE2-NE1 3.99Å; Y411-W418 HydrophobicContact CG-CD2 4.42Å; Y411-W418 HydrophobicContact CG-CZ2 4.25Å
412	D	91.9	Very high	92.6	Very high	40 Å²	40	41 Å²	41	21%	0.214	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	101.2	172.3	174	9.8	0	0	0	109	Y410 A414 S415 G416 A417 R419	Y410-D412 HydrophobicContact CE2-CB 4.14Å; D412-A414 PolarHBondContact O-N 3.44Å; D412-A414 WeakPolarHBondContact OD1-CB 3.17Å; D412-A414 PolarHBondContact OD1-N 3.24Å; D412-S415 PolarHBondContact O-N 2.76Å; D412-S415 PolarHBondContact OD1-N 3.2Å; D412-S415 VanDerWaalsContact OD2-CB 3.32Å; D412-S415 WeakPolarHBondContact OD2-CB 3.36Å; D412-S415 PolarHBondContact OD2-OG 2.95Å; D412-G416 VanDerWaalsContact O-CA 3.31Å; D412-G416 WeakPolarHBondContact O-CA 3.44Å; D412-G416 PolarHBondContact O-N 3.06Å; D412-A417 PolarHBondContact N-O 3.49Å; D412-A417 PolarHBondContact O-N 3.06Å; D412-R419 IonicContact OD2-NE 3.59Å
413	M	93.4	Very high	93.4	Very high	5 Å²	5	42 Å²	42	3%	0.025	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-31.8	-179.5	-63.9	-73.2	-179.2	0	0	112.5	S263 A264 P266 T267 V327 F332 I387 Y411	S263-M413 CarbonylContact C-O 3.52Å; S263-M413 VanDerWaalsContact C-O 3.26Å; S263-M413 WeakPolarHBondContact CB-O 3.28Å; S263-M413 PolarHBondContact OG-O 3.3Å; A264-M413 VanDerWaalsContact CA-O 3.31Å; A264-M413 WeakPolarHBondContact CA-O 3.27Å; A264-M413 PolarHBondContact N-O 2.56Å; P266-M413 HydrophobicContact CB-SD 4.37Å; P266-M413 HydrophobicContact CG-SD 3.96Å; T267-M413 HydrophobicContact CG2-CB 3.89Å; T267-M413 HydrophobicContact CG2-CG 4.04Å; V327-M413 HydrophobicContact CB-CE 4.29Å; V327-M413 HydrophobicContact CG1-CE 4.25Å; V327-M413 HydrophobicContact CG2-CE 4.33Å; F332-M413 HydrophobicContact CE1-CE 4.21Å; F332-M413 HydrophobicContact CE2-CE 4.07Å; F332-M413 HydrophobicContact CZ-CE 3.69Å; F332-M413 HydrophobicContact CZ-SD 4.1Å; I387-M413 HydrophobicContact CD1-CE 3.41Å; I387-M413 VanDerWaalsContact CD1-CE 3.41Å; I387-M413 HydrophobicContact CG1-CE 3.77Å; Y411-M413 HydrophobicContact CD1-CE 3.64Å; Y411-M413 HydrophobicContact CD1-CG 4.21Å; Y411-M413 HydrophobicContact CD1-SD 3.38Å; Y411-M413 WeakPolarHBondContact CD1-SD 3.44Å; Y411-M413 HydrophobicContact CE1-CE 4.13Å; Y411-M413 HydrophobicContact CE1-CG 4.44Å; Y411-M413 HydrophobicContact CE1-SD 3.36Å; Y411-M413 WeakPolarHBondContact CE1-SD 3.37Å; Y411-M413 PolarHBondContact O-N 2.84Å
414	A	90.3	Very high	93.8	Very high	77 Å²	77	38.1 Å²	38.1	64%	0.636	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-44.3	-176.1	0	0	0	0	0	111.8	D412	D412-A414 PolarHBondContact O-N 3.44Å; D412-A414 WeakPolarHBondContact OD1-CB 3.17Å; D412-A414 PolarHBondContact OD1-N 3.24Å
415	S	91.1	Very high	94	Very high	61 Å²	61	41.6 Å²	41.6	43%	0.427	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-15.4	173.7	66.1	0	0	0	0	113.9	D412 A417 R419	D412-S415 PolarHBondContact O-N 2.76Å; D412-S415 PolarHBondContact OD1-N 3.2Å; D412-S415 VanDerWaalsContact OD2-CB 3.32Å; D412-S415 WeakPolarHBondContact OD2-CB 3.36Å; D412-S415 PolarHBondContact OD2-OG 2.95Å; S415-A417 VanDerWaalsContact C-N 3.32Å; S415-R419 PolarHBondContact OG-NH2 3.14Å
416	G	93.4	Very high	93.9	Very high	13 Å²	13	43.6 Å²	43.6	13%	0.134	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	22.1	-178.1	0	0	0	0	0	114	S263 E369 Y411 D412	S263-G416 WeakPolarHBondContact OG-CA 3.33Å; E369-G416 VanDerWaalsContact CB-O 3.28Å; E369-G416 WeakPolarHBondContact CB-O 3.45Å; Y411-G416 VanDerWaalsContact CE2-C 3.42Å; Y411-G416 VanDerWaalsContact CE2-O 3.31Å; Y411-G416 WeakPolarHBondContact CE2-O 3.47Å; Y411-G416 WeakPolarHBondContact OH-CA 3.45Å; Y411-G416 PolarHBondContact OH-O 3.2Å; D412-G416 VanDerWaalsContact O-CA 3.31Å; D412-G416 WeakPolarHBondContact O-CA 3.44Å; D412-G416 PolarHBondContact O-N 3.06Å
417	A	95.5	Very high	93.9	Very high	31 Å²	31	45 Å²	45	26%	0.256	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.4	-171.9	0	0	0	0	0	113.2	D412 S415	D412-A417 PolarHBondContact N-O 3.49Å; D412-A417 PolarHBondContact O-N 3.06Å; S415-A417 VanDerWaalsContact C-N 3.32Å
418	W	97.6	Very high	93.8	Very high	13 Å²	13	40.2 Å²	40.2	5%	0.049	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	139.4	171.9	-71.1	90.1	0	0	0	111.7	I334 V355 E369 S370 M371 L372 I387 A389 E409 Y410 Y411	I334-W418 HydrophobicContact CD1-CH2 4.02Å; I334-W418 HydrophobicContact CD1-CZ2 4.06Å; I334-W418 HydrophobicContact CG2-CH2 4.45Å; I334-W418 HydrophobicContact CG2-CZ2 4.41Å; V355-W418 HydrophobicContact CG2-CZ2 3.69Å; E369-W418 PolarHBondContact O-NE1 3.04Å; S370-W418 VanDerWaalsContact C-CD1 3.49Å; M371-W418 HydrophobicContact CG-CD2 3.99Å; M371-W418 HydrophobicContact CG-CE3 4.23Å; M371-W418 HydrophobicContact CG-CH2 3.93Å; M371-W418 HydrophobicContact CG-CZ2 3.67Å; M371-W418 HydrophobicContact CG-CZ3 4.2Å; M371-W418 HydrophobicContact SD-CH2 4.34Å; L372-W418 HydrophobicContact CD2-CB 4.29Å; L372-W418 HydrophobicContact CG-CB 3.95Å; I387-W418 HydrophobicContact CG2-CH2 4.26Å; A389-W418 HydrophobicContact CB-CH2 4.33Å; A389-W418 HydrophobicContact CB-CZ3 3.99Å; E409-W418 HydrophobicContact CB-CE3 4.15Å; E409-W418 HydrophobicContact CG-CE3 3.78Å; E409-W418 HydrophobicContact CG-CZ3 4.03Å; Y410-W418 VanDerWaalsContact C-CE3 3.48Å; Y410-W418 CarbonylContact O-C 3.56Å; Y410-W418 WeakPolarHBondContact O-CA 3.39Å; Y411-W418 AromaticContact CD2-CD1 3.65Å; Y411-W418 AromaticContact CD2-CD2 3.97Å; Y411-W418 HydrophobicContact CD2-CD2 3.97Å; Y411-W418 AromaticContact CD2-CE2 3.68Å; Y411-W418 AromaticContact CD2-CG 3.96Å; Y411-W418 HydrophobicContact CD2-CG 3.96Å; Y411-W418 HydrophobicContact CD2-CZ2 4.31Å; Y411-W418 AromaticContact CD2-NE1 3.46Å; Y411-W418 AromaticContact CE2-NE1 3.99Å; Y411-W418 HydrophobicContact CG-CD2 4.42Å; Y411-W418 HydrophobicContact CG-CZ2 4.25Å
419	R	96.2	Very high	93.6	Very high	114 Å²	114	40.3 Å²	40.3	43%	0.43	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	153.9	-179	-64.8	178.9	-177.2	-80.8	-4.6	110.4	E409 Y410 D412 S415	E409-R419 CarbonylContact C-O 3.51Å; E409-R419 WeakPolarHBondContact CA-O 3.48Å; E409-R419 WeakPolarHBondContact CB-O 3.25Å; Y410-R419 HydrophobicContact CD1-CB 4.12Å; Y410-R419 WeakPolarHBondContact CD1-O 3.4Å; Y410-R419 HydrophobicContact CE1-CB 3.57Å; Y410-R419 HydrophobicContact CE2-CB 4.05Å; Y410-R419 PolarHBondContact N-O 3.42Å; Y410-R419 PolarHBondContact O-N 3.46Å; Y410-R419 VanDerWaalsContact OH-CD 3.26Å; Y410-R419 WeakPolarHBondContact OH-CD 3.29Å; D412-R419 IonicContact OD2-NE 3.59Å; S415-R419 PolarHBondContact OG-NH2 3.14Å
420	R	95.2	Very high	93.3	Very high	146 Å²	146	40.5 Å²	40.5	55%	0.551	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	139.4	175.7	-68.8	-172.9	171.6	-173.8	-4.3	111.1	L372 E373	L372-R420 HydrophobicContact CD1-CG 3.68Å; E373-R420 IonicContact OE1-CZ 3.69Å; E373-R420 IonicContact OE1-NH2 2.73Å; E373-R420 PolarHBondContact OE1-NH2 3.01Å
421	A	93.6	Very high	93.2	Very high	25 Å²	25	37.7 Å²	37.7	21%	0.207	22%	0.22	C	C	.	.			trans	-109.1	-174.8	171.8	0	0	0	0	0	110.6	Y388 V408 Y410 A423 W471	Y388-A421 HydrophobicContact CE1-CB 4.48Å; V408-A421 HydrophobicContact CB-CB 4.02Å; V408-A421 HydrophobicContact CG1-CB 3.89Å; V408-A421 PolarHBondContact O-N 3.2Å; Y410-A421 HydrophobicContact CD1-CB 3.97Å; A421-A423 PolarHBondContact O-N 2.85Å; A421-W471 HydrophobicContact CB-CH2 3.56Å; A421-W471 HydrophobicContact CB-CZ3 3.93Å
422	A	92.8	Very high	93.1	Very high	13 Å²	13	37.7 Å²	37.7	11%	0.107	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-59.8	117.3	173.1	0	0	0	0	0	110.7	V408 W471 T476 W478	V408-A422 WeakPolarHBondContact CG2-O 3.42Å; A422-W471 HydrophobicContact CB-CD2 4.36Å; A422-W471 HydrophobicContact CB-CH2 4.4Å; A422-W471 HydrophobicContact CB-CZ2 3.79Å; A422-T476 WeakPolarHBondContact CB-O 3.43Å; A422-W478 PolarHBondContact O-NE1 2.92Å
423	A	94	Very high	93.4	Very high	46 Å²	46	36.5 Å²	36.5	38%	0.38	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-67.1	147.7	176.5	0	0	0	0	0	111.1	A406 Y407 A421 W478	A406-A423 WeakPolarHBondContact O-CA 3.36Å; Y407-A423 HydrophobicContact CD1-CB 4.3Å; A421-A423 PolarHBondContact O-N 2.85Å; A423-W478 PolarHBondContact O-NE1 2.77Å
424	M	94.3	Very high	93.6	Very high	8 Å²	8	37.2 Å²	37.2	4%	0.039	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-61.7	153.9	173.1	-63.8	-176.2	-61.6	0	0	110.6	I390 A406 V408 Y426 L428 V442 I469 W478	I390-M424 HydrophobicContact CG2-CE 4.33Å; I390-M424 HydrophobicContact CG2-CG 4.35Å; I390-M424 HydrophobicContact CG2-SD 3.61Å; A406-M424 HydrophobicContact CB-CB 4.47Å; A406-M424 PolarHBondContact O-N 2.82Å; V408-M424 HydrophobicContact CG2-CG 4.15Å; M424-Y426 PolarHBondContact O-N 2.87Å; M424-Y426 VanDerWaalsContact O-N 3.17Å; M424-L428 HydrophobicContact CE-CB 4.03Å; M424-L428 HydrophobicContact SD-CD1 4.35Å; M424-V442 HydrophobicContact SD-CG1 4.24Å; M424-V442 HydrophobicContact SD-CG2 4.49Å; M424-I469 HydrophobicContact CB-CD1 4.34Å; M424-I469 HydrophobicContact CG-CD1 4.28Å; M424-I469 HydrophobicContact SD-CD1 4.44Å; M424-W478 HydrophobicContact CG-CH2 4.48Å; M424-W478 HydrophobicContact CG-CZ2 4.07Å
425	P	92.2	Very high	93.9	Very high	83 Å²	83	35.3 Å²	35.3	54%	0.539	20%	0.2	S	C	.	.	S	Bend	trans	-61	-26.8	179.4	-23.3	34.6	0	0	0	113.6	W478	P425-W478 HydrophobicContact CG-CB 3.73Å; P425-W478 HydrophobicContact CG-CG 4.34Å
426	Y	89.1	Confident	94.1	Very high	53 Å²	53	32.7 Å²	32.7	21%	0.208	18%	0.181	C	C	.	.	S	Bend	trans	-145.8	154.1	177	44.2	-86.7	0	0	0	111.2	M424 L428 E467	M424-Y426 PolarHBondContact O-N 2.87Å; M424-Y426 VanDerWaalsContact O-N 3.17Å; Y426-L428 HydrophobicContact CD2-CD1 4.11Å; Y426-L428 HydrophobicContact CD2-CD2 3.86Å; Y426-L428 HydrophobicContact CD2-CG 3.72Å; Y426-L428 HydrophobicContact CE2-CD1 3.62Å; Y426-L428 HydrophobicContact CE2-CD2 3.76Å; Y426-L428 HydrophobicContact CE2-CG 3.71Å; Y426-E467 WeakPolarHBondContact OH-CB 3.33Å; Y426-E467 PolarHBondContact OH-OE2 2.98Å
427	P	91.4	Very high	94.1	Very high	45 Å²	45	38.3 Å²	38.3	29%	0.292	21%	0.208	S	C	.	.			trans	-70.9	133.4	178.8	-16.6	30.6	0	0	0	112.7	S404 A406 P447 A448	S404-P427 WeakPolarHBondContact O-CB 3Å; A406-P427 HydrophobicContact CB-CB 4.25Å; A406-P427 HydrophobicContact CB-CG 4.06Å; P427-P447 WeakPolarHBondContact O-CA 3.32Å; P427-A448 HydrophobicContact CB-CB 4.19Å; P427-A448 HydrophobicContact CG-CB 4.4Å; P427-A448 PolarHBondContact O-N 3.23Å
428	L	91.9	Very high	93.9	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	143.3	-178.5	-73.2	174.3	0	0	0	112.1	G392 L405 M424 Y426 H431 V442 P447	G392-L428 PolarHBondContact N-O 2.83Å; L405-L428 PolarHBondContact O-N 2.82Å; M424-L428 HydrophobicContact CE-CB 4.03Å; M424-L428 HydrophobicContact SD-CD1 4.35Å; Y426-L428 HydrophobicContact CD2-CD1 4.11Å; Y426-L428 HydrophobicContact CD2-CD2 3.86Å; Y426-L428 HydrophobicContact CD2-CG 3.72Å; Y426-L428 HydrophobicContact CE2-CD1 3.62Å; Y426-L428 HydrophobicContact CE2-CD2 3.76Å; Y426-L428 HydrophobicContact CE2-CG 3.71Å; L428-H431 HydrophobicContact CB-CB 4.38Å; L428-H431 HydrophobicContact CD1-CB 4.45Å; L428-H431 PolarHBondContact O-CE1 2.78Å; L428-H431 PolarHBondContact O-ND1 2.77Å; L428-V442 HydrophobicContact CD1-CG1 4.11Å; L428-P447 HydrophobicContact CD2-CB 4.34Å
429	H	92.2	Very high	93.8	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.009	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	154.5	167.3	72.3	-84.8	0	0	0	111.5	Q377 R393 Y402 S404 H431 G445 L446 F489	Q377-H429 PolarHBondContact OE1-CD2 2.77Å; R393-H429 HydrophobicContact CB-CB 3.92Å; R393-H429 HydrophobicContact CG-CB 4.29Å; Y402-H429 AromaticContact CE2-CE1 3.49Å; Y402-H429 VanDerWaalsContact CE2-CE1 3.49Å; Y402-H429 WeakPolarHBondContact CE2-CE1 3.35Å; Y402-H429 AromaticContact CE2-NE2 3.97Å; S404-H429 PolarHBondContact OG-ND1 2.81Å; H429-H431 PolarHBondContact O-N 3.04Å; H429-G445 WeakPolarHBondContact O-CA 3.36Å; H429-L446 PolarHBondContact N-O 3.47Å; H429-L446 PolarHBondContact ND1-O 3.43Å; H429-L446 PolarHBondContact O-N 3.04Å; H429-F489 AromaticContact CD2-CE2 3.78Å; H429-F489 AromaticContact NE2-CE2 3.95Å; H429-F489 WeakPolarHBondContact O-CE2 3.12Å
430	G	90.3	Very high	93.9	Very high	6 Å²	6	37.3 Å²	37.3	6%	0.062	20%	0.203	C	C	.	.	S	Bend	trans	59.7	23.4	-173.4	0	0	0	0	0	113.3	Q377 G490	Q377-G430 PolarHBondContact O-N 3.46Å; G430-G490 PolarHBondContact O-N 3.24Å
431	H	94.5	Very high	94	Very high	6 Å²	6	31 Å²	31	3%	0.028	18%	0.18	C	C	.	.			trans	-77.8	171.7	168.1	59.3	-89.7	0	0	0	109.6	T379 I390 L428 H429 V442 T443 G444	T379-H431 WeakPolarHBondContact CG2-O 3.02Å; T379-H431 PolarHBondContact OG1-NE2 2.95Å; I390-H431 PolarHBondContact O-CE1 2.86Å; I390-H431 VanDerWaalsContact O-CE1 3.24Å; I390-H431 PolarHBondContact O-NE2 2.91Å; L428-H431 HydrophobicContact CB-CB 4.38Å; L428-H431 HydrophobicContact CD1-CB 4.45Å; L428-H431 PolarHBondContact O-CE1 2.78Å; L428-H431 PolarHBondContact O-ND1 2.77Å; H429-H431 PolarHBondContact O-N 3.04Å; H431-V442 HydrophobicContact CB-CG1 4.11Å; H431-T443 WeakPolarHBondContact CB-O 3.49Å; H431-G444 WeakPolarHBondContact CB-O 3.4Å
432	A	95.4	Very high	94.1	Very high	3 Å²	3	29.9 Å²	29.9	3%	0.025	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141.8	173.5	0	0	0	0	0	109.9	V442 T443 H491 L493	A432-V442 WeakPolarHBondContact O-CA 3.38Å; A432-T443 PolarHBondContact N-O 2.97Å; A432-T443 PolarHBondContact O-N 2.96Å; A432-T443 PolarHBondContact O-OG1 2.82Å; A432-H491 WeakPolarHBondContact CB-NE2 3.31Å; A432-H491 WeakPolarHBondContact CB-O 3.32Å; A432-L493 HydrophobicContact CB-CB 4.4Å; A432-L493 HydrophobicContact CB-CD1 4.46Å; A432-L493 HydrophobicContact CB-CD2 4.47Å; A432-L493 HydrophobicContact CB-CG 3.72Å
433	S	96.9	Very high	94.3	Very high	15 Å²	15	29.3 Å²	29.3	11%	0.105	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	153.9	175.5	72.3	0	0	0	0	112.3	T379 C381 Y441	T379-S433 WeakPolarHBondContact CB-OG 3.46Å; T379-S433 VanDerWaalsContact OG1-CB 3.28Å; T379-S433 WeakPolarHBondContact OG1-CB 3.19Å; T379-S433 PolarHBondContact OG1-OG 2.9Å; C381-S433 PolarHBondContact SG-OG 3Å; S433-Y441 CarbonylContact C-O 3.45Å; S433-Y441 WeakPolarHBondContact CA-O 3.13Å; S433-Y441 VanDerWaalsContact CB-O 3.25Å; S433-Y441 WeakPolarHBondContact CB-O 3.36Å
434	T	97.1	Very high	94.2	Very high	20 Å²	20	27.1 Å²	27.1	12%	0.123	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	171.8	172.3	-159.7	0	0	0	0	111.1	Y441 L493 T495 I500	T434-Y441 PolarHBondContact N-O 2.84Å; T434-Y441 PolarHBondContact O-N 3.17Å; T434-L493 HydrophobicContact CG2-CB 3.8Å; T434-L493 HydrophobicContact CG2-CD1 3.9Å; T434-T495 WeakPolarHBondContact CG2-OG1 3.31Å; T434-T495 PolarHBondContact OG1-OG1 3.18Å; T434-T495 VanDerWaalsContact OG1-OG1 3.04Å; T434-I500 HydrophobicContact CG2-CB 4.38Å; T434-I500 HydrophobicContact CG2-CD1 3.9Å; T434-I500 HydrophobicContact CG2-CG1 3.86Å; T434-I500 HydrophobicContact CG2-CG2 3.75Å
435	V	96.9	Very high	94	Very high	36 Å²	36	26.8 Å²	26.8	22%	0.218	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.2	178.8	-177.4	0	0	0	0	109.1	C381 V383 S439 I440 T495	C381-V435 HydrophobicContact CB-CG2 3.65Å; V383-V435 HydrophobicContact CG2-CB 4.47Å; V383-V435 HydrophobicContact CG2-CG1 3.93Å; V383-V435 HydrophobicContact CG2-CG2 3.64Å; V435-S439 WeakPolarHBondContact CA-O 3.38Å; V435-I440 HydrophobicContact CG2-CG1 4.46Å; V435-T495 WeakPolarHBondContact O-CB 3.48Å; V435-T495 WeakPolarHBondContact O-CG2 3.32Å; V435-T495 PolarHBondContact O-OG1 3.32Å
436	L	96	Very high	93.8	Very high	7 Å²	7	23.5 Å²	23.5	4%	0.037	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	130.3	169.6	174.5	60.3	0	0	0	108.1	K438 S439 Y441 T495 G498 I500 P518	L436-K438 PolarHBondContact O-N 3.11Å; L436-K438 VanDerWaalsContact O-N 3.15Å; L436-S439 PolarHBondContact N-O 3.06Å; L436-S439 WeakPolarHBondContact O-CB 3.32Å; L436-S439 PolarHBondContact O-N 3.45Å; L436-Y441 HydrophobicContact CB-CD2 4.27Å; L436-Y441 HydrophobicContact CB-CE2 3.97Å; L436-T495 HydrophobicContact CB-CG2 4.01Å; L436-T495 HydrophobicContact CD1-CG2 3.58Å; L436-T495 HydrophobicContact CG-CG2 4.3Å; L436-G498 WeakPolarHBondContact CD2-O 3.49Å; L436-I500 HydrophobicContact CB-CD1 4.15Å; L436-I500 HydrophobicContact CB-CG1 4.14Å; L436-I500 HydrophobicContact CD2-CD1 4.15Å; L436-I500 HydrophobicContact CD2-CG1 3.82Å; L436-P518 HydrophobicContact CD2-CB 4.31Å; L436-P518 HydrophobicContact CD2-CG 3.74Å
437	D	92.2	Very high	93.4	Very high	130 Å²	130	23.1 Å²	23.1	70%	0.695	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	39.3	179.7	-59.2	-28.4	0	0	0	114.6	S439	D437-S439 PolarHBondContact O-N 3.22Å
438	K	92.9	Very high	92.5	Very high	125 Å²	125	23 Å²	23	54%	0.543	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	5	-176.4	-49.6	178.6	177.9	-167.9	0	115.3	V383 E384 L436	V383-K438 HydrophobicContact CG1-CB 4.12Å; E384-K438 HydrophobicContact CG-CD 4.46Å; E384-K438 WeakPolarHBondContact OE1-CD 3.36Å; E384-K438 VanDerWaalsContact OE1-CE 3.25Å; E384-K438 WeakPolarHBondContact OE1-CE 3.13Å; E384-K438 IonicContact OE1-NZ 2.78Å; E384-K438 PolarHBondContact OE1-NZ 3.24Å; L436-K438 PolarHBondContact O-N 3.11Å; L436-K438 VanDerWaalsContact O-N 3.15Å
439	S	94.9	Very high	90.9	Very high	13 Å²	13	28.5 Å²	28.5	9%	0.091	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	141.1	174.4	-57.5	0	0	0	0	110.9	V435 L436 D437 W471 D472	V435-S439 WeakPolarHBondContact CA-O 3.38Å; L436-S439 PolarHBondContact N-O 3.06Å; L436-S439 WeakPolarHBondContact O-CB 3.32Å; L436-S439 PolarHBondContact O-N 3.45Å; D437-S439 PolarHBondContact O-N 3.22Å; S439-W471 WeakPolarHBondContact CA-O 3.45Å; S439-D472 WeakPolarHBondContact CB-OD1 3.14Å; S439-D472 VanDerWaalsContact OG-CG 3.32Å; S439-D472 PolarHBondContact OG-OD1 2.83Å
440	I	97.2	Very high	88.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.2	175.7	-64	174.8	0	0	0	108.2	C381 V383 Y388 I390 V435 V442 S470 W471 L473 W478	C381-I440 HydrophobicContact CB-CD1 4.26Å; C381-I440 HydrophobicContact CB-CG1 4.25Å; V383-I440 HydrophobicContact CG2-CD1 4.04Å; V383-I440 HydrophobicContact CG2-CG1 3.77Å; Y388-I440 HydrophobicContact CD1-CD1 4.14Å; Y388-I440 HydrophobicContact CD2-CD1 4.08Å; Y388-I440 HydrophobicContact CG-CD1 3.83Å; I390-I440 HydrophobicContact CD1-CD1 4.44Å; I390-I440 HydrophobicContact CD1-CG2 3.5Å; I390-I440 VanDerWaalsContact CD1-CG2 3.5Å; V435-I440 HydrophobicContact CG2-CG1 4.46Å; I440-V442 HydrophobicContact CG2-CG2 4.31Å; I440-S470 CarbonylContact O-C 3.57Å; I440-S470 WeakPolarHBondContact O-CA 3.49Å; I440-W471 HydrophobicContact CD1-CE3 4.13Å; I440-W471 HydrophobicContact CD1-CZ3 4.29Å; I440-W471 PolarHBondContact N-O 2.88Å; I440-W471 PolarHBondContact O-N 3.25Å; I440-L473 HydrophobicContact CD1-CD2 3.92Å; I440-L473 HydrophobicContact CG1-CD2 4.48Å; I440-W478 HydrophobicContact CB-CH2 4.47Å; I440-W478 HydrophobicContact CG2-CH2 3.95Å; I440-W478 HydrophobicContact CG2-CZ3 4.44Å
441	Y	97.5	Very high	86.5	Confident	14 Å²	14	40.7 Å²	40.7	6%	0.055	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	136.9	173	-70.2	-101.8	0	0	0	109.6	S433 T434 L436 I469 R481 I500 Y516	S433-Y441 CarbonylContact C-O 3.45Å; S433-Y441 WeakPolarHBondContact CA-O 3.13Å; S433-Y441 VanDerWaalsContact CB-O 3.25Å; S433-Y441 WeakPolarHBondContact CB-O 3.36Å; T434-Y441 PolarHBondContact N-O 2.84Å; T434-Y441 PolarHBondContact O-N 3.17Å; L436-Y441 HydrophobicContact CB-CD2 4.27Å; L436-Y441 HydrophobicContact CB-CE2 3.97Å; Y441-I469 CarbonylContact C-O 3.59Å; Y441-I469 WeakPolarHBondContact CA-O 3.18Å; Y441-R481 HydrophobicContact CE1-CG 4.23Å; Y441-I500 HydrophobicContact CD1-CD1 3.71Å; Y441-I500 HydrophobicContact CD2-CD1 3.48Å; Y441-I500 VanDerWaalsContact CD2-CD1 3.48Å; Y441-I500 HydrophobicContact CE1-CD1 4.18Å; Y441-I500 HydrophobicContact CE2-CD1 3.97Å; Y441-I500 HydrophobicContact CG-CD1 3.32Å; Y441-Y516 HydrophobicContact CD1-CE1 4.29Å; Y441-Y516 AromaticContact CE1-CE1 3.74Å; Y441-Y516 HydrophobicContact CE1-CE1 3.74Å
442	V	97.2	Very high	84.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	133.3	176	176.2	0	0	0	0	108.4	I390 M424 L428 H431 A432 I440 C468 I469 W478	I390-V442 HydrophobicContact CG2-CG2 3.91Å; M424-V442 HydrophobicContact SD-CG1 4.24Å; M424-V442 HydrophobicContact SD-CG2 4.49Å; L428-V442 HydrophobicContact CD1-CG1 4.11Å; H431-V442 HydrophobicContact CB-CG1 4.11Å; A432-V442 WeakPolarHBondContact O-CA 3.38Å; I440-V442 HydrophobicContact CG2-CG2 4.31Å; V442-C468 WeakPolarHBondContact O-CA 3.4Å; V442-I469 HydrophobicContact CB-CD1 4.28Å; V442-I469 HydrophobicContact CB-CG1 3.79Å; V442-I469 HydrophobicContact CG1-CG1 4.41Å; V442-I469 PolarHBondContact N-O 2.84Å; V442-I469 PolarHBondContact O-N 2.82Å; V442-W478 HydrophobicContact CB-CZ3 4.31Å; V442-W478 HydrophobicContact CG2-CH2 3.78Å; V442-W478 HydrophobicContact CG2-CZ3 3.72Å
443	T	95.4	Very high	82	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	144.8	-179	61	0	0	0	0	112.2	H431 A432 E467 C468 M484 H491 L493 W523	H431-T443 WeakPolarHBondContact CB-O 3.49Å; A432-T443 PolarHBondContact N-O 2.97Å; A432-T443 PolarHBondContact O-N 2.96Å; A432-T443 PolarHBondContact O-OG1 2.82Å; T443-E467 VanDerWaalsContact CA-O 3.29Å; T443-E467 WeakPolarHBondContact CA-O 3.45Å; T443-C468 HydrophobicContact CG2-CB 3.98Å; T443-M484 HydrophobicContact CG2-SD 4.36Å; T443-H491 PolarHBondContact O-CE1 2.85Å; T443-H491 PolarHBondContact O-NE2 3.1Å; T443-H491 PolarHBondContact OG1-NE2 3.29Å; T443-L493 HydrophobicContact CG2-CD1 3.92Å; T443-L493 HydrophobicContact CG2-CD2 4.43Å; T443-L493 WeakPolarHBondContact OG1-CD1 3.27Å; T443-L493 WeakPolarHBondContact OG1-CD2 3.49Å; T443-W523 HydrophobicContact CG2-CH2 4.09Å; T443-W523 HydrophobicContact CG2-CZ2 3.88Å
444	G	92.2	Very high	79.6	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.01	30%	0.3	C	S	.	.			trans	57.8	-144.7	172.1	0	0	0	0	0	115.2	H431 S465 E467	H431-G444 WeakPolarHBondContact CB-O 3.4Å; G444-S465 WeakPolarHBondContact CA-O 3.42Å; G444-E467 PolarHBondContact N-O 3.26Å
445	G	90.1	Very high	77.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.315	C	S	.	.			trans	85.2	-175.8	-173.4	0	0	0	0	0	113.4	H429 S465 R488	H429-G445 WeakPolarHBondContact O-CA 3.36Å; G445-S465 WeakPolarHBondContact O-CB 3.27Å; G445-S465 PolarHBondContact O-N 2.82Å; G445-R488 PolarHBondContact N-O 2.65Å
446	L	87.9	Confident	74.5	Confident	14 Å²	14	63 Å²	63	7%	0.073	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.3	179.2	-77.3	171.4	0	0	0	110.8	H429 R462 I464 F489	H429-L446 PolarHBondContact N-O 3.47Å; H429-L446 PolarHBondContact ND1-O 3.43Å; H429-L446 PolarHBondContact O-N 3.04Å; L446-R462 HydrophobicContact CD2-CB 3.82Å; L446-I464 HydrophobicContact CD2-CG1 3.94Å; L446-F489 HydrophobicContact CB-CD2 4.19Å; L446-F489 HydrophobicContact CB-CE2 4.23Å; L446-F489 HydrophobicContact CD1-CD2 3.71Å; L446-F489 HydrophobicContact CD1-CE2 3.56Å; L446-F489 HydrophobicContact CD1-CG 4.35Å; L446-F489 HydrophobicContact CD1-CZ 4.13Å; L446-F489 HydrophobicContact CG-CD2 3.57Å; L446-F489 HydrophobicContact CG-CE2 3.85Å; L446-F489 HydrophobicContact CG-CG 4.33Å
447	P	82	Confident	71.9	Confident	46 Å²	46	70.6 Å²	70.6	30%	0.299	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	153	170.8	29.6	-31.8	0	0	0	110.6	P427 L428 H449 E463	P427-P447 WeakPolarHBondContact O-CA 3.32Å; L428-P447 HydrophobicContact CD2-CB 4.34Å; P447-H449 PolarHBondContact O-N 3.1Å; P447-E463 VanDerWaalsContact CD-O 3.29Å; P447-E463 WeakPolarHBondContact CD-O 3.44Å
448	A	70.8	Confident	69.4	Low	43 Å²	43	72.3 Å²	72.3	36%	0.355	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-72.6	125.1	171.7	0	0	0	0	0	111	P427	P427-A448 HydrophobicContact CB-CB 4.19Å; P427-A448 HydrophobicContact CG-CB 4.4Å; P427-A448 PolarHBondContact O-N 3.23Å
449	H	58.3	Low	67	Low	116 Å²	116	70.5 Å²	70.5	54%	0.537	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-71.5	141.3	156.8	-81.8	-79.3	0	0	0	108.9	P447 G451	P447-H449 PolarHBondContact O-N 3.1Å; H449-G451 PolarHBondContact O-N 3.49Å
450	Q	46.2	Very low	64.4	Low	215 Å²	215	76.2 Å²	76.2	100%	1.005	40%	0.4	S	S	*	.	S	Bend	trans	-65.7	27	-176.9	-80.1	175	-10.1	0	0	115.6
451	G	45.8	Very low	62	Low	50 Å²	50	83.3 Å²	83.3	52%	0.515	44%	0.438	S	S	.	.	S	Bend	trans	-143.3	157	179.4	0	0	0	0	0	113.8	H449 I453	H449-G451 PolarHBondContact O-N 3.49Å; G451-I453 PolarHBondContact O-N 2.73Å; G451-I453 VanDerWaalsContact O-N 3.14Å
452	R	44.2	Very low	60.3	Low	227 Å²	227	87 Å²	87	86%	0.857	45%	0.452	S	S	*	.			trans	-61.3	109.7	174.4	-73.2	179.4	173	177.8	-1.5	109.8	T401 H454	T401-R452 HydrophobicContact CG2-CB 4.1Å; R452-H454 PolarHBondContact O-N 2.72Å
453	I	51	Low	59.2	Low	35 Å²	35	94.2 Å²	94.2	18%	0.179	49%	0.486	C	S	.	.			trans	-80.7	117.9	-179	-61.1	164.6	0	0	0	109.7	T401 Y402 G451	T401-I453 WeakPolarHBondContact CG2-O 3.44Å; Y402-I453 HydrophobicContact CE1-CG2 4.47Å; Y402-I453 HydrophobicContact CE2-CD1 4.29Å; G451-I453 PolarHBondContact O-N 2.73Å; G451-I453 VanDerWaalsContact O-N 3.14Å
454	H	45.7	Very low	58.6	Low	150 Å²	150	96.6 Å²	96.6	69%	0.694	50%	0.498	S	S	*	.			trans	-80.2	135.5	165.9	-107.3	54.9	0	0	0	109.3	R452 S456	R452-H454 PolarHBondContact O-N 2.72Å; H454-S456 PolarHBondContact O-N 2.95Å; H454-S456 VanDerWaalsContact O-N 3.1Å
455	V	45.5	Very low	58.4	Low	73 Å²	73	97.2 Å²	97.2	44%	0.442	50%	0.502	S	S	.	.			trans	-79.7	94.6	173.8	-179.3	0	0	0	0	108.2	M400	M400-V455 HydrophobicContact CB-CG2 4.43Å; M400-V455 HydrophobicContact CG-CB 3.67Å; M400-V455 HydrophobicContact CG-CG2 3.45Å; M400-V455 VanDerWaalsContact CG-CG2 3.45Å
456	S	41.7	Very low	58.4	Low	63 Å²	63	98.8 Å²	98.8	44%	0.441	51%	0.513	S	S	.	.			trans	-110.2	143.3	157.4	84.2	0	0	0	0	108.9	H454 Q458	H454-S456 PolarHBondContact O-N 2.95Å; H454-S456 VanDerWaalsContact O-N 3.1Å; S456-Q458 PolarHBondContact O-N 3.08Å
457	N	41.7	Very low	58.7	Low	166 Å²	166	100.7 Å²	100.7	89%	0.888	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	21.3	-177.4	-76.8	-18.3	0	0	0	113.6
458	Q	39.9	Very low	59.3	Low	166 Å²	166	98.5 Å²	98.5	78%	0.776	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.3	16.1	-174.9	-74.8	-171.1	-17.6	0	0	115.2	S456 V460	S456-Q458 PolarHBondContact O-N 3.08Å; Q458-V460 PolarHBondContact O-N 3.35Å
459	D	41.9	Very low	60.5	Low	87 Å²	87	96.8 Å²	96.8	47%	0.465	49%	0.492	S	S	.	.			trans	-89.7	80.7	174.2	-69.4	-29.3	0	0	0	111.9	N461	D459-N461 VanDerWaalsContact C-N 3.27Å; D459-N461 PolarHBondContact O-N 3.13Å
460	V	41	Very low	62.3	Low	134 Å²	134	91.3 Å²	91.3	81%	0.812	47%	0.467	S	S	*	.			trans	-77.6	-1.5	-176.9	-176.1	0	0	0	0	113.5	Q458	Q458-V460 PolarHBondContact O-N 3.35Å
461	N	46.1	Very low	64.7	Low	148 Å²	148	81.6 Å²	81.6	79%	0.791	42%	0.421	S	S	*	.			trans	-119.4	53.9	-179.9	-89	-0.2	0	0	0	113.3	D459 E463	D459-N461 VanDerWaalsContact C-N 3.27Å; D459-N461 PolarHBondContact O-N 3.13Å; N461-E463 PolarHBondContact O-N 2.86Å
462	R	61.3	Low	66.8	Low	93 Å²	93	82.5 Å²	82.5	35%	0.351	41%	0.414	S	S	.	.			trans	-81	106.9	164.6	-67.6	-173.8	-176.8	175.4	4.2	108.5	L446 I464	L446-R462 HydrophobicContact CD2-CB 3.82Å; R462-I464 VanDerWaalsContact C-N 3.34Å; R462-I464 PolarHBondContact O-N 2.82Å
463	E	73.8	Confident	68.7	Low	150 Å²	150	73.2 Å²	73.2	70%	0.701	38%	0.381	S	S	*	.			trans	-65.6	92.8	174.4	-71.7	-178.7	-179	0	0	109.7	P447 N461 S465	P447-E463 VanDerWaalsContact CD-O 3.29Å; P447-E463 WeakPolarHBondContact CD-O 3.44Å; N461-E463 PolarHBondContact O-N 2.86Å; E463-S465 PolarHBondContact O-N 2.78Å
464	I	84.4	Confident	70.2	Confident	51 Å²	51	80.5 Å²	80.5	26%	0.262	41%	0.412	S	S	.	.			trans	-63.6	133.8	169.8	-60.1	173.3	0	0	0	107.4	L446 R462 P487 R488 F489	L446-I464 HydrophobicContact CD2-CG1 3.94Å; R462-I464 VanDerWaalsContact C-N 3.34Å; R462-I464 PolarHBondContact O-N 2.82Å; I464-P487 HydrophobicContact CB-CB 3.95Å; I464-P487 HydrophobicContact CG2-CB 3.76Å; I464-P487 VanDerWaalsContact O-CB 3.28Å; I464-P487 WeakPolarHBondContact O-CB 3.29Å; I464-R488 VanDerWaalsContact CG2-N 3.33Å; I464-R488 WeakPolarHBondContact CG2-O 3.22Å; I464-F489 HydrophobicContact CD1-CB 4.29Å; I464-F489 HydrophobicContact CG1-CB 4.45Å; I464-F489 HydrophobicContact CG2-CB 4.1Å
465	S	87.8	Confident	71.7	Confident	15 Å²	15	77.2 Å²	77.2	11%	0.105	40%	0.404	C	S	.	.			trans	-79.4	145.1	178.7	-174.7	0	0	0	0	111.3	G444 G445 E463 E467 P487 R488	G444-S465 WeakPolarHBondContact CA-O 3.42Å; G445-S465 WeakPolarHBondContact O-CB 3.27Å; G445-S465 PolarHBondContact O-N 2.82Å; E463-S465 PolarHBondContact O-N 2.78Å; S465-E467 WeakPolarHBondContact OG-CB 3.27Å; S465-E467 WeakPolarHBondContact OG-CG 3.13Å; S465-E467 PolarHBondContact OG-N 2.87Å; S465-P487 WeakPolarHBondContact O-CA 3.41Å; S465-R488 PolarHBondContact O-N 2.87Å
466	S	89.9	Confident	73.2	Confident	32 Å²	32	79 Å²	79	22%	0.224	42%	0.415	C	S	.	.			trans	-107.2	3.1	163.8	61.8	0	0	0	0	112.4	S483 M484	S466-S483 CarbonylContact O-C 3.59Å; S466-S483 WeakPolarHBondContact O-CA 3.48Å; S466-S483 WeakPolarHBondContact O-CB 3.43Å; S466-M484 WeakPolarHBondContact CB-O 3.32Å; S466-M484 PolarHBondContact O-N 2.76Å
467	E	93.2	Very high	75.5	Confident	54 Å²	54	80.3 Å²	80.3	25%	0.252	42%	0.42	S	S	.	.			trans	-66.4	147.7	-173.7	-63.6	-167.4	123.8	0	0	111.8	Y426 T443 G444 S465 K480	Y426-E467 WeakPolarHBondContact OH-CB 3.33Å; Y426-E467 PolarHBondContact OH-OE2 2.98Å; T443-E467 VanDerWaalsContact CA-O 3.29Å; T443-E467 WeakPolarHBondContact CA-O 3.45Å; G444-E467 PolarHBondContact N-O 3.26Å; S465-E467 WeakPolarHBondContact OG-CB 3.27Å; S465-E467 WeakPolarHBondContact OG-CG 3.13Å; S465-E467 PolarHBondContact OG-N 2.87Å; E467-K480 IonicContact OE1-NZ 2.68Å; E467-K480 PolarHBondContact OE1-NZ 2.96Å
468	C	95.8	Very high	78	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.007	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	126	172.9	-176.6	0	0	0	0	108	V442 T443 R481 A482 W523	V442-C468 WeakPolarHBondContact O-CA 3.4Å; T443-C468 HydrophobicContact CG2-CB 3.98Å; C468-R481 HydrophobicContact CB-CB 4.02Å; C468-R481 PolarHBondContact O-N 2.77Å; C468-A482 VanDerWaalsContact CB-O 3.24Å; C468-A482 WeakPolarHBondContact CB-O 3.25Å; C468-W523 HydrophobicContact CB-CZ2 4.38Å
469	I	96.1	Very high	80.6	Confident	7 Å²	7	69.4 Å²	69.4	4%	0.036	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.9	174.8	60.8	175.8	0	0	0	109.6	M424 Y441 V442 W478 E479	M424-I469 HydrophobicContact CB-CD1 4.34Å; M424-I469 HydrophobicContact CG-CD1 4.28Å; M424-I469 HydrophobicContact SD-CD1 4.44Å; Y441-I469 CarbonylContact C-O 3.59Å; Y441-I469 WeakPolarHBondContact CA-O 3.18Å; V442-I469 HydrophobicContact CB-CD1 4.28Å; V442-I469 HydrophobicContact CB-CG1 3.79Å; V442-I469 HydrophobicContact CG1-CG1 4.41Å; V442-I469 PolarHBondContact N-O 2.84Å; V442-I469 PolarHBondContact O-N 2.82Å; I469-W478 HydrophobicContact CB-CE3 4.04Å; I469-W478 HydrophobicContact CD1-CD2 4.14Å; I469-W478 HydrophobicContact CD1-CE3 3.64Å; I469-W478 HydrophobicContact CD1-CZ3 4.12Å; I469-W478 HydrophobicContact CG1-CE3 3.65Å; I469-W478 HydrophobicContact CG1-CZ3 3.99Å; I469-E479 CarbonylContact C-O 3.48Å; I469-E479 VanDerWaalsContact CA-O 3.23Å; I469-E479 WeakPolarHBondContact CA-O 3.37Å
470	S	96.1	Very high	83.2	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	150.7	178.4	64.7	0	0	0	0	112.4	I440 W478 E479 R481	I440-S470 CarbonylContact O-C 3.57Å; I440-S470 WeakPolarHBondContact O-CA 3.49Å; S470-W478 CarbonylContact O-C 3.51Å; S470-W478 WeakPolarHBondContact O-CA 3.48Å; S470-E479 PolarHBondContact N-O 2.97Å; S470-E479 PolarHBondContact O-N 3.3Å; S470-R481 PolarHBondContact OG-NE 3.06Å; S470-R481 PolarHBondContact OG-NH2 3.29Å
471	W	95.6	Very high	85.9	Confident	11 Å²	11	68.2 Å²	68.2	4%	0.042	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	119.6	175.2	179	41.4	0	0	0	111.4	Y388 V408 A421 A422 S439 I440 L473 P475 W478	Y388-W471 HydrophobicContact CD1-CH2 4.48Å; Y388-W471 AromaticContact CD1-CZ3 3.95Å; Y388-W471 HydrophobicContact CD1-CZ3 3.95Å; Y388-W471 AromaticContact CE1-CH2 3.94Å; Y388-W471 HydrophobicContact CE1-CH2 3.94Å; Y388-W471 AromaticContact CE1-CZ3 3.82Å; Y388-W471 HydrophobicContact CE1-CZ3 3.82Å; V408-W471 HydrophobicContact CG1-CZ3 4.38Å; A421-W471 HydrophobicContact CB-CH2 3.56Å; A421-W471 HydrophobicContact CB-CZ3 3.93Å; A422-W471 HydrophobicContact CB-CD2 4.36Å; A422-W471 HydrophobicContact CB-CH2 4.4Å; A422-W471 HydrophobicContact CB-CZ2 3.79Å; S439-W471 WeakPolarHBondContact CA-O 3.45Å; I440-W471 HydrophobicContact CD1-CE3 4.13Å; I440-W471 HydrophobicContact CD1-CZ3 4.29Å; I440-W471 PolarHBondContact N-O 2.88Å; I440-W471 PolarHBondContact O-N 3.25Å; W471-L473 HydrophobicContact CD2-CD2 4.19Å; W471-L473 VanDerWaalsContact CE2-CA 3.49Å; W471-L473 HydrophobicContact CE3-CD2 3.79Å; W471-L473 HydrophobicContact CH2-CD2 3.67Å; W471-L473 HydrophobicContact CZ2-CD2 4.12Å; W471-L473 HydrophobicContact CZ3-CD2 3.52Å; W471-L473 PolarHBondContact O-N 3Å; W471-P475 PolarHBondContact NE1-O 3.01Å; W471-W478 HydrophobicContact CB-CD2 3.65Å; W471-W478 HydrophobicContact CB-CE3 3.62Å; W471-W478 HydrophobicContact CB-CG 4.32Å; W471-W478 HydrophobicContact CB-CH2 3.81Å; W471-W478 HydrophobicContact CB-CZ2 3.81Å; W471-W478 HydrophobicContact CB-CZ3 3.71Å; W471-W478 HydrophobicContact CD2-CZ2 4.18Å; W471-W478 HydrophobicContact CE3-CH2 4.38Å; W471-W478 AromaticContact CE3-CZ2 3.81Å; W471-W478 HydrophobicContact CE3-CZ2 3.81Å; W471-W478 HydrophobicContact CG-CD2 4.32Å; W471-W478 HydrophobicContact CG-CZ2 4.22Å
472	D	90.1	Very high	88.3	Confident	70 Å²	70	62.4 Å²	62.4	37%	0.374	31%	0.314	S	S	.	.			trans	-85.3	19.3	-175.8	-62.9	-10.7	0	0	0	113.1	S439 K474	S439-D472 WeakPolarHBondContact CB-OD1 3.14Å; S439-D472 VanDerWaalsContact OG-CG 3.32Å; S439-D472 PolarHBondContact OG-OD1 2.83Å; D472-K474 PolarHBondContact O-N 2.87Å
473	L	85.3	Confident	89.9	Confident	32 Å²	32	60.3 Å²	60.3	17%	0.168	31%	0.313	C	S	.	.	S	Bend	trans	61	-27.5	-172.9	-57.5	-178.5	0	0	0	115.7	V383 Y388 I440 W471	V383-L473 HydrophobicContact CB-CD1 3.94Å; V383-L473 HydrophobicContact CG1-CD1 3.48Å; V383-L473 VanDerWaalsContact CG1-CD1 3.48Å; V383-L473 HydrophobicContact CG2-CD1 4.46Å; Y388-L473 HydrophobicContact CE1-CD2 3.84Å; Y388-L473 HydrophobicContact CE2-CD2 4.21Å; I440-L473 HydrophobicContact CD1-CD2 3.92Å; I440-L473 HydrophobicContact CG1-CD2 4.48Å; W471-L473 HydrophobicContact CD2-CD2 4.19Å; W471-L473 VanDerWaalsContact CE2-CA 3.49Å; W471-L473 HydrophobicContact CE3-CD2 3.79Å; W471-L473 HydrophobicContact CH2-CD2 3.67Å; W471-L473 HydrophobicContact CZ2-CD2 4.12Å; W471-L473 HydrophobicContact CZ3-CD2 3.52Å; W471-L473 PolarHBondContact O-N 3Å
474	K	81.4	Confident	90.8	Very high	188 Å²	188	53.5 Å²	53.5	82%	0.817	28%	0.281	S	S	*	.	S	Bend	trans	-145.3	114	176.4	-60.8	177.5	-175.8	173.1	0	107.5	D472	D472-K474 PolarHBondContact O-N 2.87Å
475	P	76.5	Confident	91.1	Very high	81 Å²	81	54.1 Å²	54.1	53%	0.526	29%	0.29	S	S	.	.	S	Bend	cis	-77.7	178.7	8.8	33.1	-37	0	0	0	114.2	W471 V477	W471-P475 PolarHBondContact NE1-O 3.01Å; P475-V477 PolarHBondContact O-N 3.48Å
476	T	78.4	Confident	91	Very high	111 Å²	111	53.9 Å²	53.9	68%	0.681	29%	0.288	S	S	*	.	S	Bend	trans	-78.5	25	179.1	59.2	0	0	0	0	113.7	A422	A422-T476 WeakPolarHBondContact CB-O 3.43Å
477	V	89.4	Confident	90.9	Very high	90 Å²	90	55.5 Å²	55.5	55%	0.545	30%	0.298	S	S	.	.			trans	-114.2	132.9	-174	-176.5	0	0	0	0	109	P475	P475-V477 PolarHBondContact O-N 3.48Å
478	W	94.7	Very high	90.6	Very high	20 Å²	20	53.4 Å²	53.4	8%	0.076	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-83.5	130.7	170.8	-72.9	83.4	0	0	0	109.6	V408 A422 A423 M424 P425 I440 V442 I469 S470 W471	V408-W478 HydrophobicContact CG2-CZ2 4.02Å; A422-W478 PolarHBondContact O-NE1 2.92Å; A423-W478 PolarHBondContact O-NE1 2.77Å; M424-W478 HydrophobicContact CG-CH2 4.48Å; M424-W478 HydrophobicContact CG-CZ2 4.07Å; P425-W478 HydrophobicContact CG-CB 3.73Å; P425-W478 HydrophobicContact CG-CG 4.34Å; I440-W478 HydrophobicContact CB-CH2 4.47Å; I440-W478 HydrophobicContact CG2-CH2 3.95Å; I440-W478 HydrophobicContact CG2-CZ3 4.44Å; V442-W478 HydrophobicContact CB-CZ3 4.31Å; V442-W478 HydrophobicContact CG2-CH2 3.78Å; V442-W478 HydrophobicContact CG2-CZ3 3.72Å; I469-W478 HydrophobicContact CB-CE3 4.04Å; I469-W478 HydrophobicContact CD1-CD2 4.14Å; I469-W478 HydrophobicContact CD1-CE3 3.64Å; I469-W478 HydrophobicContact CD1-CZ3 4.12Å; I469-W478 HydrophobicContact CG1-CE3 3.65Å; I469-W478 HydrophobicContact CG1-CZ3 3.99Å; S470-W478 CarbonylContact O-C 3.51Å; S470-W478 WeakPolarHBondContact O-CA 3.48Å; W471-W478 HydrophobicContact CB-CD2 3.65Å; W471-W478 HydrophobicContact CB-CE3 3.62Å; W471-W478 HydrophobicContact CB-CG 4.32Å; W471-W478 HydrophobicContact CB-CH2 3.81Å; W471-W478 HydrophobicContact CB-CZ2 3.81Å; W471-W478 HydrophobicContact CB-CZ3 3.71Å; W471-W478 HydrophobicContact CD2-CZ2 4.18Å; W471-W478 HydrophobicContact CE3-CH2 4.38Å; W471-W478 AromaticContact CE3-CZ2 3.81Å; W471-W478 HydrophobicContact CE3-CZ2 3.81Å; W471-W478 HydrophobicContact CG-CD2 4.32Å; W471-W478 HydrophobicContact CG-CZ2 4.22Å
479	E	94.9	Very high	90.2	Very high	82 Å²	82	53.9 Å²	53.9	38%	0.383	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.3	178.8	-63	-170.9	167.9	0	0	110.9	I469 S470 R481	I469-E479 CarbonylContact C-O 3.48Å; I469-E479 VanDerWaalsContact CA-O 3.23Å; I469-E479 WeakPolarHBondContact CA-O 3.37Å; S470-E479 PolarHBondContact N-O 2.97Å; S470-E479 PolarHBondContact O-N 3.3Å; E479-R481 IonicContact OE2-CZ 2.72Å; E479-R481 VanDerWaalsContact OE2-CZ 3.24Å; E479-R481 IonicContact OE2-NH1 3.44Å; E479-R481 PolarHBondContact OE2-NH1 3.38Å; E479-R481 IonicContact OE2-NH2 3.35Å; E479-R481 PolarHBondContact OE2-NH2 3.32Å
480	K	95.7	Very high	89.8	Confident	138 Å²	138	54.8 Å²	54.8	60%	0.6	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	129.7	172.9	-174.9	164.3	178.5	155.6	0	109.9	E467	E467-K480 IonicContact OE1-NZ 2.68Å; E467-K480 PolarHBondContact OE1-NZ 2.96Å
481	R	96.8	Very high	89.6	Confident	59 Å²	59	55.1 Å²	55.1	22%	0.223	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	175.1	174	-61.7	-59.5	-175.8	-161	-8.8	110.1	Y441 C468 S470 E479 S483 Y516	Y441-R481 HydrophobicContact CE1-CG 4.23Å; C468-R481 HydrophobicContact CB-CB 4.02Å; C468-R481 PolarHBondContact O-N 2.77Å; S470-R481 PolarHBondContact OG-NE 3.06Å; S470-R481 PolarHBondContact OG-NH2 3.29Å; E479-R481 IonicContact OE2-CZ 2.72Å; E479-R481 VanDerWaalsContact OE2-CZ 3.24Å; E479-R481 IonicContact OE2-NH1 3.44Å; E479-R481 PolarHBondContact OE2-NH1 3.38Å; E479-R481 IonicContact OE2-NH2 3.35Å; E479-R481 PolarHBondContact OE2-NH2 3.32Å; R481-S483 PolarHBondContact O-N 3.14Å; R481-Y516 WeakPolarHBondContact CD-OH 3.36Å
482	A	96.6	Very high	89.5	Confident	26 Å²	26	56.9 Å²	56.9	22%	0.215	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-59	131.1	174.6	0	0	0	0	0	110.3	C468 Y516 N521 W523	C468-A482 VanDerWaalsContact CB-O 3.24Å; C468-A482 WeakPolarHBondContact CB-O 3.25Å; A482-Y516 HydrophobicContact CB-CE2 4.38Å; A482-N521 WeakPolarHBondContact CB-O 3.35Å; A482-N521 WeakPolarHBondContact CB-OD1 3.29Å; A482-N521 PolarHBondContact N-OD1 2.83Å; A482-W523 PolarHBondContact O-NE1 3.01Å
483	S	95.4	Very high	89.8	Confident	49 Å²	49	54.2 Å²	54.2	34%	0.343	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-68.5	148.5	176.5	-59.6	0	0	0	0	110.9	S466 R481	S466-S483 CarbonylContact O-C 3.59Å; S466-S483 WeakPolarHBondContact O-CA 3.48Å; S466-S483 WeakPolarHBondContact O-CB 3.43Å; R481-S483 PolarHBondContact O-N 3.14Å
484	M	93.3	Very high	90.3	Very high	6 Å²	6	52.8 Å²	52.8	3%	0.03	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-58.8	152	168.8	-65.2	179.5	-61.9	0	0	109.9	T443 S466 I486 R488 A502 W523	T443-M484 HydrophobicContact CG2-SD 4.36Å; S466-M484 WeakPolarHBondContact CB-O 3.32Å; S466-M484 PolarHBondContact O-N 2.76Å; M484-I486 WeakPolarHBondContact CB-O 3.28Å; M484-I486 PolarHBondContact O-N 2.7Å; M484-R488 HydrophobicContact CE-CB 4.23Å; M484-R488 HydrophobicContact CE-CG 4.33Å; M484-A502 HydrophobicContact SD-CB 3.9Å; M484-W523 HydrophobicContact CG-CD2 3.88Å; M484-W523 HydrophobicContact CG-CE3 4.19Å; M484-W523 HydrophobicContact CG-CH2 3.85Å; M484-W523 HydrophobicContact CG-CZ2 3.53Å; M484-W523 HydrophobicContact CG-CZ3 4.17Å; M484-W523 HydrophobicContact SD-CH2 4.17Å; M484-W523 HydrophobicContact SD-CZ2 4.33Å
485	S	89.8	Confident	91	Very high	64 Å²	64	45.4 Å²	45.4	45%	0.448	26%	0.258	S	S	.	.	S	Bend	trans	-73.1	-19.6	175	73.7	0	0	0	0	112.2	E514 R525	S485-E514 WeakPolarHBondContact CA-OE1 3.45Å; S485-E514 VanDerWaalsContact CB-OE1 3.23Å; S485-E514 WeakPolarHBondContact CB-OE1 3.3Å; S485-E514 PolarHBondContact N-OE1 2.92Å; S485-E514 PolarHBondContact OG-OE1 3.21Å; S485-R525 PolarHBondContact OG-NE 3.15Å; S485-R525 VanDerWaalsContact OG-NE 3.08Å; S485-R525 PolarHBondContact OG-NH2 3.22Å
486	I	85.4	Confident	91.9	Very high	10 Å²	10	41.8 Å²	41.8	5%	0.051	24%	0.235	C	C	.	.	S	Bend	trans	-124.3	124.8	-179.9	-58.8	165	0	0	0	108.8	M484 R488 F510 D512	M484-I486 WeakPolarHBondContact CB-O 3.28Å; M484-I486 PolarHBondContact O-N 2.7Å; I486-R488 HydrophobicContact CG2-CG 4.42Å; I486-F510 HydrophobicContact CD1-CB 4.21Å; I486-F510 HydrophobicContact CD1-CD1 4.31Å; I486-F510 HydrophobicContact CD1-CG 4.31Å; I486-F510 HydrophobicContact CG2-CB 4.29Å; I486-F510 HydrophobicContact CG2-CD2 4.06Å; I486-F510 HydrophobicContact CG2-CG 4.15Å; I486-D512 HydrophobicContact CD1-CB 3.77Å
487	P	87.8	Confident	92.6	Very high	67 Å²	67	40.6 Å²	40.6	44%	0.435	22%	0.221	S	C	.	.			trans	-65.4	136.3	169	-17.3	29.5	0	0	0	111.7	I464 S465	I464-P487 HydrophobicContact CB-CB 3.95Å; I464-P487 HydrophobicContact CG2-CB 3.76Å; I464-P487 VanDerWaalsContact O-CB 3.28Å; I464-P487 WeakPolarHBondContact O-CB 3.29Å; S465-P487 WeakPolarHBondContact O-CA 3.41Å
488	R	88.2	Confident	92.9	Very high	10 Å²	10	38 Å²	38	4%	0.038	21%	0.213	C	C	.	.			trans	-134.7	142.7	-173.7	-62	175.5	-171.1	-97.1	-1	112.2	G445 I464 S465 M484 I486 H491 D512 E514	G445-R488 PolarHBondContact N-O 2.65Å; I464-R488 VanDerWaalsContact CG2-N 3.33Å; I464-R488 WeakPolarHBondContact CG2-O 3.22Å; S465-R488 PolarHBondContact O-N 2.87Å; M484-R488 HydrophobicContact CE-CB 4.23Å; M484-R488 HydrophobicContact CE-CG 4.33Å; I486-R488 HydrophobicContact CG2-CG 4.42Å; R488-H491 HydrophobicContact CB-CB 3.88Å; R488-H491 VanDerWaalsContact CB-CG 3.47Å; R488-H491 VanDerWaalsContact CB-ND1 3.29Å; R488-H491 WeakPolarHBondContact CB-ND1 3.26Å; R488-D512 PolarHBondContact NH1-O 3.19Å; R488-D512 PolarHBondContact NH2-O 3.41Å; R488-E514 IonicContact CZ-OE2 3.39Å; R488-E514 IonicContact NE-OE2 3.62Å; R488-E514 PolarHBondContact NE-OE2 2.8Å; R488-E514 IonicContact NH2-OE2 2.65Å; R488-E514 PolarHBondContact NH2-OE2 3.08Å
489	F	87.8	Confident	93	Very high	11 Å²	11	40.4 Å²	40.4	5%	0.048	22%	0.222	C	C	.	.	S	Bend	trans	-132	136.8	173.1	174.2	-95.9	0	0	0	109.7	H429 L446 I464 H491 G505 M506	H429-F489 AromaticContact CD2-CE2 3.78Å; H429-F489 AromaticContact NE2-CE2 3.95Å; H429-F489 WeakPolarHBondContact O-CE2 3.12Å; L446-F489 HydrophobicContact CB-CD2 4.19Å; L446-F489 HydrophobicContact CB-CE2 4.23Å; L446-F489 HydrophobicContact CD1-CD2 3.71Å; L446-F489 HydrophobicContact CD1-CE2 3.56Å; L446-F489 HydrophobicContact CD1-CG 4.35Å; L446-F489 HydrophobicContact CD1-CZ 4.13Å; L446-F489 HydrophobicContact CG-CD2 3.57Å; L446-F489 HydrophobicContact CG-CE2 3.85Å; L446-F489 HydrophobicContact CG-CG 4.33Å; I464-F489 HydrophobicContact CD1-CB 4.29Å; I464-F489 HydrophobicContact CG1-CB 4.45Å; I464-F489 HydrophobicContact CG2-CB 4.1Å; F489-H491 PolarHBondContact O-N 2.78Å; F489-G505 CarbonylContact O-C 3.58Å; F489-G505 VanDerWaalsContact O-CA 3.26Å; F489-G505 WeakPolarHBondContact O-CA 3.23Å; F489-M506 HydrophobicContact CD1-CB 4.2Å; F489-M506 HydrophobicContact CD1-CE 4.15Å; F489-M506 HydrophobicContact CE1-CE 3.74Å; F489-M506 PolarHBondContact O-N 2.87Å
490	G	87.4	Confident	93.2	Very high	26 Å²	26	36.6 Å²	36.6	27%	0.268	20%	0.204	S	C	.	.	S	Bend	trans	64.9	20.3	-177.8	0	0	0	0	0	113.7	G430	G430-G490 PolarHBondContact O-N 3.24Å
491	H	91.4	Very high	93.2	Very high	7 Å²	7	30.2 Å²	30.2	3%	0.032	18%	0.177	C	C	.	.			trans	-80.3	174.4	173.9	67.8	-69.6	0	0	0	111.4	A432 T443 R488 F489 L503 L504	A432-H491 WeakPolarHBondContact CB-NE2 3.31Å; A432-H491 WeakPolarHBondContact CB-O 3.32Å; T443-H491 PolarHBondContact O-CE1 2.85Å; T443-H491 PolarHBondContact O-NE2 3.1Å; T443-H491 PolarHBondContact OG1-NE2 3.29Å; R488-H491 HydrophobicContact CB-CB 3.88Å; R488-H491 VanDerWaalsContact CB-CG 3.47Å; R488-H491 VanDerWaalsContact CB-ND1 3.29Å; R488-H491 WeakPolarHBondContact CB-ND1 3.26Å; F489-H491 PolarHBondContact O-N 2.78Å; H491-L503 WeakPolarHBondContact CB-O 3.29Å; H491-L504 VanDerWaalsContact CA-O 3.23Å; H491-L504 WeakPolarHBondContact CA-O 3.39Å
492	R	92.9	Very high	93.1	Very high	48 Å²	48	27.4 Å²	27.4	18%	0.181	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	149.7	174.2	-61.8	-167.8	-179.3	-108	-0.9	111.6	L503 Y536 M538 T588 E589	R492-L503 PolarHBondContact N-O 2.87Å; R492-L503 PolarHBondContact O-N 3.32Å; R492-Y536 HydrophobicContact CB-CE2 4.45Å; R492-Y536 HydrophobicContact CG-CE2 4.25Å; R492-Y536 VanDerWaalsContact CZ-O 3.28Å; R492-Y536 PolarHBondContact NE-O 2.78Å; R492-Y536 PolarHBondContact NH2-O 2.83Å; R492-M538 HydrophobicContact CB-CE 3.37Å; R492-M538 HydrophobicContact CB-SD 3.95Å; R492-M538 HydrophobicContact CG-CE 4.46Å; R492-T588 PolarHBondContact NH2-O 3.36Å; R492-T588 VanDerWaalsContact NH2-O 3.08Å; R492-E589 IonicContact CZ-OE1 2.69Å; R492-E589 IonicContact CZ-OE2 2.65Å; R492-E589 IonicContact NH1-OE1 3.4Å; R492-E589 PolarHBondContact NH1-OE1 2.81Å; R492-E589 IonicContact NH1-OE2 3.84Å; R492-E589 PolarHBondContact NH1-OE2 3.34Å; R492-E589 IonicContact NH2-OE1 3.57Å; R492-E589 PolarHBondContact NH2-OE1 3.32Å; R492-E589 IonicContact NH2-OE2 2.98Å; R492-E589 PolarHBondContact NH2-OE2 3.35Å
493	L	95.8	Very high	92.7	Very high	14 Å²	14	26.1 Å²	26.1	7%	0.073	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	142.2	171.9	-67.9	-172.2	0	0	0	110.6	A432 T434 T443 I500 Y501 A502 M538	A432-L493 HydrophobicContact CB-CB 4.4Å; A432-L493 HydrophobicContact CB-CD1 4.46Å; A432-L493 HydrophobicContact CB-CD2 4.47Å; A432-L493 HydrophobicContact CB-CG 3.72Å; T434-L493 HydrophobicContact CG2-CB 3.8Å; T434-L493 HydrophobicContact CG2-CD1 3.9Å; T443-L493 HydrophobicContact CG2-CD1 3.92Å; T443-L493 HydrophobicContact CG2-CD2 4.43Å; T443-L493 WeakPolarHBondContact OG1-CD1 3.27Å; T443-L493 WeakPolarHBondContact OG1-CD2 3.49Å; L493-I500 HydrophobicContact CB-CG2 4.34Å; L493-I500 HydrophobicContact CD1-CG2 4.05Å; L493-I500 HydrophobicContact CD2-CG2 3.93Å; L493-I500 HydrophobicContact CG-CG2 4.32Å; L493-Y501 CarbonylContact C-O 3.57Å; L493-Y501 VanDerWaalsContact CA-O 3.28Å; L493-Y501 WeakPolarHBondContact CA-O 3.25Å; L493-A502 HydrophobicContact CD2-CB 3.6Å; L493-M538 VanDerWaalsContact C-CE 3.47Å; L493-M538 WeakPolarHBondContact O-CE 3.47Å
494	A	95.8	Very high	92	Very high	2 Å²	2	23.9 Å²	23.9	2%	0.017	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	146.9	170.9	0	0	0	0	0	110	I500 Y501 M538 T540 L546	A494-I500 CarbonylContact O-C 3.6Å; A494-I500 WeakPolarHBondContact O-CA 3.38Å; A494-Y501 PolarHBondContact N-O 2.84Å; A494-Y501 PolarHBondContact O-N 3.24Å; A494-M538 HydrophobicContact CB-CE 3.8Å; A494-M538 HydrophobicContact CB-SD 4.46Å; A494-T540 WeakPolarHBondContact CB-OG1 3.14Å; A494-L546 HydrophobicContact CB-CD1 3.76Å; A494-L546 HydrophobicContact CB-CD2 3.48Å; A494-L546 VanDerWaalsContact CB-CD2 3.48Å; A494-L546 HydrophobicContact CB-CG 4.25Å
495	T	96.4	Very high	91.1	Very high	33 Å²	33	24.5 Å²	24.5	20%	0.202	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.2	172.6	-61.6	0	0	0	0	109.1	T434 V435 L436 Y499 T540	T434-T495 WeakPolarHBondContact CG2-OG1 3.31Å; T434-T495 PolarHBondContact OG1-OG1 3.18Å; T434-T495 VanDerWaalsContact OG1-OG1 3.04Å; V435-T495 WeakPolarHBondContact O-CB 3.48Å; V435-T495 WeakPolarHBondContact O-CG2 3.32Å; V435-T495 PolarHBondContact O-OG1 3.32Å; L436-T495 HydrophobicContact CB-CG2 4.01Å; L436-T495 HydrophobicContact CD1-CG2 3.58Å; L436-T495 HydrophobicContact CG-CG2 4.3Å; T495-Y499 WeakPolarHBondContact CA-O 3.31Å; T495-T540 WeakPolarHBondContact O-CG2 3.04Å
496	A	96	Very high	90	Very high	5 Å²	5	24 Å²	24	4%	0.041	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	138.5	175.8	0	0	0	0	0	110.7	G498 Y499 Y501 T540 G544 T570	A496-G498 PolarHBondContact O-N 2.69Å; A496-G498 VanDerWaalsContact O-N 3.1Å; A496-Y499 PolarHBondContact N-O 3.37Å; A496-Y499 PolarHBondContact O-N 3.35Å; A496-Y501 HydrophobicContact CB-CD2 4.29Å; A496-Y501 HydrophobicContact CB-CE2 3.87Å; A496-T540 HydrophobicContact CB-CG2 4.16Å; A496-G544 VanDerWaalsContact CB-O 3.27Å; A496-G544 WeakPolarHBondContact CB-O 3.23Å; A496-T570 HydrophobicContact CB-CG2 4.24Å
497	H	94.2	Very high	88.7	Confident	85 Å²	85	31.5 Å²	31.5	39%	0.394	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	34.7	174.9	-56.3	-50.9	0	0	0	115.1	Y499 G543 T570 K571	H497-Y499 VanDerWaalsContact C-N 3.34Å; H497-Y499 HydrophobicContact CB-CD2 4.43Å; H497-Y499 WeakPolarHBondContact O-CD2 3.43Å; H497-Y499 WeakPolarHBondContact O-CE2 3.28Å; H497-G543 PolarHBondContact CE1-O 2.9Å; H497-G543 PolarHBondContact NE2-O 2.9Å; H497-T570 PolarHBondContact CD2-OG1 3Å; H497-K571 VanDerWaalsContact CE1-CE 3.49Å; H497-K571 WeakPolarHBondContact CE1-CE 3.41Å; H497-K571 WeakPolarHBondContact NE2-CE 3.09Å
498	G	95.1	Very high	87.1	Confident	36 Å²	36	35.7 Å²	35.7	37%	0.371	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	8.6	-179.4	0	0	0	0	0	115	L436 A496 P518	L436-G498 WeakPolarHBondContact CD2-O 3.49Å; A496-G498 PolarHBondContact O-N 2.69Å; A496-G498 VanDerWaalsContact O-N 3.1Å; G498-P518 WeakPolarHBondContact O-CD 3.26Å
499	Y	97.3	Very high	85.4	Confident	71 Å²	71	43.1 Å²	43.1	28%	0.278	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	156.8	178.2	-58.3	-83.5	0	0	0	111.5	T495 A496 H497 R515 D517	T495-Y499 WeakPolarHBondContact CA-O 3.31Å; A496-Y499 PolarHBondContact N-O 3.37Å; A496-Y499 PolarHBondContact O-N 3.35Å; H497-Y499 VanDerWaalsContact C-N 3.34Å; H497-Y499 HydrophobicContact CB-CD2 4.43Å; H497-Y499 WeakPolarHBondContact O-CD2 3.43Å; H497-Y499 WeakPolarHBondContact O-CE2 3.28Å; Y499-R515 HydrophobicContact CD1-CG 4.03Å; Y499-R515 HydrophobicContact CG-CG 3.94Å; Y499-D517 HydrophobicContact CD1-CB 3.93Å; Y499-D517 HydrophobicContact CE1-CB 3.82Å
500	I	97.8	Very high	83.9	Confident	1 Å²	1	48 Å²	48	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	130.4	171.3	-61.9	172.6	0	0	0	108.9	T434 L436 Y441 L493 A494 R515 Y516 W523	T434-I500 HydrophobicContact CG2-CB 4.38Å; T434-I500 HydrophobicContact CG2-CD1 3.9Å; T434-I500 HydrophobicContact CG2-CG1 3.86Å; T434-I500 HydrophobicContact CG2-CG2 3.75Å; L436-I500 HydrophobicContact CB-CD1 4.15Å; L436-I500 HydrophobicContact CB-CG1 4.14Å; L436-I500 HydrophobicContact CD2-CD1 4.15Å; L436-I500 HydrophobicContact CD2-CG1 3.82Å; Y441-I500 HydrophobicContact CD1-CD1 3.71Å; Y441-I500 HydrophobicContact CD2-CD1 3.48Å; Y441-I500 VanDerWaalsContact CD2-CD1 3.48Å; Y441-I500 HydrophobicContact CE1-CD1 4.18Å; Y441-I500 HydrophobicContact CE2-CD1 3.97Å; Y441-I500 HydrophobicContact CG-CD1 3.32Å; L493-I500 HydrophobicContact CB-CG2 4.34Å; L493-I500 HydrophobicContact CD1-CG2 4.05Å; L493-I500 HydrophobicContact CD2-CG2 3.93Å; L493-I500 HydrophobicContact CG-CG2 4.32Å; A494-I500 CarbonylContact O-C 3.6Å; A494-I500 WeakPolarHBondContact O-CA 3.38Å; I500-R515 CarbonylContact O-C 3.59Å; I500-R515 VanDerWaalsContact O-CA 3.28Å; I500-R515 WeakPolarHBondContact O-CA 3.36Å; I500-Y516 HydrophobicContact CB-CD1 4.47Å; I500-Y516 HydrophobicContact CD1-CD1 4.16Å; I500-Y516 PolarHBondContact N-O 3.19Å; I500-Y516 VanDerWaalsContact N-O 3.12Å; I500-Y516 PolarHBondContact O-N 3.03Å; I500-W523 HydrophobicContact CG2-CH2 4.31Å
501	Y	96.1	Very high	82.9	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.016	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.8	177.8	-64.1	-102.5	0	0	0	109.1	L493 A494 A496 E514 R515 L526 L546 Y568 T570	L493-Y501 CarbonylContact C-O 3.57Å; L493-Y501 VanDerWaalsContact CA-O 3.28Å; L493-Y501 WeakPolarHBondContact CA-O 3.25Å; A494-Y501 PolarHBondContact N-O 2.84Å; A494-Y501 PolarHBondContact O-N 3.24Å; A496-Y501 HydrophobicContact CB-CD2 4.29Å; A496-Y501 HydrophobicContact CB-CE2 3.87Å; Y501-E514 CarbonylContact C-O 3.45Å; Y501-E514 WeakPolarHBondContact CA-O 3.32Å; Y501-R515 HydrophobicContact CD1-CB 4.1Å; Y501-R515 HydrophobicContact CD1-CG 4.22Å; Y501-R515 HydrophobicContact CE1-CB 4.05Å; Y501-R515 HydrophobicContact CE1-CG 3.87Å; Y501-R515 HydrophobicContact CE2-CG 4.3Å; Y501-L526 HydrophobicContact CD1-CD1 3.82Å; Y501-L526 HydrophobicContact CE1-CD1 3.58Å; Y501-L546 HydrophobicContact CG-CD1 4.31Å; Y501-Y568 HydrophobicContact CD1-CE1 4.16Å; Y501-Y568 HydrophobicContact CE1-CE1 4.15Å; Y501-T570 HydrophobicContact CD1-CG2 4.39Å; Y501-T570 HydrophobicContact CE1-CG2 3.91Å; Y501-T570 HydrophobicContact CE2-CG2 4.1Å
502	A	93.8	Very high	82.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	116.6	172.6	0	0	0	0	0	110.1	M484 L493 I513 E514 W523	M484-A502 HydrophobicContact SD-CB 3.9Å; L493-A502 HydrophobicContact CD2-CB 3.6Å; A502-I513 WeakPolarHBondContact O-CA 3.5Å; A502-E514 PolarHBondContact N-O 2.96Å; A502-E514 PolarHBondContact O-N 3.47Å; A502-E514 VanDerWaalsContact O-N 3.08Å; A502-W523 HydrophobicContact CB-CH2 4.02Å; A502-W523 HydrophobicContact CB-CZ3 3.64Å
503	L	89.3	Confident	82.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.4	-176.9	-76.6	76.1	0	0	0	110.5	H491 R492 I513 Y536 M538 L546 V548 W575	H491-L503 WeakPolarHBondContact CB-O 3.29Å; R492-L503 PolarHBondContact N-O 2.87Å; R492-L503 PolarHBondContact O-N 3.32Å; L503-I513 HydrophobicContact CB-CG2 4.33Å; L503-I513 HydrophobicContact CG-CG2 3.84Å; L503-Y536 WeakPolarHBondContact CB-OH 3.35Å; L503-Y536 PolarHBondContact O-OH 3Å; L503-M538 HydrophobicContact CB-SD 4.25Å; L503-M538 HydrophobicContact CD1-SD 4.32Å; L503-M538 HydrophobicContact CD2-SD 3.79Å; L503-M538 HydrophobicContact CG-SD 4.34Å; L503-L546 HydrophobicContact CD1-CD1 3.71Å; L503-L546 HydrophobicContact CD2-CD1 4.02Å; L503-V548 HydrophobicContact CD2-CG2 4.34Å; L503-W575 HydrophobicContact CD2-CH2 3.75Å; L503-W575 HydrophobicContact CD2-CZ2 4.17Å
504	L	79.8	Confident	82	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	23%	0.228	C	C	.	.			trans	26.5	125.2	159.6	-49.9	168	0	0	0	117.6	H491 L529 L533 Y536	H491-L504 VanDerWaalsContact CA-O 3.23Å; H491-L504 WeakPolarHBondContact CA-O 3.39Å; L504-L529 HydrophobicContact CD1-CB 4.31Å; L504-L529 HydrophobicContact CD1-CD2 3.6Å; L504-L533 VanDerWaalsContact CB-O 3.26Å; L504-L533 WeakPolarHBondContact CB-O 3.45Å; L504-L533 HydrophobicContact CD1-CB 4.06Å; L504-Y536 HydrophobicContact CB-CE1 3.8Å; L504-Y536 HydrophobicContact CD1-CE1 4.32Å; L504-Y536 PolarHBondContact O-OH 3.25Å
505	G	74.5	Confident	82.1	Confident	19 Å²	19	49.3 Å²	49.3	20%	0.196	24%	0.239	C	C	.	.			trans	-120.5	-175.6	175.6	0	0	0	0	0	114.2	F489	F489-G505 CarbonylContact O-C 3.58Å; F489-G505 VanDerWaalsContact O-CA 3.26Å; F489-G505 WeakPolarHBondContact O-CA 3.23Å
506	M	68.3	Low	82.1	Confident	53 Å²	53	47.8 Å²	47.8	26%	0.261	23%	0.23	S	C	.	.	S	Bend	trans	-82.6	133.3	171.6	-162.4	173	90.4	0	0	109.5	F489 F534	F489-M506 HydrophobicContact CD1-CB 4.2Å; F489-M506 HydrophobicContact CD1-CE 4.15Å; F489-M506 HydrophobicContact CE1-CE 3.74Å; F489-M506 PolarHBondContact O-N 2.87Å; M506-F534 HydrophobicContact CG-CD2 4.29Å
507	Y	58	Low	82.2	Confident	168 Å²	168	48.9 Å²	48.9	66%	0.659	24%	0.235	S	C	*	.	S	Bend	trans	91.3	150.2	-173.7	-56.7	-76.4	0	0	0	116.4
508	E	53.8	Low	82.3	Confident	154 Å²	154	46.4 Å²	46.4	72%	0.72	23%	0.226	S	C	*	.	S	Bend	trans	-62.4	162.5	-137.6	-65.1	-168.8	157.2	0	0	121.7	F510	E508-F510 VanDerWaalsContact C-N 3.3Å; E508-F510 WeakPolarHBondContact O-CD2 3Å; E508-F510 WeakPolarHBondContact O-CE2 3.17Å; E508-F510 PolarHBondContact O-N 2.9Å
509	Q	51.4	Low	82.3	Confident	167 Å²	167	53.4 Å²	53.4	78%	0.78	25%	0.249	S	C	*	.	S	Bend	trans	60.3	-18.8	162.8	-70.1	-179.7	26.3	0	0	120.7	C511	Q509-C511 PolarHBondContact O-N 3.18Å
510	F	56.5	Low	82.2	Confident	112 Å²	112	53.4 Å²	53.4	49%	0.491	26%	0.26	S	S	.	.			trans	-96.6	96.2	-172.1	-53.9	-68.1	0	0	0	112.7	I486 E508	I486-F510 HydrophobicContact CD1-CB 4.21Å; I486-F510 HydrophobicContact CD1-CD1 4.31Å; I486-F510 HydrophobicContact CD1-CG 4.31Å; I486-F510 HydrophobicContact CG2-CB 4.29Å; I486-F510 HydrophobicContact CG2-CD2 4.06Å; I486-F510 HydrophobicContact CG2-CG 4.15Å; E508-F510 VanDerWaalsContact C-N 3.3Å; E508-F510 WeakPolarHBondContact O-CD2 3Å; E508-F510 WeakPolarHBondContact O-CE2 3.17Å; E508-F510 PolarHBondContact O-N 2.9Å
511	C	66.2	Low	82.2	Confident	25 Å²	25	56.3 Å²	56.3	17%	0.169	28%	0.276	C	S	.	.			trans	-78.2	-6.3	166.1	-65.9	0	0	0	0	113	Q509 I513 P528 L529 G532	Q509-C511 PolarHBondContact O-N 3.18Å; C511-I513 PolarHBondContact O-N 3Å; C511-P528 VanDerWaalsContact C-CB 3.49Å; C511-P528 HydrophobicContact CB-CB 3.64Å; C511-P528 CarbonylContact O-C 3.46Å; C511-P528 WeakPolarHBondContact O-CA 3.44Å; C511-P528 WeakPolarHBondContact O-CB 3.46Å; C511-L529 WeakPolarHBondContact CB-O 3.17Å; C511-L529 PolarHBondContact O-N 3.08Å; C511-L529 PolarHBondContact SG-O 2.98Å; C511-G532 PolarHBondContact SG-N 2.86Å; C511-G532 VanDerWaalsContact SG-N 3.38Å
512	D	79.3	Confident	82.2	Confident	34 Å²	34	61.5 Å²	61.5	18%	0.182	30%	0.3	C	S	.	.			trans	-64.3	130.8	-179	-71	-10.1	0	0	0	110.3	I486 R488 R525	I486-D512 HydrophobicContact CD1-CB 3.77Å; R488-D512 PolarHBondContact NH1-O 3.19Å; R488-D512 PolarHBondContact NH2-O 3.41Å; D512-R525 IonicContact OD2-CZ 3.98Å; D512-R525 IonicContact OD2-NE 3.24Å; D512-R525 IonicContact OD2-NH1 3.45Å; D512-R525 PolarHBondContact OD2-NH1 2.93Å
513	I	89.8	Confident	82.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	145.9	170.2	50.6	153.3	0	0	0	108.1	A502 L503 C511 L526 K527 Y568 W575	A502-I513 WeakPolarHBondContact O-CA 3.5Å; L503-I513 HydrophobicContact CB-CG2 4.33Å; L503-I513 HydrophobicContact CG-CG2 3.84Å; C511-I513 PolarHBondContact O-N 3Å; I513-L526 HydrophobicContact CD1-CB 3.7Å; I513-L526 HydrophobicContact CD1-CD1 4.37Å; I513-L526 HydrophobicContact CG1-CB 3.75Å; I513-L526 PolarHBondContact O-N 3.49Å; I513-K527 VanDerWaalsContact CG1-O 3.29Å; I513-K527 WeakPolarHBondContact CG1-O 3.24Å; I513-Y568 HydrophobicContact CD1-CD1 4.42Å; I513-Y568 HydrophobicContact CD1-CD2 4.26Å; I513-Y568 HydrophobicContact CD1-CE1 3.72Å; I513-Y568 HydrophobicContact CD1-CE2 3.54Å; I513-Y568 VanDerWaalsContact CD1-OH 3.27Å; I513-Y568 WeakPolarHBondContact CD1-OH 3.43Å; I513-W575 HydrophobicContact CD1-CZ2 4.38Å; I513-W575 HydrophobicContact CG2-CZ2 4.3Å
514	E	93.6	Very high	82.7	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	143.3	-177.7	-66.5	171.9	99.9	0	0	110.3	S485 R488 Y501 A502 W523 T524 R525	S485-E514 WeakPolarHBondContact CA-OE1 3.45Å; S485-E514 VanDerWaalsContact CB-OE1 3.23Å; S485-E514 WeakPolarHBondContact CB-OE1 3.3Å; S485-E514 PolarHBondContact N-OE1 2.92Å; S485-E514 PolarHBondContact OG-OE1 3.21Å; R488-E514 IonicContact CZ-OE2 3.39Å; R488-E514 IonicContact NE-OE2 3.62Å; R488-E514 PolarHBondContact NE-OE2 2.8Å; R488-E514 IonicContact NH2-OE2 2.65Å; R488-E514 PolarHBondContact NH2-OE2 3.08Å; Y501-E514 CarbonylContact C-O 3.45Å; Y501-E514 WeakPolarHBondContact CA-O 3.32Å; A502-E514 PolarHBondContact N-O 2.96Å; A502-E514 PolarHBondContact O-N 3.47Å; A502-E514 VanDerWaalsContact O-N 3.08Å; E514-W523 HydrophobicContact CB-CE3 3.62Å; E514-W523 HydrophobicContact CB-CZ3 4.17Å; E514-T524 CarbonylContact C-O 3.58Å; E514-T524 WeakPolarHBondContact CA-O 3.44Å; E514-R525 HydrophobicContact CG-CG 4.22Å
515	R	96.4	Very high	83.3	Confident	65 Å²	65	70.9 Å²	70.9	25%	0.245	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	122	174.2	-179.1	-164.7	73	179.7	1.1	110.1	Y499 I500 Y501 W523 T524 L526	Y499-R515 HydrophobicContact CD1-CG 4.03Å; Y499-R515 HydrophobicContact CG-CG 3.94Å; I500-R515 CarbonylContact O-C 3.59Å; I500-R515 VanDerWaalsContact O-CA 3.28Å; I500-R515 WeakPolarHBondContact O-CA 3.36Å; Y501-R515 HydrophobicContact CD1-CB 4.1Å; Y501-R515 HydrophobicContact CD1-CG 4.22Å; Y501-R515 HydrophobicContact CE1-CB 4.05Å; Y501-R515 HydrophobicContact CE1-CG 3.87Å; Y501-R515 HydrophobicContact CE2-CG 4.3Å; R515-W523 CarbonylContact O-C 3.56Å; R515-W523 WeakPolarHBondContact O-CA 3.02Å; R515-T524 PolarHBondContact N-O 3.5Å; R515-T524 PolarHBondContact O-N 2.94Å; R515-L526 HydrophobicContact CB-CD1 3.53Å; R515-L526 HydrophobicContact CB-CG 4.09Å; R515-L526 HydrophobicContact CG-CD1 4.45Å
516	Y	97.9	Very high	84.1	Confident	1 Å²	1	71.3 Å²	71.3	0%	0.004	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.1	172.4	-179.2	-111.5	0	0	0	110.8	Y441 R481 A482 I500 P518 N521 H522 W523	Y441-Y516 HydrophobicContact CD1-CE1 4.29Å; Y441-Y516 AromaticContact CE1-CE1 3.74Å; Y441-Y516 HydrophobicContact CE1-CE1 3.74Å; R481-Y516 WeakPolarHBondContact CD-OH 3.36Å; A482-Y516 HydrophobicContact CB-CE2 4.38Å; I500-Y516 HydrophobicContact CB-CD1 4.47Å; I500-Y516 HydrophobicContact CD1-CD1 4.16Å; I500-Y516 PolarHBondContact N-O 3.19Å; I500-Y516 VanDerWaalsContact N-O 3.12Å; I500-Y516 PolarHBondContact O-N 3.03Å; Y516-P518 HydrophobicContact CE1-CB 3.98Å; Y516-N521 WeakPolarHBondContact CE2-OD1 3.28Å; Y516-N521 PolarHBondContact OH-OD1 2.93Å; Y516-H522 WeakPolarHBondContact CA-O 3.29Å; Y516-W523 AromaticContact CD2-CD1 3.74Å; Y516-W523 AromaticContact CD2-CD2 3.94Å; Y516-W523 HydrophobicContact CD2-CD2 3.94Å; Y516-W523 AromaticContact CD2-CE2 3.58Å; Y516-W523 HydrophobicContact CD2-CG 4.05Å; Y516-W523 HydrophobicContact CD2-CZ2 4.11Å; Y516-W523 AromaticContact CD2-NE1 3.43Å; Y516-W523 HydrophobicContact CG-CD2 4.22Å; Y516-W523 AromaticContact CG-CE2 3.88Å; Y516-W523 HydrophobicContact CG-CH2 4.4Å; Y516-W523 AromaticContact CG-CZ2 3.99Å; Y516-W523 HydrophobicContact CG-CZ2 3.99Å
517	D	97.1	Very high	85.1	Confident	29 Å²	29	74 Å²	74	16%	0.155	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	114.7	167.6	174	5.9	0	0	0	109.1	Y499 Q519 S520 N521 H522	Y499-D517 HydrophobicContact CD1-CB 3.93Å; Y499-D517 HydrophobicContact CE1-CB 3.82Å; D517-Q519 VanDerWaalsContact C-N 3.26Å; D517-Q519 PolarHBondContact O-N 3.5Å; D517-Q519 WeakPolarHBondContact OD1-CB 3.44Å; D517-Q519 PolarHBondContact OD1-N 2.75Å; D517-S520 WeakPolarHBondContact CB-OG 3.34Å; D517-S520 WeakPolarHBondContact OD2-CB 3.49Å; D517-S520 PolarHBondContact OD2-OG 3.11Å; D517-N521 VanDerWaalsContact O-CA 3.28Å; D517-N521 WeakPolarHBondContact O-CA 3.42Å; D517-N521 PolarHBondContact O-N 2.85Å; D517-H522 PolarHBondContact N-O 2.8Å; D517-H522 PolarHBondContact O-N 2.88Å
518	P	95.4	Very high	86.4	Confident	32 Å²	32	68.8 Å²	68.8	21%	0.208	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.5	179.5	31.9	-39.8	0	0	0	113.2	L436 G498 Y516	L436-P518 HydrophobicContact CD2-CB 4.31Å; L436-P518 HydrophobicContact CD2-CG 3.74Å; G498-P518 WeakPolarHBondContact O-CD 3.26Å; Y516-P518 HydrophobicContact CE1-CB 3.98Å
519	Q	95.4	Very high	87.8	Confident	183 Å²	183	62.1 Å²	62.1	86%	0.855	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-45.9	-177.9	-60.6	-174.1	6.1	0	0	111.3	D517 N521	D517-Q519 VanDerWaalsContact C-N 3.26Å; D517-Q519 PolarHBondContact O-N 3.5Å; D517-Q519 WeakPolarHBondContact OD1-CB 3.44Å; D517-Q519 PolarHBondContact OD1-N 2.75Å; Q519-N521 VanDerWaalsContact C-N 3.35Å
520	S	96.3	Very high	88.7	Confident	71 Å²	71	58.6 Å²	58.6	50%	0.497	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-8.2	175.9	61.1	0	0	0	0	113.5	D517 H522	D517-S520 WeakPolarHBondContact CB-OG 3.34Å; D517-S520 WeakPolarHBondContact OD2-CB 3.49Å; D517-S520 PolarHBondContact OD2-OG 3.11Å; S520-H522 VanDerWaalsContact C-N 3.33Å; S520-H522 PolarHBondContact O-N 3.23Å
521	N	96.8	Very high	89.6	Confident	63 Å²	63	58 Å²	58	34%	0.337	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	53.3	-174.9	-173.9	33.5	0	0	0	111.5	A482 Y516 D517 Q519	A482-N521 WeakPolarHBondContact CB-O 3.35Å; A482-N521 WeakPolarHBondContact CB-OD1 3.29Å; A482-N521 PolarHBondContact N-OD1 2.83Å; Y516-N521 WeakPolarHBondContact CE2-OD1 3.28Å; Y516-N521 PolarHBondContact OH-OD1 2.93Å; D517-N521 VanDerWaalsContact O-CA 3.28Å; D517-N521 WeakPolarHBondContact O-CA 3.42Å; D517-N521 PolarHBondContact O-N 2.85Å; Q519-N521 VanDerWaalsContact C-N 3.35Å
522	H	97.2	Very high	90	Very high	112 Å²	112	58.2 Å²	58.2	52%	0.519	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	147.4	-174.7	-173.4	68.8	0	0	0	112.4	Y516 D517 S520	Y516-H522 WeakPolarHBondContact CA-O 3.29Å; D517-H522 PolarHBondContact N-O 2.8Å; D517-H522 PolarHBondContact O-N 2.88Å; S520-H522 VanDerWaalsContact C-N 3.33Å; S520-H522 PolarHBondContact O-N 3.23Å
523	W	96.7	Very high	90.3	Very high	15 Å²	15	57 Å²	57	6%	0.057	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.5	175.9	-69.5	90.6	0	0	0	110.8	T443 C468 A482 M484 I500 A502 E514 R515 Y516	T443-W523 HydrophobicContact CG2-CH2 4.09Å; T443-W523 HydrophobicContact CG2-CZ2 3.88Å; C468-W523 HydrophobicContact CB-CZ2 4.38Å; A482-W523 PolarHBondContact O-NE1 3.01Å; M484-W523 HydrophobicContact CG-CD2 3.88Å; M484-W523 HydrophobicContact CG-CE3 4.19Å; M484-W523 HydrophobicContact CG-CH2 3.85Å; M484-W523 HydrophobicContact CG-CZ2 3.53Å; M484-W523 HydrophobicContact CG-CZ3 4.17Å; M484-W523 HydrophobicContact SD-CH2 4.17Å; M484-W523 HydrophobicContact SD-CZ2 4.33Å; I500-W523 HydrophobicContact CG2-CH2 4.31Å; A502-W523 HydrophobicContact CB-CH2 4.02Å; A502-W523 HydrophobicContact CB-CZ3 3.64Å; E514-W523 HydrophobicContact CB-CE3 3.62Å; E514-W523 HydrophobicContact CB-CZ3 4.17Å; R515-W523 CarbonylContact O-C 3.56Å; R515-W523 WeakPolarHBondContact O-CA 3.02Å; Y516-W523 AromaticContact CD2-CD1 3.74Å; Y516-W523 AromaticContact CD2-CD2 3.94Å; Y516-W523 HydrophobicContact CD2-CD2 3.94Å; Y516-W523 AromaticContact CD2-CE2 3.58Å; Y516-W523 HydrophobicContact CD2-CG 4.05Å; Y516-W523 HydrophobicContact CD2-CZ2 4.11Å; Y516-W523 AromaticContact CD2-NE1 3.43Å; Y516-W523 HydrophobicContact CG-CD2 4.22Å; Y516-W523 AromaticContact CG-CE2 3.88Å; Y516-W523 HydrophobicContact CG-CH2 4.4Å; Y516-W523 AromaticContact CG-CZ2 3.99Å; Y516-W523 HydrophobicContact CG-CZ2 3.99Å
524	T	95.4	Very high	90.2	Very high	53 Å²	53	58.1 Å²	58.1	33%	0.325	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.7	175	-50	0	0	0	0	109.9	E514 R515	E514-T524 CarbonylContact C-O 3.58Å; E514-T524 WeakPolarHBondContact CA-O 3.44Å; R515-T524 PolarHBondContact N-O 3.5Å; R515-T524 PolarHBondContact O-N 2.94Å
525	R	92.3	Very high	90	Very high	132 Å²	132	60.1 Å²	60.1	50%	0.498	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	138.1	172.2	-68.6	-169.8	-179.6	-167.7	9.1	110.8	S485 D512 E514	S485-R525 PolarHBondContact OG-NE 3.15Å; S485-R525 VanDerWaalsContact OG-NE 3.08Å; S485-R525 PolarHBondContact OG-NH2 3.22Å; D512-R525 IonicContact OD2-CZ 3.98Å; D512-R525 IonicContact OD2-NE 3.24Å; D512-R525 IonicContact OD2-NH1 3.45Å; D512-R525 PolarHBondContact OD2-NH1 2.93Å; E514-R525 HydrophobicContact CG-CG 4.22Å
526	L	92.9	Very high	89.8	Confident	28 Å²	28	57.1 Å²	57.1	15%	0.147	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	175.5	179.9	-63.9	-177.7	0	0	0	110.6	Y501 I513 R515 Y568	Y501-L526 HydrophobicContact CD1-CD1 3.82Å; Y501-L526 HydrophobicContact CE1-CD1 3.58Å; I513-L526 HydrophobicContact CD1-CB 3.7Å; I513-L526 HydrophobicContact CD1-CD1 4.37Å; I513-L526 HydrophobicContact CG1-CB 3.75Å; I513-L526 PolarHBondContact O-N 3.49Å; R515-L526 HydrophobicContact CB-CD1 3.53Å; R515-L526 HydrophobicContact CB-CG 4.09Å; R515-L526 HydrophobicContact CG-CD1 4.45Å; L526-Y568 WeakPolarHBondContact CD1-OH 3.47Å
527	K	88	Confident	89.5	Confident	108 Å²	108	57.1 Å²	57.1	47%	0.47	31%	0.31	S	S	.	.			trans	-58.6	122.5	-174.1	-171.6	175.9	-176	173.6	0	112.2	I513 D573 W575	I513-K527 VanDerWaalsContact CG1-O 3.29Å; I513-K527 WeakPolarHBondContact CG1-O 3.24Å; K527-D573 VanDerWaalsContact CB-CG 3.47Å; K527-D573 WeakPolarHBondContact CB-OD1 3.32Å; K527-D573 WeakPolarHBondContact CB-OD2 3.38Å; K527-D573 VanDerWaalsContact CD-O 3.26Å; K527-D573 WeakPolarHBondContact CD-O 3.49Å; K527-D573 PolarHBondContact N-OD1 2.82Å; K527-D573 PolarHBondContact N-OD2 2.66Å; K527-W575 PolarHBondContact O-NE1 3.49Å
528	P	85.3	Confident	89.4	Confident	59 Å²	59	56.5 Å²	56.5	38%	0.383	31%	0.306	S	S	.	.			trans	-69.1	154.4	-178.2	25.8	-33.3	0	0	0	112.8	C511 A530	C511-P528 VanDerWaalsContact C-CB 3.49Å; C511-P528 HydrophobicContact CB-CB 3.64Å; C511-P528 CarbonylContact O-C 3.46Å; C511-P528 WeakPolarHBondContact O-CA 3.44Å; C511-P528 WeakPolarHBondContact O-CB 3.46Å; P528-A530 PolarHBondContact O-N 3.38Å
529	L	83.9	Confident	89.4	Confident	15 Å²	15	56 Å²	56	8%	0.079	30%	0.302	C	S	.	.			trans	-83.5	107.5	168.7	-179.8	67.4	0	0	0	110.2	L504 C511 N531 L533 L566 W575	L504-L529 HydrophobicContact CD1-CB 4.31Å; L504-L529 HydrophobicContact CD1-CD2 3.6Å; C511-L529 WeakPolarHBondContact CB-O 3.17Å; C511-L529 PolarHBondContact O-N 3.08Å; C511-L529 PolarHBondContact SG-O 2.98Å; L529-N531 WeakPolarHBondContact CD2-O 3.48Å; L529-N531 CarbonylContact O-C 3.52Å; L529-N531 PolarHBondContact O-N 3.26Å; L529-L533 HydrophobicContact CD2-CB 4.44Å; L529-L533 HydrophobicContact CD2-CD1 3.75Å; L529-L533 HydrophobicContact CD2-CG 3.97Å; L529-L566 HydrophobicContact CD1-CD1 3.71Å; L529-L566 HydrophobicContact CD2-CD1 3.88Å; L529-L566 HydrophobicContact CG-CD1 4.45Å; L529-W575 HydrophobicContact CB-CZ2 4.43Å; L529-W575 HydrophobicContact CD1-CB 4.44Å; L529-W575 HydrophobicContact CD1-CD2 3.86Å; L529-W575 HydrophobicContact CD1-CE3 4.08Å; L529-W575 HydrophobicContact CD1-CG 4.02Å
530	A	70.4	Confident	89.3	Confident	92 Å²	92	49.1 Å²	49.1	76%	0.76	27%	0.273	S	S	*	.	S	Bend	trans	-46.6	-31.9	-171.7	0	0	0	0	0	115.9	P528	P528-A530 PolarHBondContact O-N 3.38Å
531	N	74.7	Confident	89.1	Confident	101 Å²	101	47.6 Å²	47.6	54%	0.54	26%	0.258	S	S	.	.	S	Bend	trans	-116.3	100.7	172	-64.1	-33.5	0	0	0	109.8	L529	L529-N531 WeakPolarHBondContact CD2-O 3.48Å; L529-N531 CarbonylContact O-C 3.52Å; L529-N531 PolarHBondContact O-N 3.26Å
532	G	75.7	Confident	88.7	Confident	28 Å²	28	49.9 Å²	49.9	29%	0.289	29%	0.286	S	S	.	.			trans	-54.8	138.5	-179.1	0	0	0	0	0	112.9	C511 R553	C511-G532 PolarHBondContact SG-N 2.86Å; C511-G532 VanDerWaalsContact SG-N 3.38Å; G532-R553 VanDerWaalsContact O-CB 3.31Å; G532-R553 WeakPolarHBondContact O-CB 3.29Å
533	L	85.9	Confident	88.3	Confident	9 Å²	9	47 Å²	47	5%	0.047	29%	0.286	C	S	.	.			trans	-118.6	145.5	179.2	-69.6	170.7	0	0	0	110.3	L504 L529 Y536 V548 R552 R553 V562 L566	L504-L533 VanDerWaalsContact CB-O 3.26Å; L504-L533 WeakPolarHBondContact CB-O 3.45Å; L504-L533 HydrophobicContact CD1-CB 4.06Å; L529-L533 HydrophobicContact CD2-CB 4.44Å; L529-L533 HydrophobicContact CD2-CD1 3.75Å; L529-L533 HydrophobicContact CD2-CG 3.97Å; L533-Y536 HydrophobicContact CB-CD1 3.79Å; L533-Y536 HydrophobicContact CB-CE1 4.37Å; L533-Y536 HydrophobicContact CB-CG 4.5Å; L533-Y536 VanDerWaalsContact O-CE1 3.25Å; L533-Y536 WeakPolarHBondContact O-CE1 3.17Å; L533-V548 HydrophobicContact CD1-CG1 4.05Å; L533-R552 CarbonylContact C-O 3.54Å; L533-R552 WeakPolarHBondContact CA-O 3.46Å; L533-R553 HydrophobicContact CD2-CB 4.1Å; L533-V562 HydrophobicContact CD2-CG2 3.6Å; L533-L566 HydrophobicContact CD1-CD1 3.82Å
534	F	87.8	Confident	88.1	Confident	24 Å²	24	46.5 Å²	46.5	11%	0.105	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-139.6	159.4	170.3	57.7	-84.2	0	0	0	110.4	M506 Y536 G551 R552 Q559	M506-F534 HydrophobicContact CG-CD2 4.29Å; F534-Y536 PolarHBondContact O-N 2.94Å; F534-G551 CarbonylContact O-C 3.58Å; F534-G551 WeakPolarHBondContact O-CA 3.45Å; F534-R552 VanDerWaalsContact CD1-O 3.22Å; F534-R552 WeakPolarHBondContact CD1-O 3.44Å; F534-R552 HydrophobicContact CD2-CB 4.19Å; F534-R552 HydrophobicContact CE1-CB 4.04Å; F534-R552 WeakPolarHBondContact CE1-O 3.22Å; F534-R552 HydrophobicContact CE2-CB 3.69Å; F534-R552 HydrophobicContact CE2-CG 4.45Å; F534-R552 HydrophobicContact CZ-CB 3.59Å; F534-R552 PolarHBondContact N-O 2.87Å; F534-R552 PolarHBondContact O-N 3.13Å; F534-Q559 HydrophobicContact CZ-CG 4.03Å
535	N	88.1	Confident	88.1	Confident	42 Å²	42	45.4 Å²	45.4	23%	0.225	28%	0.278	C	S	.	.	S	Bend	trans	53	36.5	-174.2	-62	-31.5	0	0	0	113.5	G551 R552 T586 G587	N535-G551 WeakPolarHBondContact O-CA 3.46Å; N535-R552 PolarHBondContact ND2-NH1 2.82Å; N535-R552 VanDerWaalsContact ND2-NH1 3.13Å; N535-R552 PolarHBondContact ND2-NH2 3.04Å; N535-T586 VanDerWaalsContact CB-OG1 3.25Å; N535-T586 WeakPolarHBondContact CB-OG1 3.26Å; N535-T586 PolarHBondContact O-OG1 3.4Å; N535-T586 VanDerWaalsContact O-OG1 3.11Å; N535-G587 PolarHBondContact O-N 2.87Å
536	Y	92.1	Very high	88.2	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.008	25%	0.254	C	S	.	.			trans	-89.1	158.6	172.8	53.9	-89.3	0	0	0	110.5	R492 L503 L504 L533 F534 M538 V548	R492-Y536 HydrophobicContact CB-CE2 4.45Å; R492-Y536 HydrophobicContact CG-CE2 4.25Å; R492-Y536 VanDerWaalsContact CZ-O 3.28Å; R492-Y536 PolarHBondContact NE-O 2.78Å; R492-Y536 PolarHBondContact NH2-O 2.83Å; L503-Y536 WeakPolarHBondContact CB-OH 3.35Å; L503-Y536 PolarHBondContact O-OH 3Å; L504-Y536 HydrophobicContact CB-CE1 3.8Å; L504-Y536 HydrophobicContact CD1-CE1 4.32Å; L504-Y536 PolarHBondContact O-OH 3.25Å; L533-Y536 HydrophobicContact CB-CD1 3.79Å; L533-Y536 HydrophobicContact CB-CE1 4.37Å; L533-Y536 HydrophobicContact CB-CG 4.5Å; L533-Y536 VanDerWaalsContact O-CE1 3.25Å; L533-Y536 WeakPolarHBondContact O-CE1 3.17Å; F534-Y536 PolarHBondContact O-N 2.94Å; Y536-M538 HydrophobicContact CD2-CB 4.13Å; Y536-M538 HydrophobicContact CE2-CB 4.04Å; Y536-M538 HydrophobicContact CE2-SD 4.27Å; Y536-V548 HydrophobicContact CD2-CG1 3.61Å; Y536-V548 HydrophobicContact CD2-CG2 4.39Å; Y536-V548 HydrophobicContact CE2-CG1 4.34Å; Y536-V548 HydrophobicContact CE2-CG2 4.47Å; Y536-V548 HydrophobicContact CG-CG1 3.81Å
537	G	93.1	Very high	88.3	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	144.8	165.4	0	0	0	0	0	110.4	V548 F549 T588 C590	G537-V548 CarbonylContact O-C 3.52Å; G537-V548 WeakPolarHBondContact O-CA 3.25Å; G537-F549 PolarHBondContact N-O 3.49Å; G537-F549 PolarHBondContact O-N 2.95Å; G537-T588 WeakPolarHBondContact CA-O 3.17Å; G537-C590 VanDerWaalsContact CA-SG 3.59Å
538	M	94.3	Very high	88.6	Confident	16 Å²	16	32.8 Å²	32.8	8%	0.079	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.3	179.5	-171.3	-175.8	74.6	0	0	111.8	R492 L493 A494 L503 Y536 L547 V548	R492-M538 HydrophobicContact CB-CE 3.37Å; R492-M538 HydrophobicContact CB-SD 3.95Å; R492-M538 HydrophobicContact CG-CE 4.46Å; L493-M538 VanDerWaalsContact C-CE 3.47Å; L493-M538 WeakPolarHBondContact O-CE 3.47Å; A494-M538 HydrophobicContact CB-CE 3.8Å; A494-M538 HydrophobicContact CB-SD 4.46Å; L503-M538 HydrophobicContact CB-SD 4.25Å; L503-M538 HydrophobicContact CD1-SD 4.32Å; L503-M538 HydrophobicContact CD2-SD 3.79Å; L503-M538 HydrophobicContact CG-SD 4.34Å; Y536-M538 HydrophobicContact CD2-CB 4.13Å; Y536-M538 HydrophobicContact CE2-CB 4.04Å; Y536-M538 HydrophobicContact CE2-SD 4.27Å; M538-L547 CarbonylContact C-O 3.58Å; M538-L547 VanDerWaalsContact CA-O 3.25Å; M538-L547 WeakPolarHBondContact CA-O 3.24Å; M538-L547 WeakPolarHBondContact CG-O 3.08Å; M538-V548 HydrophobicContact CG-CG2 4.25Å
539	L	94.7	Very high	89.1	Confident	21 Å²	21	30.2 Å²	30.2	11%	0.11	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	146.1	175.8	-174.1	82.3	0	0	0	110.6	V282 M541 L546 L547 C590 L592	V282-L539 HydrophobicContact CB-CD2 4.18Å; V282-L539 HydrophobicContact CG1-CB 4.41Å; V282-L539 HydrophobicContact CG1-CD2 3.77Å; V282-L539 HydrophobicContact CG2-CD2 3.46Å; V282-L539 VanDerWaalsContact CG2-CD2 3.46Å; L539-M541 HydrophobicContact CD2-SD 4.08Å; L539-L546 WeakPolarHBondContact O-CA 3.39Å; L539-L547 PolarHBondContact N-O 3.39Å; L539-L547 PolarHBondContact O-N 3.34Å; L539-C590 HydrophobicContact CB-CB 4.18Å; L539-L592 HydrophobicContact CD1-CG 4.11Å; L539-L592 HydrophobicContact CD2-CD1 4.12Å; L539-L592 HydrophobicContact CD2-CD2 3.58Å; L539-L592 HydrophobicContact CD2-CG 3.53Å; L539-L592 HydrophobicContact CG-CG 4.34Å
540	T	94.3	Very high	89.5	Confident	40 Å²	40	29.5 Å²	29.5	25%	0.245	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.4	166.3	-49.8	0	0	0	0	110	A494 T495 A496 L546	A494-T540 WeakPolarHBondContact CB-OG1 3.14Å; T495-T540 WeakPolarHBondContact O-CG2 3.04Å; A496-T540 HydrophobicContact CB-CG2 4.16Å; T540-L546 HydrophobicContact CG2-CD2 3.77Å
541	M	92.3	Very high	90.6	Very high	38 Å²	38	25.1 Å²	25.1	19%	0.187	17%	0.168	C	C	.	.			trans	-80.1	155.7	173.6	-64.2	-59.9	-65.9	0	0	111.4	T303 L539 G543 G544 N545 L547	T303-M541 HydrophobicContact CG2-CE 3.39Å; T303-M541 HydrophobicContact CG2-SD 3.88Å; L539-M541 HydrophobicContact CD2-SD 4.08Å; M541-G543 PolarHBondContact O-N 2.88Å; M541-G543 VanDerWaalsContact O-N 3.1Å; M541-G544 PolarHBondContact O-N 3.07Å; M541-N545 WeakPolarHBondContact CB-O 3.42Å; M541-N545 PolarHBondContact N-O 2.95Å; M541-L547 HydrophobicContact CG-CD1 3.95Å; M541-L547 HydrophobicContact CG-CG 3.9Å; M541-L547 HydrophobicContact SD-CD1 3.56Å; M541-L547 VanDerWaalsContact SD-CD1 3.56Å; M541-L547 HydrophobicContact SD-CG 4.15Å
542	A	87.8	Confident	91.2	Very high	112 Å²	112	21.3 Å²	21.3	93%	0.926	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-29.4	175.4	0	0	0	0	0	113.5	G544	A542-G544 PolarHBondContact O-N 2.83Å
543	G	88.6	Confident	91.8	Very high	51 Å²	51	23.3 Å²	23.3	53%	0.526	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-5.9	175.2	0	0	0	0	0	115.2	H497 M541	H497-G543 PolarHBondContact CE1-O 2.9Å; H497-G543 PolarHBondContact NE2-O 2.9Å; M541-G543 PolarHBondContact O-N 2.88Å; M541-G543 VanDerWaalsContact O-N 3.1Å
544	G	92.4	Very high	91.7	Very high	4 Å²	4	30.2 Å²	30.2	4%	0.041	17%	0.171	C	C	.	.	S	Bend	trans	90.6	-2.4	-179	0	0	0	0	0	115.5	A496 M541 A542 T570	A496-G544 VanDerWaalsContact CB-O 3.27Å; A496-G544 WeakPolarHBondContact CB-O 3.23Å; M541-G544 PolarHBondContact O-N 3.07Å; A542-G544 PolarHBondContact O-N 2.83Å; G544-T570 WeakPolarHBondContact O-CG2 3.43Å; G544-T570 PolarHBondContact O-OG1 3.14Å
545	N	94.8	Very high	91.5	Very high	30 Å²	30	30.2 Å²	30.2	16%	0.16	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-75.8	148.8	172.8	-67.3	-4.4	0	0	0	111	M541 E567 Y568	M541-N545 WeakPolarHBondContact CB-O 3.42Å; M541-N545 PolarHBondContact N-O 2.95Å; N545-E567 HydrophobicContact CB-CG 4.04Å; N545-E567 WeakPolarHBondContact CB-OE1 3.31Å; N545-E567 PolarHBondContact ND2-OE1 2.91Å; N545-Y568 WeakPolarHBondContact CA-O 3.22Å
546	L	95.4	Very high	91.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132	178.4	-45.8	-177.6	0	0	0	109.8	A494 Y501 L503 L539 T540 E567 Y568 T570	A494-L546 HydrophobicContact CB-CD1 3.76Å; A494-L546 HydrophobicContact CB-CD2 3.48Å; A494-L546 VanDerWaalsContact CB-CD2 3.48Å; A494-L546 HydrophobicContact CB-CG 4.25Å; Y501-L546 HydrophobicContact CG-CD1 4.31Å; L503-L546 HydrophobicContact CD1-CD1 3.71Å; L503-L546 HydrophobicContact CD2-CD1 4.02Å; L539-L546 WeakPolarHBondContact O-CA 3.39Å; T540-L546 HydrophobicContact CG2-CD2 3.77Å; L546-E567 CarbonylContact O-C 3.55Å; L546-E567 VanDerWaalsContact O-CA 3.28Å; L546-E567 WeakPolarHBondContact O-CA 3.43Å; L546-Y568 HydrophobicContact CD1-CD1 3.99Å; L546-Y568 HydrophobicContact CG-CD1 4.24Å; L546-Y568 PolarHBondContact N-O 2.77Å; L546-Y568 PolarHBondContact O-N 3.4Å; L546-T570 HydrophobicContact CD1-CG2 4.27Å; L546-T570 HydrophobicContact CD2-CG2 4.32Å; L546-T570 HydrophobicContact CG-CG2 3.88Å
547	L	95.4	Very high	90.6	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.016	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.5	172.4	-63.6	-176.6	0	0	0	110.1	V282 F301 T303 M538 L539 M541 F549 L566 E567 I578	V282-L547 HydrophobicContact CG2-CD1 4.37Å; F301-L547 HydrophobicContact CE1-CD1 4.3Å; T303-L547 HydrophobicContact CG2-CD1 4.16Å; M538-L547 CarbonylContact C-O 3.58Å; M538-L547 VanDerWaalsContact CA-O 3.25Å; M538-L547 WeakPolarHBondContact CA-O 3.24Å; M538-L547 WeakPolarHBondContact CG-O 3.08Å; L539-L547 PolarHBondContact N-O 3.39Å; L539-L547 PolarHBondContact O-N 3.34Å; M541-L547 HydrophobicContact CG-CD1 3.95Å; M541-L547 HydrophobicContact CG-CG 3.9Å; M541-L547 HydrophobicContact SD-CD1 3.56Å; M541-L547 VanDerWaalsContact SD-CD1 3.56Å; M541-L547 HydrophobicContact SD-CG 4.15Å; L547-F549 HydrophobicContact CB-CD2 4.4Å; L547-F549 HydrophobicContact CB-CE2 3.55Å; L547-F549 HydrophobicContact CB-CZ 3.91Å; L547-F549 HydrophobicContact CD1-CE2 4.31Å; L547-F549 HydrophobicContact CD1-CZ 3.92Å; L547-L566 CarbonylContact C-O 3.5Å; L547-L566 WeakPolarHBondContact CA-O 3.49Å; L547-E567 HydrophobicContact CD2-CB 3.69Å; L547-E567 HydrophobicContact CD2-CG 3.74Å; L547-I578 HydrophobicContact CD2-CD1 3.6Å
548	V	94.7	Very high	90.2	Very high	1 Å²	1	45 Å²	45	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.7	177.4	174.7	0	0	0	0	108.8	L503 L533 Y536 G537 M538 V565 L566 W575	L503-V548 HydrophobicContact CD2-CG2 4.34Å; L533-V548 HydrophobicContact CD1-CG1 4.05Å; Y536-V548 HydrophobicContact CD2-CG1 3.61Å; Y536-V548 HydrophobicContact CD2-CG2 4.39Å; Y536-V548 HydrophobicContact CE2-CG1 4.34Å; Y536-V548 HydrophobicContact CE2-CG2 4.47Å; Y536-V548 HydrophobicContact CG-CG1 3.81Å; G537-V548 CarbonylContact O-C 3.52Å; G537-V548 WeakPolarHBondContact O-CA 3.25Å; M538-V548 HydrophobicContact CG-CG2 4.25Å; V548-V565 CarbonylContact O-C 3.16Å; V548-V565 WeakPolarHBondContact O-CA 3.43Å; V548-L566 HydrophobicContact CB-CB 4.3Å; V548-L566 PolarHBondContact N-O 2.86Å; V548-L566 PolarHBondContact O-N 3.11Å; V548-W575 HydrophobicContact CG2-CH2 4.06Å; V548-W575 HydrophobicContact CG2-CZ3 3.98Å
549	F	95	Very high	89.9	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.018	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118	-175.1	-61.8	-91.8	0	0	0	110.9	V282 L284 F301 F308 G537 L547 V565	V282-F549 HydrophobicContact CB-CZ 4.21Å; V282-F549 HydrophobicContact CG1-CE2 3.84Å; V282-F549 HydrophobicContact CG1-CZ 3.92Å; V282-F549 HydrophobicContact CG2-CZ 4.37Å; L284-F549 HydrophobicContact CD1-CD1 4.18Å; L284-F549 HydrophobicContact CD1-CE1 4.2Å; L284-F549 HydrophobicContact CD2-CB 3.92Å; L284-F549 HydrophobicContact CD2-CD1 3.87Å; L284-F549 HydrophobicContact CD2-CG 4.01Å; L284-F549 HydrophobicContact CG-CD1 4.39Å; L284-F549 HydrophobicContact CG-CG 4.39Å; F301-F549 HydrophobicContact CB-CE1 4.13Å; F301-F549 AromaticContact CD1-CE1 3.7Å; F301-F549 HydrophobicContact CD1-CE1 3.7Å; F301-F549 AromaticContact CD1-CZ 3.78Å; F301-F549 HydrophobicContact CD1-CZ 3.78Å; F301-F549 HydrophobicContact CD2-CE1 4.5Å; F301-F549 HydrophobicContact CE1-CE1 4.19Å; F301-F549 HydrophobicContact CE1-CZ 4.3Å; F301-F549 AromaticContact CG-CE1 3.86Å; F301-F549 HydrophobicContact CG-CE1 3.86Å; F301-F549 HydrophobicContact CG-CZ 4.33Å; F308-F549 HydrophobicContact CZ-CD1 4.45Å; F308-F549 HydrophobicContact CZ-CE1 4.48Å; G537-F549 PolarHBondContact N-O 3.49Å; G537-F549 PolarHBondContact O-N 2.95Å; L547-F549 HydrophobicContact CB-CD2 4.4Å; L547-F549 HydrophobicContact CB-CE2 3.55Å; L547-F549 HydrophobicContact CB-CZ 3.91Å; L547-F549 HydrophobicContact CD1-CE2 4.31Å; L547-F549 HydrophobicContact CD1-CZ 3.92Å; F549-V565 HydrophobicContact CD1-CB 4.4Å; F549-V565 HydrophobicContact CD1-CG1 3.67Å; F549-V565 HydrophobicContact CD1-CG2 3.94Å; F549-V565 HydrophobicContact CE1-CG1 3.54Å; F549-V565 HydrophobicContact CE1-CG2 4.34Å; F549-V565 HydrophobicContact CG-CG1 4.46Å; F549-V565 HydrophobicContact CZ-CG1 4.24Å
550	G	93.2	Very high	89.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.29	C	S	.	.			trans	60.6	-136.2	171.7	0	0	0	0	0	113	N564	G550-N564 PolarHBondContact N-O 2.88Å
551	G	91.5	Very high	89.5	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.287	C	S	.	.			trans	98.6	-168.1	-174.7	0	0	0	0	0	112.7	F534 N535 T561 V562 L585	F534-G551 CarbonylContact O-C 3.58Å; F534-G551 WeakPolarHBondContact O-CA 3.45Å; N535-G551 WeakPolarHBondContact O-CA 3.46Å; G551-T561 WeakPolarHBondContact O-CA 3.41Å; G551-V562 WeakPolarHBondContact O-CG2 3.49Å; G551-V562 PolarHBondContact O-N 2.98Å; G551-L585 PolarHBondContact N-O 3.46Å
552	R	88.8	Confident	89.5	Confident	21 Å²	21	48.7 Å²	48.7	8%	0.079	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	145.9	175.7	-58.7	-161.4	-63	-90	14.4	110.2	L533 F534 N535 V560 T586	L533-R552 CarbonylContact C-O 3.54Å; L533-R552 WeakPolarHBondContact CA-O 3.46Å; F534-R552 VanDerWaalsContact CD1-O 3.22Å; F534-R552 WeakPolarHBondContact CD1-O 3.44Å; F534-R552 HydrophobicContact CD2-CB 4.19Å; F534-R552 HydrophobicContact CE1-CB 4.04Å; F534-R552 WeakPolarHBondContact CE1-O 3.22Å; F534-R552 HydrophobicContact CE2-CB 3.69Å; F534-R552 HydrophobicContact CE2-CG 4.45Å; F534-R552 HydrophobicContact CZ-CB 3.59Å; F534-R552 PolarHBondContact N-O 2.87Å; F534-R552 PolarHBondContact O-N 3.13Å; N535-R552 PolarHBondContact ND2-NH1 2.82Å; N535-R552 VanDerWaalsContact ND2-NH1 3.13Å; N535-R552 PolarHBondContact ND2-NH2 3.04Å; R552-V560 VanDerWaalsContact CA-O 3.31Å; R552-V560 WeakPolarHBondContact CA-O 3.44Å; R552-T586 HydrophobicContact CG-CG2 4.15Å; R552-T586 WeakPolarHBondContact CG-OG1 3.37Å; R552-T586 PolarHBondContact NH1-OG1 3.1Å; R552-T586 VanDerWaalsContact NH1-OG1 3.07Å
553	R	87.1	Confident	89.8	Confident	70 Å²	70	49 Å²	49	26%	0.264	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	159.9	168.8	68.3	-178	-178.9	93.1	2.4	110	G532 L533 S555 V560 V562	G532-R553 VanDerWaalsContact O-CB 3.31Å; G532-R553 WeakPolarHBondContact O-CB 3.29Å; L533-R553 HydrophobicContact CD2-CB 4.1Å; R553-S555 PolarHBondContact NH1-OG 2.9Å; R553-V560 PolarHBondContact N-O 2.98Å; R553-V560 PolarHBondContact O-N 3.07Å; R553-V562 HydrophobicContact CG-CG1 3.71Å
554	W	84.2	Confident	90	Very high	154 Å²	154	48.9 Å²	48.9	58%	0.583	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	131.2	166.8	-144.8	-104.1	0	0	0	109.3	G557 Q558 Q559	W554-G557 VanDerWaalsContact CZ2-O 3.32Å; W554-G557 WeakPolarHBondContact CZ2-O 3.38Å; W554-Q558 WeakPolarHBondContact CA-O 3.43Å; W554-Q559 HydrophobicContact CE3-CG 3.51Å; W554-Q559 HydrophobicContact CH2-CG 3.99Å; W554-Q559 HydrophobicContact CZ3-CB 4.49Å; W554-Q559 HydrophobicContact CZ3-CG 3.16Å
555	S	83.1	Confident	90.2	Very high	25 Å²	25	48.7 Å²	48.7	18%	0.175	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	126.5	172.4	-159.4	0	0	0	0	107.9	R553 G557 Q558	R553-S555 PolarHBondContact NH1-OG 2.9Å; S555-G557 PolarHBondContact O-N 2.65Å; S555-G557 VanDerWaalsContact O-N 3.11Å; S555-Q558 PolarHBondContact N-O 3.37Å; S555-Q558 PolarHBondContact O-N 2.65Å; S555-Q558 VanDerWaalsContact O-O 3.09Å
556	D	82.4	Confident	90.2	Very high	160 Å²	160	48.1 Å²	48.1	86%	0.856	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	38.5	173.8	-48.3	-55.4	0	0	0	114.1	Q558	D556-Q558 VanDerWaalsContact C-N 3.31Å; D556-Q558 PolarHBondContact O-N 2.98Å
557	G	80.4	Confident	90.2	Very high	53 Å²	53	49 Å²	49	55%	0.546	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	2.5	-179.6	0	0	0	0	0	115.2	W554 S555	W554-G557 VanDerWaalsContact CZ2-O 3.32Å; W554-G557 WeakPolarHBondContact CZ2-O 3.38Å; S555-G557 PolarHBondContact O-N 2.65Å; S555-G557 VanDerWaalsContact O-N 3.11Å
558	Q	84.6	Confident	90.1	Very high	142 Å²	142	48.9 Å²	48.9	66%	0.664	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124	153	-178.6	-62.7	-167.8	-9.1	0	0	113	W554 S555 D556	W554-Q558 WeakPolarHBondContact CA-O 3.43Å; S555-Q558 PolarHBondContact N-O 3.37Å; S555-Q558 PolarHBondContact O-N 2.65Å; S555-Q558 VanDerWaalsContact O-O 3.09Å; D556-Q558 VanDerWaalsContact C-N 3.31Å; D556-Q558 PolarHBondContact O-N 2.98Å
559	Q	86.4	Confident	90.2	Very high	97 Å²	97	49.9 Å²	49.9	45%	0.453	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	121	170.6	-63.6	-172.6	28.4	0	0	109.8	F534 W554	F534-Q559 HydrophobicContact CZ-CG 4.03Å; W554-Q559 HydrophobicContact CE3-CG 3.51Å; W554-Q559 HydrophobicContact CH2-CG 3.99Å; W554-Q559 HydrophobicContact CZ3-CB 4.49Å; W554-Q559 HydrophobicContact CZ3-CG 3.16Å
560	V	89.8	Confident	90.1	Very high	58 Å²	58	50.3 Å²	50.3	35%	0.352	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	125	178.3	-176.7	0	0	0	0	109.5	R552 R553	R552-V560 VanDerWaalsContact CA-O 3.31Å; R552-V560 WeakPolarHBondContact CA-O 3.44Å; R553-V560 PolarHBondContact N-O 2.98Å; R553-V560 PolarHBondContact O-N 3.07Å
561	T	91.3	Very high	90.1	Very high	28 Å²	28	57.8 Å²	57.8	17%	0.172	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	130.3	170.5	-53.5	0	0	0	0	109.5	V289 G551 P584 L585 T586	V289-T561 PolarHBondContact O-OG1 2.95Å; G551-T561 WeakPolarHBondContact O-CA 3.41Å; T561-P584 HydrophobicContact CG2-CB 3.59Å; T561-L585 VanDerWaalsContact CG2-N 3.32Å; T561-T586 HydrophobicContact CG2-CG2 4.06Å
562	V	92.5	Very high	90.2	Very high	10 Å²	10	64.3 Å²	64.3	6%	0.061	31%	0.313	C	S	.	.			trans	-108.4	167.4	-174.1	-61.2	0	0	0	0	112.9	L533 G551 R553 L585	L533-V562 HydrophobicContact CD2-CG2 3.6Å; G551-V562 WeakPolarHBondContact O-CG2 3.49Å; G551-V562 PolarHBondContact O-N 2.98Å; R553-V562 HydrophobicContact CG-CG1 3.71Å; V562-L585 PolarHBondContact O-N 3.29Å
563	R	94.6	Very high	90.5	Very high	117 Å²	117	65.6 Å²	65.6	44%	0.442	32%	0.321	S	S	.	.			trans	-109.4	-9.5	179	-60.4	-175.6	-172.9	-172.8	-0.6	113.4	V565 Q580 L581 P584	R563-V565 PolarHBondContact O-N 2.88Å; R563-Q580 HydrophobicContact CB-CB 4.49Å; R563-Q580 CarbonylContact O-C 3.56Å; R563-Q580 WeakPolarHBondContact O-CA 3.49Å; R563-L581 HydrophobicContact CB-CB 4.25Å; R563-L581 WeakPolarHBondContact O-CB 3.2Å; R563-L581 WeakPolarHBondContact O-CG 3.25Å; R563-L581 PolarHBondContact O-N 3.22Å; R563-P584 HydrophobicContact CG-CB 4.29Å; R563-P584 HydrophobicContact CG-CG 3.99Å; R563-P584 VanDerWaalsContact NE-CD 3.34Å
564	N	93.3	Very high	90.8	Very high	49 Å²	49	67.2 Å²	67.2	26%	0.262	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	138.8	-169.4	-52.4	74.1	0	0	0	110.9	G550 L566 E577	G550-N564 PolarHBondContact N-O 2.88Å; N564-L566 HydrophobicContact CB-CD2 4.09Å; N564-L566 HydrophobicContact CB-CG 4.32Å; N564-E577 VanDerWaalsContact ND2-CD 3.27Å; N564-E577 PolarHBondContact ND2-OE1 3.25Å; N564-E577 PolarHBondContact ND2-OE2 2.88Å
565	V	95.4	Very high	91.2	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	111.3	165.8	-174.1	0	0	0	0	107	F308 V548 F549 R563 I578 A579 L581	F308-V565 HydrophobicContact CE2-CG2 4.17Å; F308-V565 HydrophobicContact CZ-CG2 3.74Å; V548-V565 CarbonylContact O-C 3.16Å; V548-V565 WeakPolarHBondContact O-CA 3.43Å; F549-V565 HydrophobicContact CD1-CB 4.4Å; F549-V565 HydrophobicContact CD1-CG1 3.67Å; F549-V565 HydrophobicContact CD1-CG2 3.94Å; F549-V565 HydrophobicContact CE1-CG1 3.54Å; F549-V565 HydrophobicContact CE1-CG2 4.34Å; F549-V565 HydrophobicContact CG-CG1 4.46Å; F549-V565 HydrophobicContact CZ-CG1 4.24Å; R563-V565 PolarHBondContact O-N 2.88Å; V565-I578 HydrophobicContact CB-CG1 4.24Å; V565-I578 HydrophobicContact CG1-CD1 4.05Å; V565-I578 HydrophobicContact CG1-CG1 3.82Å; V565-I578 PolarHBondContact O-N 3.2Å; V565-A579 HydrophobicContact CB-CB 4.07Å; V565-A579 WeakPolarHBondContact CB-O 3.33Å; V565-A579 HydrophobicContact CG2-CB 4.13Å; V565-A579 PolarHBondContact N-O 3.44Å; V565-L581 HydrophobicContact CG2-CG 4.11Å
566	L	94.6	Very high	91.7	Very high	19 Å²	19	66.6 Å²	66.6	10%	0.099	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	143.3	-176.6	-54.1	177.4	0	0	0	109.8	L529 L533 L547 V548 N564 W575 R576 E577	L529-L566 HydrophobicContact CD1-CD1 3.71Å; L529-L566 HydrophobicContact CD2-CD1 3.88Å; L529-L566 HydrophobicContact CG-CD1 4.45Å; L533-L566 HydrophobicContact CD1-CD1 3.82Å; L547-L566 CarbonylContact C-O 3.5Å; L547-L566 WeakPolarHBondContact CA-O 3.49Å; V548-L566 HydrophobicContact CB-CB 4.3Å; V548-L566 PolarHBondContact N-O 2.86Å; V548-L566 PolarHBondContact O-N 3.11Å; N564-L566 HydrophobicContact CB-CD2 4.09Å; N564-L566 HydrophobicContact CB-CG 4.32Å; L566-W575 HydrophobicContact CB-CE3 3.97Å; L566-W575 HydrophobicContact CB-CZ3 4.03Å; L566-W575 HydrophobicContact CD1-CE3 4.42Å; L566-R576 CarbonylContact C-O 3.57Å; L566-R576 WeakPolarHBondContact CA-O 3.35Å; L566-E577 HydrophobicContact CD2-CB 3.9Å; L566-E577 HydrophobicContact CD2-CG 4.25Å
567	E	95.2	Very high	92.3	Very high	19 Å²	19	63.3 Å²	63.3	9%	0.089	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.9	168.9	-176.5	177.9	-160.4	0	0	109.4	N545 L546 L547 W575 R576 I578	N545-E567 HydrophobicContact CB-CG 4.04Å; N545-E567 WeakPolarHBondContact CB-OE1 3.31Å; N545-E567 PolarHBondContact ND2-OE1 2.91Å; L546-E567 CarbonylContact O-C 3.55Å; L546-E567 VanDerWaalsContact O-CA 3.28Å; L546-E567 WeakPolarHBondContact O-CA 3.43Å; L547-E567 HydrophobicContact CD2-CB 3.69Å; L547-E567 HydrophobicContact CD2-CG 3.74Å; E567-W575 WeakPolarHBondContact O-CA 3.39Å; E567-R576 HydrophobicContact CB-CG 4.03Å; E567-R576 VanDerWaalsContact CD-NH2 3.32Å; E567-R576 PolarHBondContact N-O 2.96Å; E567-R576 PolarHBondContact O-N 3.48Å; E567-R576 IonicContact OE1-NH2 3.28Å; E567-R576 PolarHBondContact OE1-NH2 2.77Å; E567-R576 IonicContact OE2-CZ 3.96Å; E567-R576 IonicContact OE2-NE 2.86Å; E567-R576 PolarHBondContact OE2-NE 3.33Å; E567-R576 IonicContact OE2-NH2 3.36Å; E567-R576 PolarHBondContact OE2-NH2 3.37Å; E567-I578 HydrophobicContact CB-CD1 4.31Å; E567-I578 HydrophobicContact CB-CG1 4.49Å; E567-I578 HydrophobicContact CB-CG2 3.71Å; E567-I578 WeakPolarHBondContact OE2-CG2 3.46Å
568	Y	95.1	Very high	93	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	116.8	172.1	-178.5	-112.7	0	0	0	109.8	Y501 I513 L526 N545 L546 T570 D573 Q574 W575	Y501-Y568 HydrophobicContact CD1-CE1 4.16Å; Y501-Y568 HydrophobicContact CE1-CE1 4.15Å; I513-Y568 HydrophobicContact CD1-CD1 4.42Å; I513-Y568 HydrophobicContact CD1-CD2 4.26Å; I513-Y568 HydrophobicContact CD1-CE1 3.72Å; I513-Y568 HydrophobicContact CD1-CE2 3.54Å; I513-Y568 VanDerWaalsContact CD1-OH 3.27Å; I513-Y568 WeakPolarHBondContact CD1-OH 3.43Å; L526-Y568 WeakPolarHBondContact CD1-OH 3.47Å; N545-Y568 WeakPolarHBondContact CA-O 3.22Å; L546-Y568 HydrophobicContact CD1-CD1 3.99Å; L546-Y568 HydrophobicContact CG-CD1 4.24Å; L546-Y568 PolarHBondContact N-O 2.77Å; L546-Y568 PolarHBondContact O-N 3.4Å; Y568-T570 HydrophobicContact CD1-CG2 3.79Å; Y568-T570 HydrophobicContact CE1-CG2 3.89Å; Y568-T570 PolarHBondContact O-N 2.77Å; Y568-D573 WeakPolarHBondContact CE2-OD1 3.37Å; Y568-D573 VanDerWaalsContact CZ-OD1 3.32Å; Y568-D573 PolarHBondContact OH-OD1 2.83Å; Y568-Q574 WeakPolarHBondContact CA-O 3.5Å; Y568-W575 AromaticContact CD2-CD1 3.75Å; Y568-W575 AromaticContact CD2-CD2 3.67Å; Y568-W575 HydrophobicContact CD2-CD2 3.67Å; Y568-W575 AromaticContact CD2-CE2 3.37Å; Y568-W575 HydrophobicContact CD2-CE3 4.34Å; Y568-W575 AromaticContact CD2-CG 3.91Å; Y568-W575 HydrophobicContact CD2-CG 3.91Å; Y568-W575 HydrophobicContact CG-CZ2 3.93Å; Y568-W575 HydrophobicContact CD2-CH2 4.49Å; Y568-W575 AromaticContact CG-CZ2 3.93Å; Y568-W575 HydrophobicContact CG-CH2 4.24Å; Y568-W575 HydrophobicContact CG-CE3 4.48Å; Y568-W575 AromaticContact CG-CE2 3.92Å; Y568-W575 HydrophobicContact CG-CD2 4.22Å; Y568-W575 AromaticContact CE2-NE1 3.67Å; Y568-W575 AromaticContact CD2-NE1 3.41Å; Y568-W575 HydrophobicContact CD2-CZ2 3.83Å; Y568-W575 AromaticContact CD2-CZ2 3.83Å
569	D	95.3	Very high	93.5	Very high	22 Å²	22	56 Å²	56	12%	0.118	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	104.2	172.7	-175	-34	0	0	0	108.5	K571 K572 D573 Q574	D569-K571 PolarHBondContact O-N 2.89Å; D569-K571 WeakPolarHBondContact OD1-CB 3.4Å; D569-K571 PolarHBondContact OD1-N 3.31Å; D569-K572 HydrophobicContact CB-CB 4.23Å; D569-K572 PolarHBondContact O-N 3.04Å; D569-K572 PolarHBondContact OD1-N 2.68Å; D569-K572 WeakPolarHBondContact OD2-CD 3.49Å; D569-D573 WeakPolarHBondContact O-CA 3.27Å; D569-D573 PolarHBondContact O-N 3.25Å; D569-Q574 PolarHBondContact N-O 2.98Å; D569-Q574 PolarHBondContact O-N 3.36Å
570	T	94.3	Very high	93.9	Very high	12 Å²	12	57 Å²	57	7%	0.074	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.8	-176.2	51	0	0	0	0	113.5	A496 H497 Y501 G544 L546 Y568	A496-T570 HydrophobicContact CB-CG2 4.24Å; H497-T570 PolarHBondContact CD2-OG1 3Å; Y501-T570 HydrophobicContact CD1-CG2 4.39Å; Y501-T570 HydrophobicContact CE1-CG2 3.91Å; Y501-T570 HydrophobicContact CE2-CG2 4.1Å; G544-T570 WeakPolarHBondContact O-CG2 3.43Å; G544-T570 PolarHBondContact O-OG1 3.14Å; L546-T570 HydrophobicContact CD1-CG2 4.27Å; L546-T570 HydrophobicContact CD2-CG2 4.32Å; L546-T570 HydrophobicContact CG-CG2 3.88Å; Y568-T570 HydrophobicContact CD1-CG2 3.79Å; Y568-T570 HydrophobicContact CE1-CG2 3.89Å; Y568-T570 PolarHBondContact O-N 2.77Å
571	K	93.3	Very high	94.1	Very high	157 Å²	157	54.4 Å²	54.4	68%	0.683	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-36.8	176.6	-64	-178.3	-179	178.8	0	111.7	H497 D569	H497-K571 VanDerWaalsContact CE1-CE 3.49Å; H497-K571 WeakPolarHBondContact CE1-CE 3.41Å; H497-K571 WeakPolarHBondContact NE2-CE 3.09Å; D569-K571 PolarHBondContact O-N 2.89Å; D569-K571 WeakPolarHBondContact OD1-CB 3.4Å; D569-K571 PolarHBondContact OD1-N 3.31Å
572	K	93.8	Very high	94.2	Very high	137 Å²	137	56.9 Å²	56.9	60%	0.596	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-10.3	-177.6	-63.4	-176.1	-173.8	172.8	0	114.1	D569 Q574	D569-K572 HydrophobicContact CB-CB 4.23Å; D569-K572 PolarHBondContact O-N 3.04Å; D569-K572 PolarHBondContact OD1-N 2.68Å; D569-K572 WeakPolarHBondContact OD2-CD 3.49Å; K572-Q574 HydrophobicContact CB-CB 4.35Å; K572-Q574 HydrophobicContact CB-CG 4.24Å; K572-Q574 WeakPolarHBondContact O-CG 3.44Å
573	D	93.6	Very high	94.1	Very high	48 Å²	48	59.2 Å²	59.2	26%	0.257	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	53	-172.9	-171.5	18.9	0	0	0	111.9	K527 Y568 D569	K527-D573 VanDerWaalsContact CB-CG 3.47Å; K527-D573 WeakPolarHBondContact CB-OD1 3.32Å; K527-D573 WeakPolarHBondContact CB-OD2 3.38Å; K527-D573 VanDerWaalsContact CD-O 3.26Å; K527-D573 WeakPolarHBondContact CD-O 3.49Å; K527-D573 PolarHBondContact N-OD1 2.82Å; K527-D573 PolarHBondContact N-OD2 2.66Å; Y568-D573 WeakPolarHBondContact CE2-OD1 3.37Å; Y568-D573 VanDerWaalsContact CZ-OD1 3.32Å; Y568-D573 PolarHBondContact OH-OD1 2.83Å; D569-D573 WeakPolarHBondContact O-CA 3.27Å; D569-D573 PolarHBondContact O-N 3.25Å
574	Q	93.6	Very high	94	Very high	105 Å²	105	54.9 Å²	54.9	49%	0.491	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	137.9	-173.7	-73.5	178.6	12.9	0	0	112.7	Y568 D569 K572	Y568-Q574 WeakPolarHBondContact CA-O 3.5Å; D569-Q574 PolarHBondContact N-O 2.98Å; D569-Q574 PolarHBondContact O-N 3.36Å; K572-Q574 HydrophobicContact CB-CB 4.35Å; K572-Q574 HydrophobicContact CB-CG 4.24Å; K572-Q574 WeakPolarHBondContact O-CG 3.44Å
575	W	92.6	Very high	93.9	Very high	45 Å²	45	52.9 Å²	52.9	17%	0.17	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	140	173.2	-69.9	95.3	0	0	0	111	L503 I513 K527 L529 V548 L566 E567 Y568	L503-W575 HydrophobicContact CD2-CH2 3.75Å; L503-W575 HydrophobicContact CD2-CZ2 4.17Å; I513-W575 HydrophobicContact CD1-CZ2 4.38Å; I513-W575 HydrophobicContact CG2-CZ2 4.3Å; K527-W575 PolarHBondContact O-NE1 3.49Å; L529-W575 HydrophobicContact CB-CZ2 4.43Å; L529-W575 HydrophobicContact CD1-CB 4.44Å; L529-W575 HydrophobicContact CD1-CD2 3.86Å; L529-W575 HydrophobicContact CD1-CE3 4.08Å; L529-W575 HydrophobicContact CD1-CG 4.02Å; V548-W575 HydrophobicContact CG2-CH2 4.06Å; V548-W575 HydrophobicContact CG2-CZ3 3.98Å; L566-W575 HydrophobicContact CB-CE3 3.97Å; L566-W575 HydrophobicContact CB-CZ3 4.03Å; L566-W575 HydrophobicContact CD1-CE3 4.42Å; E567-W575 WeakPolarHBondContact O-CA 3.39Å; Y568-W575 AromaticContact CD2-CD1 3.75Å; Y568-W575 AromaticContact CD2-CD2 3.67Å; Y568-W575 HydrophobicContact CD2-CD2 3.67Å; Y568-W575 AromaticContact CD2-CE2 3.37Å; Y568-W575 HydrophobicContact CD2-CE3 4.34Å; Y568-W575 AromaticContact CD2-CG 3.91Å; Y568-W575 HydrophobicContact CD2-CG 3.91Å; Y568-W575 HydrophobicContact CG-CZ2 3.93Å; Y568-W575 HydrophobicContact CD2-CH2 4.49Å; Y568-W575 AromaticContact CG-CZ2 3.93Å; Y568-W575 HydrophobicContact CG-CH2 4.24Å; Y568-W575 HydrophobicContact CG-CE3 4.48Å; Y568-W575 AromaticContact CG-CE2 3.92Å; Y568-W575 HydrophobicContact CG-CD2 4.22Å; Y568-W575 AromaticContact CE2-NE1 3.67Å; Y568-W575 AromaticContact CD2-NE1 3.41Å; Y568-W575 HydrophobicContact CD2-CZ2 3.83Å; Y568-W575 AromaticContact CD2-CZ2 3.83Å
576	R	94	Very high	93.7	Very high	121 Å²	121	53 Å²	53	46%	0.457	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	143.4	169.1	62.6	179.7	-175.5	-165	-2.4	111	L566 E567 I578	L566-R576 CarbonylContact C-O 3.57Å; L566-R576 WeakPolarHBondContact CA-O 3.35Å; E567-R576 HydrophobicContact CB-CG 4.03Å; E567-R576 VanDerWaalsContact CD-NH2 3.32Å; E567-R576 PolarHBondContact N-O 2.96Å; E567-R576 PolarHBondContact O-N 3.48Å; E567-R576 IonicContact OE1-NH2 3.28Å; E567-R576 PolarHBondContact OE1-NH2 2.77Å; E567-R576 IonicContact OE2-CZ 3.96Å; E567-R576 IonicContact OE2-NE 2.86Å; E567-R576 PolarHBondContact OE2-NE 3.33Å; E567-R576 IonicContact OE2-NH2 3.36Å; E567-R576 PolarHBondContact OE2-NH2 3.37Å; R576-I578 HydrophobicContact CG-CG2 3.85Å
577	E	94.7	Very high	93.5	Very high	91 Å²	91	53.4 Å²	53.4	43%	0.425	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	128.3	166.6	-174.3	170.6	160.6	0	0	109.1	N564 L566 Q580	N564-E577 VanDerWaalsContact ND2-CD 3.27Å; N564-E577 PolarHBondContact ND2-OE1 3.25Å; N564-E577 PolarHBondContact ND2-OE2 2.88Å; L566-E577 HydrophobicContact CD2-CB 3.9Å; L566-E577 HydrophobicContact CD2-CG 4.25Å; E577-Q580 VanDerWaalsContact OE1-CG 3.23Å; E577-Q580 WeakPolarHBondContact OE1-CG 3.08Å; E577-Q580 PolarHBondContact OE1-NE2 3.35Å
578	I	95.1	Very high	93.3	Very high	21 Å²	21	52.6 Å²	52.6	11%	0.108	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-22.2	-175.9	61.9	163.6	0	0	0	113.6	F301 L547 V565 E567 R576	F301-I578 HydrophobicContact CE1-CD1 4.26Å; F301-I578 HydrophobicContact CZ-CD1 4.08Å; L547-I578 HydrophobicContact CD2-CD1 3.6Å; V565-I578 HydrophobicContact CB-CG1 4.24Å; V565-I578 HydrophobicContact CG1-CD1 4.05Å; V565-I578 HydrophobicContact CG1-CG1 3.82Å; V565-I578 PolarHBondContact O-N 3.2Å; E567-I578 HydrophobicContact CB-CD1 4.31Å; E567-I578 HydrophobicContact CB-CG1 4.49Å; E567-I578 HydrophobicContact CB-CG2 3.71Å; E567-I578 WeakPolarHBondContact OE2-CG2 3.46Å; R576-I578 HydrophobicContact CG-CG2 3.85Å
579	A	95	Very high	93.2	Very high	19 Å²	19	54.5 Å²	54.5	16%	0.157	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	174.8	-178.1	0	0	0	0	0	110.8	F301 F308 V565	F301-A579 HydrophobicContact CE2-CB 3.94Å; F301-A579 HydrophobicContact CZ-CB 4.25Å; F308-A579 HydrophobicContact CE2-CB 4.46Å; V565-A579 HydrophobicContact CB-CB 4.07Å; V565-A579 WeakPolarHBondContact CB-O 3.33Å; V565-A579 HydrophobicContact CG2-CB 4.13Å; V565-A579 PolarHBondContact N-O 3.44Å
580	Q	95.3	Very high	93.2	Very high	119 Å²	119	54 Å²	54	56%	0.556	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.5	138.6	170.1	-67.5	-173.5	-3.1	0	0	110.6	F308 R563 E577	F308-Q580 VanDerWaalsContact CE2-O 3.27Å; F308-Q580 WeakPolarHBondContact CE2-O 3.47Å; R563-Q580 HydrophobicContact CB-CB 4.49Å; R563-Q580 CarbonylContact O-C 3.56Å; R563-Q580 WeakPolarHBondContact O-CA 3.49Å; E577-Q580 VanDerWaalsContact OE1-CG 3.23Å; E577-Q580 WeakPolarHBondContact OE1-CG 3.08Å; E577-Q580 PolarHBondContact OE1-NE2 3.35Å
581	L	94.1	Very high	93.2	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	26%	0.262	C	S	.	.			trans	-61.2	145.4	171.7	-69.9	161.4	0	0	0	110.1	L284 F308 R563 V565 R583 L585	L284-L581 HydrophobicContact CD2-CD2 3.53Å; F308-L581 HydrophobicContact CD1-CD2 4.37Å; F308-L581 HydrophobicContact CE1-CD2 3.47Å; F308-L581 VanDerWaalsContact CE1-CD2 3.47Å; F308-L581 HydrophobicContact CE2-CD2 4.38Å; F308-L581 HydrophobicContact CZ-CD2 3.47Å; F308-L581 VanDerWaalsContact CZ-CD2 3.47Å; F308-L581 HydrophobicContact CZ-CG 4.13Å; R563-L581 HydrophobicContact CB-CB 4.25Å; R563-L581 WeakPolarHBondContact O-CB 3.2Å; R563-L581 WeakPolarHBondContact O-CG 3.25Å; R563-L581 PolarHBondContact O-N 3.22Å; V565-L581 HydrophobicContact CG2-CG 4.11Å; L581-R583 PolarHBondContact O-N 2.71Å; L581-R583 VanDerWaalsContact O-N 3.08Å; L581-R583 WeakPolarHBondContact CB-O 3.37Å; L581-R583 VanDerWaalsContact CB-O 3.24Å; L581-L585 HydrophobicContact CD1-CB 4Å
582	P	92.7	Very high	93.1	Very high	79 Å²	79	48.9 Å²	48.9	51%	0.513	24%	0.242	S	C	.	.	S	Bend	trans	-56.9	-27.4	176.3	-24.9	34	0	0	0	113.3	F308	F308-P582 HydrophobicContact CB-CG 3.83Å; F308-P582 HydrophobicContact CD2-CG 4.27Å; F308-P582 HydrophobicContact CG-CG 4.02Å
583	R	90.6	Very high	93	Very high	60 Å²	60	42.3 Å²	42.3	23%	0.226	21%	0.214	C	C	.	.	S	Bend	trans	-148.8	159.9	179.4	61.9	-178.3	176.8	174.5	2	110.7	E295 L581 L585	E295-R583 VanDerWaalsContact CD-CZ 3.5Å; E295-R583 VanDerWaalsContact CD-NH2 3.3Å; E295-R583 IonicContact OE1-CZ 2.77Å; E295-R583 IonicContact OE1-NH1 3.6Å; E295-R583 PolarHBondContact OE1-NH1 3.23Å; E295-R583 IonicContact OE1-NH2 3.7Å; E295-R583 IonicContact OE2-CZ 3.44Å; E295-R583 IonicContact OE2-NH1 2.92Å; E295-R583 PolarHBondContact OE2-NH1 3.09Å; E295-R583 IonicContact OE2-NH2 3.23Å; E295-R583 PolarHBondContact OE2-NH2 3.36Å; L581-R583 PolarHBondContact O-N 2.71Å; L581-R583 VanDerWaalsContact O-N 3.08Å; L581-R583 WeakPolarHBondContact CB-O 3.37Å; L581-R583 VanDerWaalsContact CB-O 3.24Å; R583-L585 PolarHBondContact O-N 3.18Å
584	P	92.1	Very high	92.6	Very high	26 Å²	26	41.7 Å²	41.7	17%	0.169	21%	0.212	C	C	.	.			trans	-62.2	136.4	174.4	-17.3	31.9	0	0	0	110.4	T561 R563	T561-P584 HydrophobicContact CG2-CB 3.59Å; R563-P584 HydrophobicContact CG-CB 4.29Å; R563-P584 HydrophobicContact CG-CG 3.99Å; R563-P584 VanDerWaalsContact NE-CD 3.34Å
585	L	92.1	Very high	92.1	Very high	6 Å²	6	37.2 Å²	37.2	3%	0.031	19%	0.191	C	C	.	.			trans	-141.8	134.1	-175.3	-164.4	70.6	0	0	0	111.2	L284 G551 T561 V562 L581 R583 T588	L284-L585 HydrophobicContact CD2-CD2 4.02Å; G551-L585 PolarHBondContact N-O 3.46Å; T561-L585 VanDerWaalsContact CG2-N 3.32Å; V562-L585 PolarHBondContact O-N 3.29Å; L581-L585 HydrophobicContact CD1-CB 4Å; R583-L585 PolarHBondContact O-N 3.18Å; L585-T588 HydrophobicContact CD2-CG2 3.97Å; L585-T588 WeakPolarHBondContact CD2-OG1 2.86Å; L585-T588 WeakPolarHBondContact CG-OG1 3.11Å
586	T	91.7	Very high	91.2	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.012	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-140.1	152.8	174.9	-177.8	0	0	0	0	111.3	G287 G288 N535 R552 T561 T588	G287-T586 CarbonylContact C-O 3.46Å; G287-T586 WeakPolarHBondContact CA-O 3.36Å; G288-T586 PolarHBondContact N-O 2.89Å; G288-T586 WeakPolarHBondContact O-CG2 3.42Å; G288-T586 PolarHBondContact O-N 2.76Å; N535-T586 VanDerWaalsContact CB-OG1 3.25Å; N535-T586 WeakPolarHBondContact CB-OG1 3.26Å; N535-T586 PolarHBondContact O-OG1 3.4Å; N535-T586 VanDerWaalsContact O-OG1 3.11Å; R552-T586 HydrophobicContact CG-CG2 4.15Å; R552-T586 WeakPolarHBondContact CG-OG1 3.37Å; R552-T586 PolarHBondContact NH1-OG1 3.1Å; R552-T586 VanDerWaalsContact NH1-OG1 3.07Å; T561-T586 HydrophobicContact CG2-CG2 4.06Å; T586-T588 VanDerWaalsContact C-N 3.35Å
587	G	89	Confident	89.6	Confident	28 Å²	28	38.5 Å²	38.5	29%	0.289	22%	0.215	S	C	.	.	S	Bend	trans	76.4	24.1	179.1	0	0	0	0	0	113.4	G287 N535	G287-G587 WeakPolarHBondContact CA-O 3.22Å; G287-G587 PolarHBondContact N-O 3.22Å; N535-G587 PolarHBondContact O-N 2.87Å
588	T	91.5	Very high	89.4	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.012	20%	0.204	C	C	.	.			trans	-92	138.8	-178.1	-63.3	0	0	0	0	110.9	L284 G286 R492 G537 L585 T586	L284-T588 HydrophobicContact CB-CG2 3.64Å; L284-T588 HydrophobicContact CD2-CG2 4.38Å; L284-T588 HydrophobicContact CG-CG2 4.13Å; G286-T588 PolarHBondContact O-OG1 2.79Å; R492-T588 PolarHBondContact NH2-O 3.36Å; R492-T588 VanDerWaalsContact NH2-O 3.08Å; G537-T588 WeakPolarHBondContact CA-O 3.17Å; L585-T588 HydrophobicContact CD2-CG2 3.97Å; L585-T588 WeakPolarHBondContact CD2-OG1 2.86Å; L585-T588 WeakPolarHBondContact CG-OG1 3.11Å; T586-T588 VanDerWaalsContact C-N 3.35Å
589	E	93.4	Very high	89.1	Confident	40 Å²	40	36.6 Å²	36.6	19%	0.187	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	148.1	168.2	-68.7	-56.1	128.2	0	0	110.7	V285 A322 V324 R492	V285-E589 PolarHBondContact N-O 3.3Å; V285-E589 PolarHBondContact O-N 3.06Å; V285-E589 VanDerWaalsContact O-N 3.08Å; A322-E589 WeakPolarHBondContact O-CG 3.32Å; V324-E589 HydrophobicContact CB-CB 3.73Å; V324-E589 HydrophobicContact CB-CG 4.38Å; V324-E589 HydrophobicContact CG2-CB 3.61Å; V324-E589 HydrophobicContact CG2-CG 4.07Å; R492-E589 IonicContact CZ-OE1 2.69Å; R492-E589 IonicContact CZ-OE2 2.65Å; R492-E589 IonicContact NH1-OE1 3.4Å; R492-E589 PolarHBondContact NH1-OE1 2.81Å; R492-E589 IonicContact NH1-OE2 3.84Å; R492-E589 PolarHBondContact NH1-OE2 3.34Å; R492-E589 IonicContact NH2-OE1 3.57Å; R492-E589 PolarHBondContact NH2-OE1 3.32Å; R492-E589 IonicContact NH2-OE2 2.98Å; R492-E589 PolarHBondContact NH2-OE2 3.35Å
590	C	94.6	Very high	88.7	Confident	11 Å²	11	37.6 Å²	37.6	7%	0.074	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.2	-179	-63.5	0	0	0	0	111.5	V282 L283 G537 L539	V282-C590 HydrophobicContact CG1-CB 4.17Å; L283-C590 VanDerWaalsContact O-CA 3.25Å; L283-C590 WeakPolarHBondContact O-CA 3.36Å; G537-C590 VanDerWaalsContact CA-SG 3.59Å; L539-C590 HydrophobicContact CB-CB 4.18Å
591	T	94.1	Very high	88.3	Confident	11 Å²	11	32.8 Å²	32.8	7%	0.067	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	159.1	170	-167.8	0	0	0	0	111.2	L283 V324 S326 L331	L283-T591 HydrophobicContact CB-CG2 4.38Å; L283-T591 PolarHBondContact N-O 3.26Å; L283-T591 PolarHBondContact O-N 2.77Å; L283-T591 VanDerWaalsContact O-N 3.13Å; V324-T591 HydrophobicContact CG1-CG2 3.81Å; S326-T591 PolarHBondContact N-OG1 3.39Å; S326-T591 PolarHBondContact OG-OG1 3.14Å; L331-T591 HydrophobicContact CD1-CG2 3.47Å; L331-T591 VanDerWaalsContact CD1-CG2 3.47Å
592	L	92.1	Very high	88	Confident	51 Å²	51	34.6 Å²	34.6	27%	0.267	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	130.2	170.3	-72.9	170	0	0	0	109.9	V282 S326 L539	V282-L592 HydrophobicContact CG2-CD2 3.92Å; S326-L592 WeakPolarHBondContact CB-O 3.37Å; S326-L592 PolarHBondContact OG-O 2.71Å; L539-L592 HydrophobicContact CD1-CG 4.11Å; L539-L592 HydrophobicContact CD2-CD1 4.12Å; L539-L592 HydrophobicContact CD2-CD2 3.58Å; L539-L592 HydrophobicContact CD2-CG 3.53Å; L539-L592 HydrophobicContact CG-CG 4.34Å
593	L	90.3	Very high	87.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.182	C	C	.	.			trans	-144.9	126.7	172	-167.6	76.4	0	0	0	109.7	H281 L283 L331 Y358 P360 L595	H281-L593 PolarHBondContact O-N 3.4Å; L283-L593 HydrophobicContact CD1-CB 3.51Å; L283-L593 HydrophobicContact CD1-CD2 3.54Å; L283-L593 HydrophobicContact CD1-CG 4.17Å; L283-L593 HydrophobicContact CG-CB 3.94Å; L331-L593 HydrophobicContact CB-CD1 4.35Å; L331-L593 HydrophobicContact CB-CD2 3.88Å; Y358-L593 HydrophobicContact CD1-CD2 4.31Å; P360-L593 HydrophobicContact CB-CD2 4.2Å; P360-L593 HydrophobicContact CG-CD2 4.08Å; P360-L593 HydrophobicContact CG-CG 4.45Å; L593-L595 HydrophobicContact CD2-CD2 4.06Å; L593-L595 PolarHBondContact O-N 2.64Å
594	P	85.7	Confident	87.5	Confident	34 Å²	34	29.6 Å²	29.6	22%	0.221	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-62.8	122.7	165.2	-17.5	31	0	0	0	109.3	L275	L275-P594 WeakPolarHBondContact CD1-O 3.28Å
595	L	82.9	Confident	87.1	Confident	11 Å²	11	29.9 Å²	29.9	6%	0.058	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-100.6	149.8	172	-67.2	175.6	0	0	0	109.6	L283 A300 P311 F313 P360 L593	L283-L595 HydrophobicContact CD2-CD1 3.7Å; L283-L595 HydrophobicContact CD2-CD2 4.3Å; L283-L595 HydrophobicContact CD2-CG 4.15Å; A300-L595 HydrophobicContact CB-CD1 3.85Å; P311-L595 HydrophobicContact CB-CD1 3.54Å; P311-L595 HydrophobicContact CB-CD2 4.42Å; P311-L595 HydrophobicContact CG-CD1 4.47Å; F313-L595 HydrophobicContact CE1-CD2 3.97Å; P360-L595 HydrophobicContact CB-CD2 4.33Å; L593-L595 HydrophobicContact CD2-CD2 4.06Å; L593-L595 PolarHBondContact O-N 2.64Å
596	P	74.2	Confident	86.7	Confident	69 Å²	69	31.9 Å²	31.9	45%	0.448	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-64	131.8	157.7	31.2	-34.6	0	0	0	108.3	P360	P360-P596 WeakPolarHBondContact O-CD 3.43Å; P360-P596 VanDerWaalsContact O-CG 3.27Å; P360-P596 WeakPolarHBondContact O-CG 3.48Å
597	D	60.7	Low	86.2	Confident	124 Å²	124	34.6 Å²	34.6	66%	0.663	21%	0.208	S	C	*	.			trans	-71.1	0	175.7	-67.9	-42.8	0	0	0	112.4	P190 G191 H281	P190-D597 WeakPolarHBondContact CA-OD2 3.25Å; P190-D597 HydrophobicContact CB-CB 4.06Å; P190-D597 WeakPolarHBondContact CB-OD2 3.38Å; G191-D597 WeakPolarHBondContact CA-O 3.16Å; H281-D597 IonicContact CE1-OD1 3.01Å

Retrieved 597 of 597 residues in 127.6 ms (Link to these results)

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