A0A077ZIH4_TRITR Loading...

DNA damage-binding protein 1

Plays a role in DNA repair. May be a component of an E3 ubiquitin-protein ligase which promotes histone ubiquitination in response to UV irradiation. Histone ubiquitination may be important for subsequent DNA repair.

AlphaFold DB , UniProt , Accession A0A077ZIH4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,242 aa.

						>A0A077ZIH4_TRITR|A0A077ZIH4
MPRKRARLTHLTPEQRDYRRKMRNRVAAQTARDRKKVAIAQLHETVMALEAEVHRLKCQNDQLATNYRIVLEENQLLRRQFIQSFDGMHSEISRIDATPFDPVEVETKPSTAIEPAALISAPLPKAQDAIEINQQQPSSWLSPVFEWADSLRSLKATVVHDHTYCAPESAFRLPVPSNTDSPFSSDLSYKSGDAMSSLDNSGEQKSLLFLFTSKCQVAVVDYVNNAFVTLDTYKVSNFCFRMAESETRVIDVTFLHSSQKPTIAYLYEDDQGCHLATLICDKLKGTIYESSPRLTCVEFDCALMFPIPKPVNGLIILGLESVVFSRNGATFSIKPECAFTPGLFCCFGIIEAGKMYVIGDTRGRIYSLSVGSAKNFDGLRMRYLCEVSRPQTLTYLGDGILFVGSRVSDSMLVRVPALCGDTTSQLSVLGSYPSLAPIVDLIQFSPDPLIEAPAYLACSGHGKDGSLRLIRGSIENRESARIPLSGAVQAWFVHYANTQPDGGLLIVSFVFGTKTYTLRNEQVEEVEIPTIPSCERTWLAMNYHCNDWSGLILVTTDRVRMMDVCRDGELLSEWSSLERTHIDVTAFSANTGHIVVCYGPQLFLLSCDNRELLLIAENTFPNDISCADISDFGGTEEIGAVGQWLEDSIILFRPVSMQMLATYSTQGVARSLQFCLMEDAPRLFVSTSDRYVVALLLTDQQSGEYKVEKTFGEFSDYPTLKCVKIRDKTAVIACCSQPFILYRRKKRLTTTRVLVGPTSSVSTINTGTFPDSFLFCLKDSLSVISIVELSSVHCRKIALGETPVRLSHQVETRTFAVCTEKEVPSWTAKTSNSAPTSISNTAKQELVANPFRKHMIKAEVQVNTREEAKRQNHFLVFDQDSCEALVCYKMSPNEKCCSVLSCQLANDPNVYYIVGTALIIRSEREASVGRLLVFKVKRDLECAKDGRDTNMDLVHEKTVNGAPYSMVEFNKKLLVAVNNVVLLFEWVLRNKKHSLQLECFCTCSVAMIQLRKLSPSSVLGGDFIEALVLFIYKPAESTLEGHDIDYHTDWLTGIGAVSPNVFLSADVAYNLYIADVTDETENGGKFPVQYNGFHIGQYVNVFCPRNMNFAMSSEIVNGSAALYATAEGSVGTVCLLTPRYFSLFKTLELAIMMACSNFGVFDHSYFRRAVELNKWETDTSCCSKIVDGNVIARLLDLPAEQKNTILRQAVDLTNEVYAPSGFSFDCDSVEHVVENMFSTISN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.3	Very low	56.3	Low	233 Å²	233	157.4 Å²	157.4	100%	1.148	75%	0.747	S	S	*	*				0	108.6	0	-79.7	-84.4	-168.2	0	0	109.7	R3	M1-R3 PolarHBondContact O-N 3.12Å
2	P	41.9	Very low	58.3	Low	126 Å²	126	149.9 Å²	149.9	82%	0.818	72%	0.72	S	S	*	*			trans	-83.4	110.7	175	31.7	-26.9	0	0	0	109.2	K4	P2-K4 PolarHBondContact O-N 3.04Å
3	R	49.3	Very low	59.8	Low	247 Å²	247	146.3 Å²	146.3	93%	0.932	72%	0.716	S	S	*	*			trans	-63.9	101.6	176.1	-83.4	-179.3	171.5	169.1	-2.1	109.7	M1 R5	M1-R3 PolarHBondContact O-N 3.12Å; R3-R5 PolarHBondContact O-N 3.31Å
4	K	47.1	Very low	61.3	Low	205 Å²	205	147.4 Å²	147.4	89%	0.891	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-56.2	125.2	169.4	-79.2	-179	176.4	176.3	0	109.1	P2 A6	P2-K4 PolarHBondContact O-N 3.04Å; K4-A6 PolarHBondContact O-N 3.16Å
5	R	53.8	Low	62.5	Low	241 Å²	241	144.1 Å²	144.1	91%	0.909	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-57.1	118	177.6	-72.8	179.1	177	178.7	-0.4	109.7	R3 R7	R3-R5 PolarHBondContact O-N 3.31Å; R5-R7 PolarHBondContact O-N 2.88Å
6	A	57.2	Low	63.5	Low	91 Å²	91	142.3 Å²	142.3	75%	0.752	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-59.5	126	175.8	0	0	0	0	0	110.5	K4 L8	K4-A6 PolarHBondContact O-N 3.16Å; A6-L8 PolarHBondContact O-N 3.27Å
7	R	57.5	Low	64.4	Low	228 Å²	228	139.5 Å²	139.5	86%	0.86	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-71.2	118.1	174.3	-75.8	-177.6	172.2	-177	-2.5	108.5	R5 T9	R5-R7 PolarHBondContact O-N 2.88Å; R7-T9 HydrophobicContact CB-CG2 4.42Å; R7-T9 PolarHBondContact O-N 3.2Å
8	L	63.2	Low	65.4	Low	71 Å²	71	140.5 Å²	140.5	37%	0.372	67%	0.671	S	S	.	*			trans	-75.2	61.3	-176.4	-72.7	164.6	0	0	0	112.3	A6 H10 L11 R16	A6-L8 PolarHBondContact O-N 3.27Å; L8-H10 VanDerWaalsContact C-N 3.28Å; L8-H10 PolarHBondContact O-N 2.86Å; L8-L11 HydrophobicContact CB-CD1 4.05Å; L8-L11 HydrophobicContact CD1-CD1 4.45Å; L8-L11 HydrophobicContact CD2-CD1 3.82Å; L8-L11 HydrophobicContact CG-CD1 4.33Å; L8-R16 VanDerWaalsContact O-CZ 3.24Å; L8-R16 PolarHBondContact O-NE 2.81Å; L8-R16 VanDerWaalsContact O-NE 3.09Å; L8-R16 PolarHBondContact O-NH2 3.29Å
9	T	66.2	Low	66.2	Low	118 Å²	118	138.8 Å²	138.8	72%	0.724	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-16	-176	48.1	0	0	0	0	114.8	R7	R7-T9 HydrophobicContact CB-CG2 4.42Å; R7-T9 PolarHBondContact O-N 3.2Å
10	H	74.5	Confident	67	Low	139 Å²	139	140.6 Å²	140.6	64%	0.644	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-4.4	-175.9	59.1	-89.7	0	0	0	115.5	L8	L8-H10 VanDerWaalsContact C-N 3.28Å; L8-H10 PolarHBondContact O-N 2.86Å
11	L	72.1	Confident	67.9	Low	32 Å²	32	141.3 Å²	141.3	17%	0.168	66%	0.658	C	S	.	*	S	Bend	trans	-100.8	133.4	-179.4	-74.8	139.4	0	0	0	110.3	L8 Q15 R16	L8-L11 HydrophobicContact CB-CD1 4.05Å; L8-L11 HydrophobicContact CD1-CD1 4.45Å; L8-L11 HydrophobicContact CD2-CD1 3.82Å; L8-L11 HydrophobicContact CG-CD1 4.33Å; L11-Q15 HydrophobicContact CB-CB 4.23Å; L11-Q15 HydrophobicContact CD2-CB 3.64Å; L11-Q15 HydrophobicContact CD2-CG 4.45Å; L11-R16 HydrophobicContact CB-CG 3.75Å; L11-R16 PolarHBondContact O-NE 2.83Å
12	T	80.6	Confident	70.2	Confident	68 Å²	68	134.1 Å²	134.1	42%	0.417	62%	0.623	S	S	.	*			trans	-62.1	157.4	172.4	64.8	0	0	0	0	110.5	E14 Q15 R16	T12-E14 PolarHBondContact O-N 3.04Å; T12-Q15 PolarHBondContact O-N 3.36Å; T12-Q15 VanDerWaalsContact O-N 3.08Å; T12-Q15 VanDerWaalsContact OG1-CG 3.25Å; T12-Q15 WeakPolarHBondContact OG1-CG 2.99Å; T12-Q15 PolarHBondContact OG1-N 2.98Å; T12-Q15 PolarHBondContact OG1-OE1 3.45Å; T12-R16 PolarHBondContact O-N 2.9Å
13	P	78.3	Confident	72.2	Confident	103 Å²	103	136 Å²	136	67%	0.669	61%	0.613	S	S	*	*	H	α-helix	trans	-52.1	-43.9	179.2	-26.1	34.2	0	0	0	112.6	Q15 R16 D17	P13-Q15 PolarHBondContact O-N 3.35Å; P13-R16 PolarHBondContact O-N 3.31Å; P13-D17 PolarHBondContact O-N 3.29Å
14	E	80.9	Confident	73.9	Confident	161 Å²	161	129 Å²	129	75%	0.752	60%	0.595	S	S	*	*	H	α-helix	trans	-62.6	-41.2	177.5	-65.1	-178.2	169.6	0	0	112.8	T12 R16 D17 Y18	T12-E14 PolarHBondContact O-N 3.04Å; E14-R16 VanDerWaalsContact C-N 3.34Å; E14-R16 PolarHBondContact O-N 3.48Å; E14-D17 PolarHBondContact O-N 2.84Å; E14-Y18 WeakPolarHBondContact O-CB 3.17Å; E14-Y18 PolarHBondContact O-N 3.48Å
15	Q	79.2	Confident	75.8	Confident	99 Å²	99	128.3 Å²	128.3	46%	0.463	59%	0.587	S	S	.	*	H	α-helix	trans	-68	-33.4	177.8	-72.3	172.4	-16.6	0	0	112.3	L11 T12 P13 R19	L11-Q15 HydrophobicContact CB-CB 4.23Å; L11-Q15 HydrophobicContact CD2-CB 3.64Å; L11-Q15 HydrophobicContact CD2-CG 4.45Å; T12-Q15 PolarHBondContact O-N 3.36Å; T12-Q15 VanDerWaalsContact O-N 3.08Å; T12-Q15 VanDerWaalsContact OG1-CG 3.25Å; T12-Q15 WeakPolarHBondContact OG1-CG 2.99Å; T12-Q15 PolarHBondContact OG1-N 2.98Å; T12-Q15 PolarHBondContact OG1-OE1 3.45Å; P13-Q15 PolarHBondContact O-N 3.35Å; Q15-R19 WeakPolarHBondContact O-CB 3.5Å; Q15-R19 PolarHBondContact O-N 3.41Å
16	R	78.4	Confident	77.3	Confident	115 Å²	115	121 Å²	121	43%	0.434	57%	0.569	S	S	.	*	H	α-helix	trans	-67.7	-42.1	173.8	-68.5	-175.1	-173.8	159.2	9.6	111.4	L8 L11 T12 P13 E14 R19 R20	L8-R16 VanDerWaalsContact O-CZ 3.24Å; L8-R16 PolarHBondContact O-NE 2.81Å; L8-R16 VanDerWaalsContact O-NE 3.09Å; L8-R16 PolarHBondContact O-NH2 3.29Å; L11-R16 HydrophobicContact CB-CG 3.75Å; L11-R16 PolarHBondContact O-NE 2.83Å; T12-R16 PolarHBondContact O-N 2.9Å; P13-R16 PolarHBondContact O-N 3.31Å; E14-R16 VanDerWaalsContact C-N 3.34Å; E14-R16 PolarHBondContact O-N 3.48Å; R16-R19 PolarHBondContact O-N 3.5Å; R16-R20 WeakPolarHBondContact O-CB 3.37Å; R16-R20 PolarHBondContact O-N 3.48Å
17	D	79.3	Confident	78.5	Confident	95 Å²	95	119.5 Å²	119.5	51%	0.508	56%	0.556	S	S	.	*	H	α-helix	trans	-67.1	-41.4	177.3	-83.2	-11.4	0	0	0	112.2	P13 E14 R19 R20 K21	P13-D17 PolarHBondContact O-N 3.29Å; E14-D17 PolarHBondContact O-N 2.84Å; D17-R19 VanDerWaalsContact C-N 3.33Å; D17-R19 PolarHBondContact O-N 3.05Å; D17-R20 PolarHBondContact O-N 3.16Å; D17-K21 WeakPolarHBondContact O-CG 3.46Å; D17-K21 PolarHBondContact O-N 3.42Å
18	Y	82.4	Confident	79.8	Confident	157 Å²	157	111.2 Å²	111.2	62%	0.616	54%	0.536	S	S	*	.	H	α-helix	trans	-59.9	-44.1	173.3	-172.5	-100.8	0	0	0	111.6	E14 R20 K21 M22	E14-Y18 WeakPolarHBondContact O-CB 3.17Å; E14-Y18 PolarHBondContact O-N 3.48Å; Y18-R20 VanDerWaalsContact C-N 3.34Å; Y18-R20 PolarHBondContact O-N 2.78Å; Y18-K21 PolarHBondContact O-N 3.28Å; Y18-M22 HydrophobicContact CD1-CG 4.13Å; Y18-M22 HydrophobicContact CE1-CG 3.76Å; Y18-M22 WeakPolarHBondContact O-CB 3.46Å; Y18-M22 WeakPolarHBondContact O-CG 3.45Å; Y18-M22 PolarHBondContact O-N 2.97Å
19	R	80.7	Confident	80.9	Confident	108 Å²	108	112.3 Å²	112.3	41%	0.408	54%	0.539	S	S	.	.	H	α-helix	trans	-65.9	-35.5	177.5	-163.2	176.4	-172.6	173.5	4	112.4	Q15 R16 D17 R23	Q15-R19 WeakPolarHBondContact O-CB 3.5Å; Q15-R19 PolarHBondContact O-N 3.41Å; R16-R19 PolarHBondContact O-N 3.5Å; D17-R19 VanDerWaalsContact C-N 3.33Å; D17-R19 PolarHBondContact O-N 3.05Å; R19-R23 WeakPolarHBondContact O-CB 3.21Å; R19-R23 PolarHBondContact O-N 2.82Å
20	R	81.9	Confident	81.7	Confident	174 Å²	174	109.4 Å²	109.4	66%	0.657	52%	0.522	S	S	*	.	H	α-helix	trans	-67.6	-44.7	174.3	-170.1	178.5	-178.6	-175.9	-0.6	111.2	R16 D17 Y18 M22 R23 N24	R16-R20 WeakPolarHBondContact O-CB 3.37Å; R16-R20 PolarHBondContact O-N 3.48Å; D17-R20 PolarHBondContact O-N 3.16Å; Y18-R20 VanDerWaalsContact C-N 3.34Å; Y18-R20 PolarHBondContact O-N 2.78Å; R20-M22 VanDerWaalsContact C-N 3.35Å; R20-M22 PolarHBondContact O-N 3.1Å; R20-R23 PolarHBondContact O-N 2.78Å; R20-N24 WeakPolarHBondContact O-CB 3.4Å; R20-N24 PolarHBondContact O-N 2.68Å
21	K	85.6	Confident	82.2	Confident	157 Å²	157	105.7 Å²	105.7	68%	0.683	52%	0.515	S	S	*	.	H	α-helix	trans	-59.5	-44.5	174	-74.9	180	-179.2	177.9	0	111.4	D17 Y18 N24 R25	D17-K21 WeakPolarHBondContact O-CG 3.46Å; D17-K21 PolarHBondContact O-N 3.42Å; Y18-K21 PolarHBondContact O-N 3.28Å; K21-N24 PolarHBondContact O-N 2.89Å; K21-R25 WeakPolarHBondContact O-CB 3.15Å; K21-R25 PolarHBondContact O-N 2.96Å
22	M	84.9	Confident	82.9	Confident	82 Å²	82	112.7 Å²	112.7	40%	0.404	54%	0.539	S	S	.	.	H	α-helix	trans	-62.9	-46.5	176.4	-77.4	-68.8	-78.4	0	0	112.4	Y18 R20 N24 R25 V26	Y18-M22 HydrophobicContact CD1-CG 4.13Å; Y18-M22 HydrophobicContact CE1-CG 3.76Å; Y18-M22 WeakPolarHBondContact O-CB 3.46Å; Y18-M22 WeakPolarHBondContact O-CG 3.45Å; Y18-M22 PolarHBondContact O-N 2.97Å; R20-M22 VanDerWaalsContact C-N 3.35Å; R20-M22 PolarHBondContact O-N 3.1Å; M22-N24 PolarHBondContact O-N 2.97Å; M22-R25 PolarHBondContact O-N 3.16Å; M22-V26 WeakPolarHBondContact O-CG2 3.06Å; M22-V26 PolarHBondContact O-N 3.41Å
23	R	83.5	Confident	83.2	Confident	164 Å²	164	113.1 Å²	113.1	62%	0.619	54%	0.539	S	S	*	.	H	α-helix	trans	-63.5	-41.1	176.8	-83.2	-174.1	169.9	-179.3	-3.1	112.9	R19 R20 R25 V26 A27	R19-R23 WeakPolarHBondContact O-CB 3.21Å; R19-R23 PolarHBondContact O-N 2.82Å; R20-R23 PolarHBondContact O-N 2.78Å; R23-R25 VanDerWaalsContact C-N 3.31Å; R23-R25 PolarHBondContact O-N 3.13Å; R23-V26 PolarHBondContact O-N 3.35Å; R23-A27 WeakPolarHBondContact O-CB 3.48Å; R23-A27 PolarHBondContact O-N 3.15Å
24	N	84.3	Confident	83.4	Confident	102 Å²	102	117 Å²	117	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-64.5	-37.9	175.1	-80.6	3.4	0	0	0	111.4	R20 K21 M22 A27 A28	R20-N24 WeakPolarHBondContact O-CB 3.4Å; R20-N24 PolarHBondContact O-N 2.68Å; K21-N24 PolarHBondContact O-N 2.89Å; M22-N24 PolarHBondContact O-N 2.97Å; N24-A27 PolarHBondContact O-N 3.1Å; N24-A28 VanDerWaalsContact O-CB 3.27Å; N24-A28 WeakPolarHBondContact O-CB 3.28Å; N24-A28 PolarHBondContact O-N 2.75Å
25	R	87	Confident	83.8	Confident	190 Å²	190	116.5 Å²	116.5	72%	0.717	54%	0.535	S	S	*	.	H	α-helix	trans	-64.7	-44.5	175.8	-169.1	176.2	-177.9	177.5	1	111.8	K21 M22 R23 A28 Q29	K21-R25 WeakPolarHBondContact O-CB 3.15Å; K21-R25 PolarHBondContact O-N 2.96Å; M22-R25 PolarHBondContact O-N 3.16Å; R23-R25 VanDerWaalsContact C-N 3.31Å; R23-R25 PolarHBondContact O-N 3.13Å; R25-A28 PolarHBondContact O-N 2.79Å; R25-Q29 WeakPolarHBondContact O-CB 3.26Å; R25-Q29 PolarHBondContact O-N 2.93Å
26	V	85.9	Confident	84.2	Confident	88 Å²	88	119.4 Å²	119.4	53%	0.533	55%	0.546	S	S	.	.	H	α-helix	trans	-63.9	-46.7	175.8	174.3	0	0	0	0	110.6	M22 R23 A28 Q29 T30	M22-V26 WeakPolarHBondContact O-CG2 3.06Å; M22-V26 PolarHBondContact O-N 3.41Å; R23-V26 PolarHBondContact O-N 3.35Å; V26-A28 VanDerWaalsContact C-N 3.33Å; V26-A28 PolarHBondContact O-N 2.92Å; V26-Q29 PolarHBondContact O-N 2.78Å; V26-Q29 VanDerWaalsContact O-N 3.14Å; V26-T30 PolarHBondContact O-N 2.88Å; V26-T30 PolarHBondContact O-OG1 2.86Å
27	A	81.3	Confident	84.6	Confident	58 Å²	58	118 Å²	118	48%	0.479	55%	0.551	S	S	.	*	H	α-helix	trans	-61	-41.3	178.3	0	0	0	0	0	112.4	R23 N24 Q29 A31	R23-A27 WeakPolarHBondContact O-CB 3.48Å; R23-A27 PolarHBondContact O-N 3.15Å; N24-A27 PolarHBondContact O-N 3.1Å; A27-Q29 VanDerWaalsContact C-N 3.35Å; A27-A31 WeakPolarHBondContact O-CB 3.3Å; A27-A31 PolarHBondContact O-N 3.3Å
28	A	85.4	Confident	84.8	Confident	54 Å²	54	116 Å²	116	45%	0.446	55%	0.547	S	S	.	.	H	α-helix	trans	-65.2	-37.8	175.1	0	0	0	0	0	112.3	N24 R25 V26 R32	N24-A28 VanDerWaalsContact O-CB 3.27Å; N24-A28 WeakPolarHBondContact O-CB 3.28Å; N24-A28 PolarHBondContact O-N 2.75Å; R25-A28 PolarHBondContact O-N 2.79Å; V26-A28 VanDerWaalsContact C-N 3.33Å; V26-A28 PolarHBondContact O-N 2.92Å; A28-R32 WeakPolarHBondContact O-CG 3.23Å; A28-R32 PolarHBondContact O-N 2.82Å; A28-R32 VanDerWaalsContact O-N 3.07Å
29	Q	86	Confident	85	Confident	94 Å²	94	112.4 Å²	112.4	44%	0.439	54%	0.538	S	S	.	.	H	α-helix	trans	-67.4	-48.8	176	-169.7	60.2	38.2	0	0	111.2	R25 V26 A27 A31 R32 D33	R25-Q29 WeakPolarHBondContact O-CB 3.26Å; R25-Q29 PolarHBondContact O-N 2.93Å; V26-Q29 PolarHBondContact O-N 2.78Å; V26-Q29 VanDerWaalsContact O-N 3.14Å; A27-Q29 VanDerWaalsContact C-N 3.35Å; Q29-A31 VanDerWaalsContact C-N 3.27Å; Q29-A31 PolarHBondContact O-N 2.85Å; Q29-R32 WeakPolarHBondContact O-CB 3.2Å; Q29-R32 PolarHBondContact O-N 2.91Å; Q29-D33 PolarHBondContact NE2-OD1 3.35Å; Q29-D33 VanDerWaalsContact O-CG 3.23Å; Q29-D33 PolarHBondContact O-N 2.77Å
30	T	84	Confident	85.2	Confident	58 Å²	58	110 Å²	110	36%	0.356	54%	0.541	S	S	.	.	H	α-helix	trans	-60	-37	177	-49.9	0	0	0	0	112.1	V26 D33 R34	V26-T30 PolarHBondContact O-N 2.88Å; V26-T30 PolarHBondContact O-OG1 2.86Å; T30-D33 PolarHBondContact O-N 2.67Å; T30-R34 WeakPolarHBondContact O-CG 3.4Å; T30-R34 PolarHBondContact O-N 3.14Å
31	A	83.9	Confident	85.4	Confident	60 Å²	60	107.5 Å²	107.5	50%	0.496	54%	0.537	S	S	.	.	H	α-helix	trans	-66	-39.7	174.7	0	0	0	0	0	112.4	A27 Q29 K35	A27-A31 WeakPolarHBondContact O-CB 3.3Å; A27-A31 PolarHBondContact O-N 3.3Å; Q29-A31 VanDerWaalsContact C-N 3.27Å; Q29-A31 PolarHBondContact O-N 2.85Å; A31-K35 PolarHBondContact O-N 3Å; A31-K35 VanDerWaalsContact O-N 3.11Å
32	R	88	Confident	85.4	Confident	179 Å²	179	105.7 Å²	105.7	68%	0.675	53%	0.534	S	S	*	.	H	α-helix	trans	-66	-42.2	174.3	-76.3	177.8	177.9	-178.8	-2.1	112	A28 Q29 K35 K36	A28-R32 WeakPolarHBondContact O-CG 3.23Å; A28-R32 PolarHBondContact O-N 2.82Å; A28-R32 VanDerWaalsContact O-N 3.07Å; Q29-R32 WeakPolarHBondContact O-CB 3.2Å; Q29-R32 PolarHBondContact O-N 2.91Å; R32-K35 PolarHBondContact O-N 3.46Å; R32-K36 PolarHBondContact O-N 2.77Å
33	D	86.5	Confident	85.4	Confident	78 Å²	78	107.9 Å²	107.9	42%	0.417	54%	0.543	S	S	.	.	H	α-helix	trans	-64.9	-42.8	179.9	-61.6	-25.2	0	0	0	110.9	Q29 T30 K35 K36 V37	Q29-D33 PolarHBondContact NE2-OD1 3.35Å; Q29-D33 VanDerWaalsContact O-CG 3.23Å; Q29-D33 PolarHBondContact O-N 2.77Å; T30-D33 PolarHBondContact O-N 2.67Å; D33-K35 PolarHBondContact O-N 3.43Å; D33-K36 WeakPolarHBondContact O-CB 3.48Å; D33-K36 PolarHBondContact O-N 2.88Å; D33-K36 VanDerWaalsContact O-N 3.16Å; D33-V37 WeakPolarHBondContact O-CG2 3.4Å; D33-V37 PolarHBondContact O-N 2.96Å
34	R	83.2	Confident	85.6	Confident	185 Å²	185	106.9 Å²	106.9	70%	0.698	55%	0.545	S	S	*	.	H	α-helix	trans	-60	-43.3	173	-72.8	179.8	-168.1	-169.3	1.5	112.6	T30 K36 V37 A38	T30-R34 WeakPolarHBondContact O-CG 3.4Å; T30-R34 PolarHBondContact O-N 3.14Å; R34-K36 VanDerWaalsContact C-N 3.28Å; R34-K36 PolarHBondContact O-N 3.34Å; R34-V37 PolarHBondContact O-N 3.16Å; R34-A38 WeakPolarHBondContact O-CB 3.47Å; R34-A38 PolarHBondContact O-N 3.01Å
35	K	87.8	Confident	85.7	Confident	149 Å²	149	105.9 Å²	105.9	65%	0.648	54%	0.543	S	S	*	.	H	α-helix	trans	-63.2	-37.4	176.5	-170.8	175	-178.8	177.6	0	111.3	A31 R32 D33 I39	A31-K35 PolarHBondContact O-N 3Å; A31-K35 VanDerWaalsContact O-N 3.11Å; R32-K35 PolarHBondContact O-N 3.46Å; D33-K35 PolarHBondContact O-N 3.43Å; K35-I39 HydrophobicContact CG-CD1 3.92Å; K35-I39 WeakPolarHBondContact O-CB 3.2Å; K35-I39 VanDerWaalsContact O-CG1 3.24Å; K35-I39 WeakPolarHBondContact O-CG1 3.32Å; K35-I39 PolarHBondContact O-N 3.25Å
36	K	88	Confident	85.7	Confident	160 Å²	160	99.7 Å²	99.7	70%	0.696	53%	0.526	S	S	*	.	H	α-helix	trans	-67.4	-40.7	177.7	-161.7	177.4	-178.5	-175.2	0	112.1	R32 D33 R34 I39 A40	R32-K36 PolarHBondContact O-N 2.77Å; D33-K36 WeakPolarHBondContact O-CB 3.48Å; D33-K36 PolarHBondContact O-N 2.88Å; D33-K36 VanDerWaalsContact O-N 3.16Å; R34-K36 VanDerWaalsContact C-N 3.28Å; R34-K36 PolarHBondContact O-N 3.34Å; K36-I39 PolarHBondContact O-N 2.54Å; K36-A40 WeakPolarHBondContact O-CB 3.24Å; K36-A40 PolarHBondContact O-N 2.53Å
37	V	86.8	Confident	85.7	Confident	86 Å²	86	101.6 Å²	101.6	52%	0.521	53%	0.53	S	S	.	.	H	α-helix	trans	-64.7	-45.8	174.4	174.2	0	0	0	0	111.2	D33 R34 I39 A40 Q41	D33-V37 WeakPolarHBondContact O-CG2 3.4Å; D33-V37 PolarHBondContact O-N 2.96Å; R34-V37 PolarHBondContact O-N 3.16Å; V37-I39 VanDerWaalsContact C-N 3.34Å; V37-I39 PolarHBondContact O-N 2.93Å; V37-A40 PolarHBondContact O-N 3.39Å; V37-A40 VanDerWaalsContact O-N 3.16Å; V37-Q41 PolarHBondContact O-N 2.91Å
38	A	83.4	Confident	86	Confident	52 Å²	52	101.8 Å²	101.8	43%	0.43	53%	0.532	S	S	.	.	H	α-helix	trans	-61.6	-40.8	177.7	0	0	0	0	0	112.3	R34 A40 Q41 L42	R34-A38 WeakPolarHBondContact O-CB 3.47Å; R34-A38 PolarHBondContact O-N 3.01Å; A38-A40 VanDerWaalsContact C-N 3.34Å; A38-Q41 PolarHBondContact O-N 2.84Å; A38-L42 WeakPolarHBondContact O-CB 3.29Å; A38-L42 PolarHBondContact O-N 3.48Å
39	I	86.9	Confident	86	Confident	82 Å²	82	104.6 Å²	104.6	42%	0.421	54%	0.539	S	S	.	.	H	α-helix	trans	-66.9	-35.5	175.9	-70	168.1	0	0	0	111.6	K35 K36 V37 L42 H43	K35-I39 HydrophobicContact CG-CD1 3.92Å; K35-I39 WeakPolarHBondContact O-CB 3.2Å; K35-I39 VanDerWaalsContact O-CG1 3.24Å; K35-I39 WeakPolarHBondContact O-CG1 3.32Å; K35-I39 PolarHBondContact O-N 3.25Å; K36-I39 PolarHBondContact O-N 2.54Å; V37-I39 VanDerWaalsContact C-N 3.34Å; V37-I39 PolarHBondContact O-N 2.93Å; I39-L42 PolarHBondContact O-N 3.31Å; I39-H43 PolarHBondContact O-N 3.42Å; I39-H43 PolarHBondContact O-ND1 3.24Å
40	A	85.7	Confident	86	Confident	57 Å²	57	105.7 Å²	105.7	47%	0.471	54%	0.544	S	S	.	.	H	α-helix	trans	-65.9	-45.9	176.2	0	0	0	0	0	111.6	K36 V37 A38 L42 H43 E44	K36-A40 WeakPolarHBondContact O-CB 3.24Å; K36-A40 PolarHBondContact O-N 2.53Å; V37-A40 PolarHBondContact O-N 3.39Å; V37-A40 VanDerWaalsContact O-N 3.16Å; A38-A40 VanDerWaalsContact C-N 3.34Å; A40-L42 VanDerWaalsContact C-N 3.29Å; A40-L42 PolarHBondContact O-N 2.86Å; A40-H43 PolarHBondContact O-N 2.9Å; A40-E44 PolarHBondContact O-N 2.81Å
41	Q	84.7	Confident	86.2	Confident	123 Å²	123	105.9 Å²	105.9	58%	0.575	55%	0.552	S	S	*	*	H	α-helix	trans	-61.9	-36.7	174.5	-73.9	178.4	-33.8	0	0	112.1	V37 A38 E44 T45	V37-Q41 PolarHBondContact O-N 2.91Å; A38-Q41 PolarHBondContact O-N 2.84Å; Q41-E44 PolarHBondContact O-N 2.81Å; Q41-T45 PolarHBondContact O-N 2.83Å; Q41-T45 PolarHBondContact O-OG1 2.95Å
42	L	86	Confident	86.4	Confident	119 Å²	119	106.8 Å²	106.8	62%	0.623	55%	0.546	S	S	*	.	H	α-helix	trans	-66.2	-40.5	176.1	-146.8	99.5	0	0	0	112	A38 I39 A40 T45 V46	A38-L42 WeakPolarHBondContact O-CB 3.29Å; A38-L42 PolarHBondContact O-N 3.48Å; I39-L42 PolarHBondContact O-N 3.31Å; A40-L42 VanDerWaalsContact C-N 3.29Å; A40-L42 PolarHBondContact O-N 2.86Å; L42-T45 WeakPolarHBondContact CA-OG1 3.48Å; L42-T45 PolarHBondContact O-OG1 2.89Å; L42-V46 WeakPolarHBondContact O-CB 3.48Å; L42-V46 WeakPolarHBondContact O-CG2 3.45Å; L42-V46 PolarHBondContact O-N 3.41Å
43	H	85.7	Confident	86.3	Confident	127 Å²	127	101.9 Å²	101.9	59%	0.588	54%	0.535	S	S	*	.	H	α-helix	trans	-65.4	-39.7	175.3	-84.1	130.2	0	0	0	112.4	I39 A40 V46 M47	I39-H43 PolarHBondContact O-N 3.42Å; I39-H43 PolarHBondContact O-ND1 3.24Å; A40-H43 PolarHBondContact O-N 2.9Å; H43-V46 PolarHBondContact O-N 2.99Å; H43-M47 VanDerWaalsContact O-CG 3.25Å; H43-M47 WeakPolarHBondContact O-CG 3.22Å; H43-M47 PolarHBondContact O-N 2.83Å
44	E	86.7	Confident	86.4	Confident	144 Å²	144	104.1 Å²	104.1	67%	0.673	54%	0.543	S	S	*	.	H	α-helix	trans	-65.2	-42.4	178.8	-167.1	169.4	-163.4	0	0	111.6	A40 Q41 M47 A48	A40-E44 PolarHBondContact O-N 2.81Å; Q41-E44 PolarHBondContact O-N 2.81Å; E44-M47 PolarHBondContact O-N 2.91Å; E44-A48 PolarHBondContact O-N 3.22Å
45	T	86.3	Confident	86.8	Confident	80 Å²	80	100.4 Å²	100.4	49%	0.491	53%	0.529	S	S	.	.	H	α-helix	trans	-66.4	-40.1	174.3	40.8	0	0	0	0	112.7	Q41 L42 A48 L49	Q41-T45 PolarHBondContact O-N 2.83Å; Q41-T45 PolarHBondContact O-OG1 2.95Å; L42-T45 WeakPolarHBondContact CA-OG1 3.48Å; L42-T45 PolarHBondContact O-OG1 2.89Å; T45-A48 PolarHBondContact O-N 2.86Å; T45-L49 WeakPolarHBondContact O-CB 3.47Å; T45-L49 WeakPolarHBondContact O-CG 3.16Å; T45-L49 PolarHBondContact O-N 2.8Å
46	V	87.4	Confident	86.6	Confident	60 Å²	60	97 Å²	97	36%	0.364	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-43.3	175.1	169.5	0	0	0	0	111.2	L42 H43 A48 L49 E50	L42-V46 WeakPolarHBondContact O-CB 3.48Å; L42-V46 WeakPolarHBondContact O-CG2 3.45Å; L42-V46 PolarHBondContact O-N 3.41Å; H43-V46 PolarHBondContact O-N 2.99Å; V46-A48 VanDerWaalsContact C-N 3.35Å; V46-A48 PolarHBondContact O-N 3.04Å; V46-L49 PolarHBondContact O-N 3.21Å; V46-E50 HydrophobicContact CG1-CG 4.38Å; V46-E50 WeakPolarHBondContact O-CG 3.04Å; V46-E50 PolarHBondContact O-N 3.2Å
47	M	86.5	Confident	86.6	Confident	128 Å²	128	96 Å²	96	63%	0.631	51%	0.513	S	S	*	.	H	α-helix	trans	-63.4	-39.7	176.8	-69.6	-121.3	111.6	0	0	112.2	H43 E44 E50 A51	H43-M47 VanDerWaalsContact O-CG 3.25Å; H43-M47 WeakPolarHBondContact O-CG 3.22Å; H43-M47 PolarHBondContact O-N 2.83Å; E44-M47 PolarHBondContact O-N 2.91Å; M47-E50 PolarHBondContact O-N 2.96Å; M47-A51 WeakPolarHBondContact O-CB 3.28Å; M47-A51 PolarHBondContact O-N 2.85Å
48	A	87.1	Confident	86.6	Confident	62 Å²	62	94.8 Å²	94.8	51%	0.512	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-41.7	175.5	0	0	0	0	0	112	E44 T45 V46 A51 E52	E44-A48 PolarHBondContact O-N 3.22Å; T45-A48 PolarHBondContact O-N 2.86Å; V46-A48 VanDerWaalsContact C-N 3.35Å; V46-A48 PolarHBondContact O-N 3.04Å; A48-A51 PolarHBondContact O-N 2.72Å; A48-E52 PolarHBondContact O-N 2.83Å
49	L	84.9	Confident	86.7	Confident	114 Å²	114	96.4 Å²	96.4	60%	0.597	51%	0.507	S	S	*	.	H	α-helix	trans	-66.6	-40.6	176.3	-74.2	169.2	0	0	0	112.2	T45 V46 A51 E52 V53	T45-L49 WeakPolarHBondContact O-CB 3.47Å; T45-L49 WeakPolarHBondContact O-CG 3.16Å; T45-L49 PolarHBondContact O-N 2.8Å; V46-L49 PolarHBondContact O-N 3.21Å; L49-A51 VanDerWaalsContact C-N 3.34Å; L49-A51 PolarHBondContact O-N 2.84Å; L49-E52 PolarHBondContact O-N 3.26Å; L49-V53 WeakPolarHBondContact O-CB 3.29Å; L49-V53 VanDerWaalsContact O-CG2 3.29Å; L49-V53 WeakPolarHBondContact O-CG2 3.5Å; L49-V53 PolarHBondContact O-N 3.48Å
50	E	87.6	Confident	86.5	Confident	116 Å²	116	97.7 Å²	97.7	54%	0.542	51%	0.514	S	S	.	.	H	α-helix	trans	-63.2	-40.4	175.8	-75.7	179.4	165.8	0	0	111.8	V46 M47 H54	V46-E50 HydrophobicContact CG1-CG 4.38Å; V46-E50 WeakPolarHBondContact O-CG 3.04Å; V46-E50 PolarHBondContact O-N 3.2Å; M47-E50 PolarHBondContact O-N 2.96Å; E50-H54 WeakPolarHBondContact O-CB 3.35Å; E50-H54 PolarHBondContact O-N 2.99Å
51	A	88.1	Confident	86.6	Confident	63 Å²	63	100.2 Å²	100.2	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-41.7	174.8	0	0	0	0	0	111.9	M47 A48 L49 H54 R55	M47-A51 WeakPolarHBondContact O-CB 3.28Å; M47-A51 PolarHBondContact O-N 2.85Å; A48-A51 PolarHBondContact O-N 2.72Å; L49-A51 VanDerWaalsContact C-N 3.34Å; L49-A51 PolarHBondContact O-N 2.84Å; A51-H54 PolarHBondContact O-N 2.93Å; A51-R55 PolarHBondContact O-N 2.89Å
52	E	86.7	Confident	86.7	Confident	78 Å²	78	100.7 Å²	100.7	36%	0.364	52%	0.522	S	S	.	.	H	α-helix	trans	-68.5	-41.4	178.3	-174.7	59.6	-168.6	0	0	112.2	A48 L49 H54 R55 L56	A48-E52 PolarHBondContact O-N 2.83Å; L49-E52 PolarHBondContact O-N 3.26Å; E52-H54 VanDerWaalsContact C-N 3.28Å; E52-H54 PolarHBondContact O-N 2.77Å; E52-R55 WeakPolarHBondContact O-CB 3.41Å; E52-R55 PolarHBondContact O-N 3.43Å; E52-R55 VanDerWaalsContact O-N 3.14Å; E52-R55 IonicContact OE1-CZ 2.69Å; E52-R55 IonicContact OE1-NE 3.14Å; E52-R55 PolarHBondContact OE1-NE 3.04Å; E52-R55 IonicContact OE1-NH2 3.31Å; E52-R55 PolarHBondContact OE1-NH2 2.74Å; E52-R55 IonicContact OE2-CZ 3.78Å; E52-R55 IonicContact OE2-NE 2.66Å; E52-R55 PolarHBondContact OE2-NE 3.05Å; E52-R55 IonicContact OE2-NH2 2.67Å; E52-L56 HydrophobicContact CG-CD1 4.21Å; E52-L56 WeakPolarHBondContact O-CB 3.46Å; E52-L56 WeakPolarHBondContact O-CG 3.31Å; E52-L56 PolarHBondContact O-N 2.8Å
53	V	86.2	Confident	86.6	Confident	76 Å²	76	99.5 Å²	99.5	46%	0.461	52%	0.516	S	S	.	.	H	α-helix	trans	-60.9	-39.5	173.4	169.2	0	0	0	0	111	L49 K57	L49-V53 WeakPolarHBondContact O-CB 3.29Å; L49-V53 VanDerWaalsContact O-CG2 3.29Å; L49-V53 WeakPolarHBondContact O-CG2 3.5Å; L49-V53 PolarHBondContact O-N 3.48Å; V53-K57 HydrophobicContact CG1-CD 4.42Å; V53-K57 WeakPolarHBondContact O-CB 3.19Å; V53-K57 WeakPolarHBondContact O-CG 3.26Å; V53-K57 PolarHBondContact O-N 2.83Å
54	H	88.3	Confident	86.5	Confident	125 Å²	125	96.4 Å²	96.4	58%	0.579	51%	0.512	S	S	*	.	H	α-helix	trans	-65.4	-42	174.6	-171.1	-57.3	0	0	0	111.6	E50 A51 E52 K57 C58	E50-H54 WeakPolarHBondContact O-CB 3.35Å; E50-H54 PolarHBondContact O-N 2.99Å; A51-H54 PolarHBondContact O-N 2.93Å; E52-H54 VanDerWaalsContact C-N 3.28Å; E52-H54 PolarHBondContact O-N 2.77Å; H54-K57 PolarHBondContact O-N 2.7Å; H54-C58 PolarHBondContact O-N 3.31Å; H54-C58 VanDerWaalsContact O-N 3.13Å
55	R	91.7	Very high	86.5	Confident	108 Å²	108	92.9 Å²	92.9	41%	0.408	50%	0.5	S	S	.	.	H	α-helix	trans	-61.5	-46.4	177.4	-167.7	-171.3	72	73	3.3	111.5	A51 E52 C58 Q59	A51-R55 PolarHBondContact O-N 2.89Å; E52-R55 WeakPolarHBondContact O-CB 3.41Å; E52-R55 PolarHBondContact O-N 3.43Å; E52-R55 VanDerWaalsContact O-N 3.14Å; E52-R55 IonicContact OE1-CZ 2.69Å; E52-R55 IonicContact OE1-NE 3.14Å; E52-R55 PolarHBondContact OE1-NE 3.04Å; E52-R55 IonicContact OE1-NH2 3.31Å; E52-R55 PolarHBondContact OE1-NH2 2.74Å; E52-R55 IonicContact OE2-CZ 3.78Å; E52-R55 IonicContact OE2-NE 2.66Å; E52-R55 PolarHBondContact OE2-NE 3.05Å; E52-R55 IonicContact OE2-NH2 2.67Å; R55-C58 PolarHBondContact O-N 2.74Å; R55-Q59 VanDerWaalsContact NH1-CD 3.26Å; R55-Q59 PolarHBondContact O-N 2.69Å
56	L	84.7	Confident	86.5	Confident	78 Å²	78	93.5 Å²	93.5	41%	0.408	50%	0.501	S	S	.	.	H	α-helix	trans	-65	-38.6	178.4	-71.7	171.3	0	0	0	112.2	E52 Q59 N60	E52-L56 HydrophobicContact CG-CD1 4.21Å; E52-L56 WeakPolarHBondContact O-CB 3.46Å; E52-L56 WeakPolarHBondContact O-CG 3.31Å; E52-L56 PolarHBondContact O-N 2.8Å; L56-Q59 PolarHBondContact O-N 3.5Å; L56-N60 PolarHBondContact O-N 3.5Å
57	K	87.1	Confident	86.2	Confident	137 Å²	137	98.4 Å²	98.4	60%	0.596	51%	0.514	S	S	*	.	H	α-helix	trans	-60.1	-46.2	173.3	-80.7	179.3	177.1	179.4	0	112	V53 H54 Q59 N60 D61	V53-K57 HydrophobicContact CG1-CD 4.42Å; V53-K57 WeakPolarHBondContact O-CB 3.19Å; V53-K57 WeakPolarHBondContact O-CG 3.26Å; V53-K57 PolarHBondContact O-N 2.83Å; H54-K57 PolarHBondContact O-N 2.7Å; K57-Q59 VanDerWaalsContact C-N 3.33Å; K57-Q59 PolarHBondContact O-N 2.93Å; K57-N60 PolarHBondContact O-N 3.49Å; K57-D61 PolarHBondContact O-N 2.86Å
58	C	87.2	Confident	86.1	Confident	61 Å²	61	99.7 Å²	99.7	41%	0.412	51%	0.512	S	S	.	.	H	α-helix	trans	-61.2	-39.9	176	-70.8	0	0	0	0	112.6	H54 R55 D61 Q62	H54-C58 PolarHBondContact O-N 3.31Å; H54-C58 VanDerWaalsContact O-N 3.13Å; R55-C58 PolarHBondContact O-N 2.74Å; C58-D61 PolarHBondContact O-N 3.43Å; C58-Q62 PolarHBondContact O-N 2.72Å; C58-Q62 VanDerWaalsContact O-N 3.09Å
59	Q	84.9	Confident	86.2	Confident	87 Å²	87	100.5 Å²	100.5	41%	0.407	51%	0.507	S	S	.	.	H	α-helix	trans	-66	-41.3	175.6	-79.9	-172.2	-46.1	0	0	112.1	R55 L56 K57 D61 Q62 L63	R55-Q59 VanDerWaalsContact NH1-CD 3.26Å; R55-Q59 PolarHBondContact O-N 2.69Å; L56-Q59 PolarHBondContact O-N 3.5Å; K57-Q59 VanDerWaalsContact C-N 3.33Å; K57-Q59 PolarHBondContact O-N 2.93Å; Q59-D61 VanDerWaalsContact C-N 3.34Å; Q59-D61 PolarHBondContact O-N 3.08Å; Q59-Q62 PolarHBondContact O-N 3.07Å; Q59-L63 WeakPolarHBondContact O-CB 3.5Å; Q59-L63 WeakPolarHBondContact O-CG 3.38Å; Q59-L63 PolarHBondContact O-N 3.32Å
60	N	83.2	Confident	86.1	Confident	108 Å²	108	98.3 Å²	98.3	58%	0.578	50%	0.498	S	S	*	.	H	α-helix	trans	-63.1	-39.8	175.6	-91.1	-4.1	0	0	0	112.2	L56 K57 Q62 L63 A64	L56-N60 PolarHBondContact O-N 3.5Å; K57-N60 PolarHBondContact O-N 3.49Å; N60-Q62 VanDerWaalsContact C-N 3.34Å; N60-Q62 PolarHBondContact O-N 2.67Å; N60-L63 PolarHBondContact O-N 3.44Å; N60-A64 VanDerWaalsContact O-CB 3.29Å; N60-A64 WeakPolarHBondContact O-CB 3.33Å; N60-A64 PolarHBondContact O-N 2.96Å
61	D	86.8	Confident	85.9	Confident	110 Å²	110	96 Å²	96	59%	0.588	49%	0.489	S	S	*	.	H	α-helix	trans	-64.9	-38.8	176.1	-70.4	-21.9	0	0	0	111.6	K57 C58 Q59 T65	K57-D61 PolarHBondContact O-N 2.86Å; C58-D61 PolarHBondContact O-N 3.43Å; Q59-D61 VanDerWaalsContact C-N 3.34Å; Q59-D61 PolarHBondContact O-N 3.08Å; D61-T65 PolarHBondContact O-N 2.81Å; D61-T65 VanDerWaalsContact O-N 3.07Å; D61-T65 PolarHBondContact O-OG1 2.92Å
62	Q	86.8	Confident	85.7	Confident	133 Å²	133	97.8 Å²	97.8	62%	0.621	49%	0.487	S	S	*	.	H	α-helix	trans	-64.6	-46.8	173	-83.5	-177.5	-26.1	0	0	112.2	C58 Q59 N60 A64 T65 N66	C58-Q62 PolarHBondContact O-N 2.72Å; C58-Q62 VanDerWaalsContact O-N 3.09Å; Q59-Q62 PolarHBondContact O-N 3.07Å; N60-Q62 VanDerWaalsContact C-N 3.34Å; N60-Q62 PolarHBondContact O-N 2.67Å; Q62-A64 PolarHBondContact O-N 3.46Å; Q62-T65 WeakPolarHBondContact O-CB 3.38Å; Q62-T65 PolarHBondContact O-N 2.88Å; Q62-N66 PolarHBondContact O-N 2.81Å
63	L	83.8	Confident	85.6	Confident	95 Å²	95	99.5 Å²	99.5	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-62.6	-41.8	178	-79.8	165	0	0	0	111.9	Q59 N60 T65 N66 Y67	Q59-L63 WeakPolarHBondContact O-CB 3.5Å; Q59-L63 WeakPolarHBondContact O-CG 3.38Å; Q59-L63 PolarHBondContact O-N 3.32Å; N60-L63 PolarHBondContact O-N 3.44Å; L63-T65 VanDerWaalsContact C-N 3.28Å; L63-T65 PolarHBondContact O-N 2.79Å; L63-N66 PolarHBondContact O-N 2.72Å; L63-Y67 WeakPolarHBondContact O-CB 3.34Å; L63-Y67 PolarHBondContact O-N 3.04Å
64	A	84.7	Confident	85.1	Confident	61 Å²	61	99.5 Å²	99.5	50%	0.504	49%	0.492	S	S	.	.	H	α-helix	trans	-61.7	-38.1	175.3	0	0	0	0	0	111.8	N60 Q62 R68	N60-A64 VanDerWaalsContact O-CB 3.29Å; N60-A64 WeakPolarHBondContact O-CB 3.33Å; N60-A64 PolarHBondContact O-N 2.96Å; Q62-A64 PolarHBondContact O-N 3.46Å; A64-R68 PolarHBondContact O-N 2.85Å; A64-R68 VanDerWaalsContact O-N 3.08Å
65	T	85.8	Confident	84.6	Confident	70 Å²	70	98.1 Å²	98.1	43%	0.429	49%	0.486	S	S	.	.	H	α-helix	trans	-67.2	-46.3	175.9	-52.3	0	0	0	0	111.3	D61 Q62 L63 Y67 R68 I69	D61-T65 PolarHBondContact O-N 2.81Å; D61-T65 VanDerWaalsContact O-N 3.07Å; D61-T65 PolarHBondContact O-OG1 2.92Å; Q62-T65 WeakPolarHBondContact O-CB 3.38Å; Q62-T65 PolarHBondContact O-N 2.88Å; L63-T65 VanDerWaalsContact C-N 3.28Å; L63-T65 PolarHBondContact O-N 2.79Å; T65-Y67 PolarHBondContact O-N 2.81Å; T65-R68 WeakPolarHBondContact O-CB 3.33Å; T65-R68 PolarHBondContact O-N 2.88Å; T65-I69 HydrophobicContact CG2-CD1 4.37Å; T65-I69 WeakPolarHBondContact O-CG1 3.49Å; T65-I69 PolarHBondContact O-N 3Å
66	N	86.4	Confident	84.1	Confident	93 Å²	93	97.5 Å²	97.5	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-61.7	-43.6	176.9	-71.7	-11.2	0	0	0	111.6	Q62 L63 R68 I69 V70	Q62-N66 PolarHBondContact O-N 2.81Å; L63-N66 PolarHBondContact O-N 2.72Å; N66-R68 VanDerWaalsContact C-N 3.28Å; N66-R68 PolarHBondContact O-N 3.18Å; N66-I69 PolarHBondContact O-N 2.98Å; N66-V70 WeakPolarHBondContact O-CG2 3.26Å; N66-V70 PolarHBondContact O-N 3.16Å
67	Y	82.2	Confident	83.7	Confident	163 Å²	163	98.5 Å²	98.5	64%	0.639	50%	0.495	S	S	*	.	H	α-helix	trans	-59.4	-40.8	176.5	-176	-105.8	0	0	0	111.5	L63 T65 V70 L71	L63-Y67 WeakPolarHBondContact O-CB 3.34Å; L63-Y67 PolarHBondContact O-N 3.04Å; T65-Y67 PolarHBondContact O-N 2.81Å; Y67-V70 PolarHBondContact O-N 2.84Å; Y67-L71 HydrophobicContact CD1-CD1 3.81Å; Y67-L71 HydrophobicContact CE1-CD1 3.23Å; Y67-L71 HydrophobicContact CE1-CG 4.41Å; Y67-L71 WeakPolarHBondContact O-CB 3.49Å; Y67-L71 PolarHBondContact O-N 2.86Å
68	R	84.8	Confident	83.1	Confident	156 Å²	156	100.5 Å²	100.5	59%	0.589	50%	0.499	S	S	*	.	H	α-helix	trans	-63.8	-42.5	176.2	-163.5	179.6	71.1	140.8	5.6	112.2	A64 T65 N66 L71 E72	A64-R68 PolarHBondContact O-N 2.85Å; A64-R68 VanDerWaalsContact O-N 3.08Å; T65-R68 WeakPolarHBondContact O-CB 3.33Å; T65-R68 PolarHBondContact O-N 2.88Å; N66-R68 VanDerWaalsContact C-N 3.28Å; N66-R68 PolarHBondContact O-N 3.18Å; R68-L71 WeakPolarHBondContact O-CB 3.26Å; R68-L71 PolarHBondContact O-N 2.99Å; R68-E72 PolarHBondContact O-N 3Å
69	I	87.3	Confident	82.5	Confident	78 Å²	78	105 Å²	105	40%	0.4	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-47.9	176.7	-66.2	166.8	0	0	0	110.5	T65 N66 L71 E72 E73	T65-I69 HydrophobicContact CG2-CD1 4.37Å; T65-I69 WeakPolarHBondContact O-CG1 3.49Å; T65-I69 PolarHBondContact O-N 3Å; N66-I69 PolarHBondContact O-N 2.98Å; I69-L71 VanDerWaalsContact C-N 3.27Å; I69-L71 PolarHBondContact O-N 3.09Å; I69-E72 PolarHBondContact O-N 3.12Å; I69-E72 VanDerWaalsContact O-N 3.15Å; I69-E73 PolarHBondContact O-N 2.85Å
70	V	84.2	Confident	82	Confident	69 Å²	69	106.3 Å²	106.3	42%	0.418	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-33.2	178.7	172.1	0	0	0	0	111.8	N66 Y67 N74	N66-V70 WeakPolarHBondContact O-CG2 3.26Å; N66-V70 PolarHBondContact O-N 3.16Å; Y67-V70 PolarHBondContact O-N 2.84Å; V70-N74 WeakPolarHBondContact CG1-ND2 3.22Å; V70-N74 VanDerWaalsContact O-CB 3.29Å; V70-N74 WeakPolarHBondContact O-CB 3.41Å; V70-N74 PolarHBondContact O-N 2.88Å; V70-N74 PolarHBondContact O-ND2 2.73Å
71	L	83.5	Confident	81.3	Confident	66 Å²	66	107.7 Å²	107.7	35%	0.346	51%	0.514	S	S	.	.	H	α-helix	trans	-67	-42.7	173.4	-113.4	158	0	0	0	112	Y67 R68 I69 N74 Q75	Y67-L71 HydrophobicContact CD1-CD1 3.81Å; Y67-L71 HydrophobicContact CE1-CD1 3.23Å; Y67-L71 HydrophobicContact CE1-CG 4.41Å; Y67-L71 WeakPolarHBondContact O-CB 3.49Å; Y67-L71 PolarHBondContact O-N 2.86Å; R68-L71 WeakPolarHBondContact O-CB 3.26Å; R68-L71 PolarHBondContact O-N 2.99Å; I69-L71 VanDerWaalsContact C-N 3.27Å; I69-L71 PolarHBondContact O-N 3.09Å; L71-N74 PolarHBondContact O-N 2.73Å; L71-Q75 WeakPolarHBondContact O-CB 3.31Å; L71-Q75 VanDerWaalsContact O-CG 3.29Å; L71-Q75 WeakPolarHBondContact O-CG 3.39Å; L71-Q75 PolarHBondContact O-N 3.39Å
72	E	84.2	Confident	80.3	Confident	102 Å²	102	107.4 Å²	107.4	48%	0.477	51%	0.512	S	S	.	.	H	α-helix	trans	-64.2	-44	175.2	-75.2	177.9	-177.8	0	0	111.3	R68 I69 Q75 L76	R68-E72 PolarHBondContact O-N 3Å; I69-E72 PolarHBondContact O-N 3.12Å; I69-E72 VanDerWaalsContact O-N 3.15Å; E72-Q75 PolarHBondContact O-N 3.11Å; E72-L76 WeakPolarHBondContact O-CG 3.48Å; E72-L76 PolarHBondContact O-N 2.79Å
73	E	83.4	Confident	78.9	Confident	113 Å²	113	107.8 Å²	107.8	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-61.8	-44.6	173.8	-78.1	-172.9	157.8	0	0	112	I69 Q75 L76 L77	I69-E73 PolarHBondContact O-N 2.85Å; E73-Q75 VanDerWaalsContact C-N 3.3Å; E73-Q75 PolarHBondContact O-N 2.96Å; E73-L76 PolarHBondContact O-N 3.46Å; E73-L77 WeakPolarHBondContact O-CB 3.49Å; E73-L77 WeakPolarHBondContact O-CG 3.45Å; E73-L77 PolarHBondContact O-N 3.15Å
74	N	76	Confident	77.6	Confident	76 Å²	76	106.4 Å²	106.4	41%	0.406	51%	0.512	S	S	.	.	H	α-helix	trans	-64	-35.1	175.9	-91.1	-68	0	0	0	112.4	V70 L71 R78	V70-N74 WeakPolarHBondContact CG1-ND2 3.22Å; V70-N74 VanDerWaalsContact O-CB 3.29Å; V70-N74 WeakPolarHBondContact O-CB 3.41Å; V70-N74 PolarHBondContact O-N 2.88Å; V70-N74 PolarHBondContact O-ND2 2.73Å; L71-N74 PolarHBondContact O-N 2.73Å; N74-R78 VanDerWaalsContact O-CB 3.24Å; N74-R78 WeakPolarHBondContact O-CB 2.95Å; N74-R78 WeakPolarHBondContact O-CG 3.14Å; N74-R78 PolarHBondContact O-N 3.16Å
75	Q	79.1	Confident	75.9	Confident	97 Å²	97	109 Å²	109	45%	0.453	51%	0.512	S	S	.	.	H	α-helix	trans	-68.4	-38.9	174	-76.3	-179.4	14	0	0	111.6	L71 E72 E73 R79	L71-Q75 WeakPolarHBondContact O-CB 3.31Å; L71-Q75 VanDerWaalsContact O-CG 3.29Å; L71-Q75 WeakPolarHBondContact O-CG 3.39Å; L71-Q75 PolarHBondContact O-N 3.39Å; E72-Q75 PolarHBondContact O-N 3.11Å; E73-Q75 VanDerWaalsContact C-N 3.3Å; E73-Q75 PolarHBondContact O-N 2.96Å; Q75-R79 WeakPolarHBondContact O-CB 3.42Å; Q75-R79 WeakPolarHBondContact O-CG 3.27Å; Q75-R79 PolarHBondContact O-N 2.89Å
76	L	80.4	Confident	73.9	Confident	94 Å²	94	111.2 Å²	111.2	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-65.8	-46.6	174.5	-74.6	169.5	0	0	0	111.6	E72 E73 R78 R79 Q80	E72-L76 WeakPolarHBondContact O-CG 3.48Å; E72-L76 PolarHBondContact O-N 2.79Å; E73-L76 PolarHBondContact O-N 3.46Å; L76-R78 PolarHBondContact O-N 3.08Å; L76-R79 WeakPolarHBondContact O-CB 3.31Å; L76-R79 PolarHBondContact O-N 3.39Å; L76-Q80 WeakPolarHBondContact O-CG 3.26Å; L76-Q80 PolarHBondContact O-N 2.82Å
77	L	76.6	Confident	71.6	Confident	99 Å²	99	108.5 Å²	108.5	52%	0.518	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-41	175.8	-74.1	168.2	0	0	0	111.3	E73 R79 Q80 F81	E73-L77 WeakPolarHBondContact O-CB 3.49Å; E73-L77 WeakPolarHBondContact O-CG 3.45Å; E73-L77 PolarHBondContact O-N 3.15Å; L77-R79 PolarHBondContact O-N 3Å; L77-Q80 PolarHBondContact O-N 3.37Å; L77-F81 WeakPolarHBondContact O-CB 2.97Å; L77-F81 PolarHBondContact O-N 3.37Å
78	R	74.2	Confident	69.6	Low	179 Å²	179	107.7 Å²	107.7	68%	0.675	52%	0.519	S	S	*	.	H	α-helix	trans	-63.6	-39.7	173.4	-77.7	174.6	-179.9	-125.8	1	112.1	N74 L76 F81 I82	N74-R78 VanDerWaalsContact O-CB 3.24Å; N74-R78 WeakPolarHBondContact O-CB 2.95Å; N74-R78 WeakPolarHBondContact O-CG 3.14Å; N74-R78 PolarHBondContact O-N 3.16Å; L76-R78 PolarHBondContact O-N 3.08Å; R78-F81 PolarHBondContact O-N 3.01Å; R78-I82 WeakPolarHBondContact O-CB 3.41Å; R78-I82 WeakPolarHBondContact O-CD1 3.23Å; R78-I82 WeakPolarHBondContact O-CG1 3.18Å; R78-I82 PolarHBondContact O-N 3.14Å
79	R	73.6	Confident	67.1	Low	155 Å²	155	106.4 Å²	106.4	59%	0.585	52%	0.519	S	S	*	.	H	α-helix	trans	-65.3	-41.9	173.8	-76.4	177.8	-173.6	158.5	5.2	111.7	Q75 L76 L77 F81 I82 Q83	Q75-R79 WeakPolarHBondContact O-CB 3.42Å; Q75-R79 WeakPolarHBondContact O-CG 3.27Å; Q75-R79 PolarHBondContact O-N 2.89Å; L76-R79 WeakPolarHBondContact O-CB 3.31Å; L76-R79 PolarHBondContact O-N 3.39Å; L77-R79 PolarHBondContact O-N 3Å; R79-F81 VanDerWaalsContact C-N 3.34Å; R79-I82 PolarHBondContact O-N 3.1Å; R79-Q83 WeakPolarHBondContact O-CB 3.3Å; R79-Q83 WeakPolarHBondContact O-CG 3.45Å; R79-Q83 PolarHBondContact O-N 2.97Å
80	Q	75.7	Confident	64.4	Low	116 Å²	116	105.6 Å²	105.6	54%	0.542	52%	0.521	S	S	.	.	H	α-helix	trans	-64.7	-38.4	175	-74.5	177.9	-14.3	0	0	111.8	L76 L77 Q83 S84	L76-Q80 WeakPolarHBondContact O-CG 3.26Å; L76-Q80 PolarHBondContact O-N 2.82Å; L77-Q80 PolarHBondContact O-N 3.37Å; Q80-Q83 PolarHBondContact O-N 3.06Å; Q80-S84 PolarHBondContact O-N 2.92Å; Q80-S84 PolarHBondContact O-OG 2.86Å
81	F	68.5	Low	61.9	Low	136 Å²	136	110.8 Å²	110.8	60%	0.596	54%	0.54	S	S	*	.	H	α-helix	trans	-71.5	-33	177.7	-158.6	-89	0	0	0	112.6	L77 R78 R79 S84 F85	L77-F81 WeakPolarHBondContact O-CB 2.97Å; L77-F81 PolarHBondContact O-N 3.37Å; R78-F81 PolarHBondContact O-N 3.01Å; R79-F81 VanDerWaalsContact C-N 3.34Å; F81-S84 VanDerWaalsContact CA-OG 3.29Å; F81-S84 WeakPolarHBondContact CA-OG 3.28Å; F81-S84 PolarHBondContact O-OG 2.93Å; F81-F85 HydrophobicContact CD1-CD2 4.5Å; F81-F85 HydrophobicContact CE1-CD2 4.08Å; F81-F85 HydrophobicContact CE1-CE2 4.19Å; F81-F85 PolarHBondContact O-N 2.81Å
82	I	65.1	Low	59.5	Low	104 Å²	104	115 Å²	115	53%	0.533	56%	0.562	S	S	.	*	H	α-helix	trans	-72	-40.4	171.9	-69.4	163.7	0	0	0	110.1	R78 R79 S84 F85 D86	R78-I82 WeakPolarHBondContact O-CB 3.41Å; R78-I82 WeakPolarHBondContact O-CD1 3.23Å; R78-I82 WeakPolarHBondContact O-CG1 3.18Å; R78-I82 PolarHBondContact O-N 3.14Å; R79-I82 PolarHBondContact O-N 3.1Å; I82-S84 VanDerWaalsContact C-N 3.34Å; I82-S84 PolarHBondContact O-N 3.11Å; I82-F85 PolarHBondContact O-N 2.71Å; I82-D86 PolarHBondContact O-N 3.08Å
83	Q	57.4	Low	56.8	Low	142 Å²	142	114.6 Å²	114.6	66%	0.664	57%	0.57	S	S	*	*	H	α-helix	trans	-65.6	-32.9	174.9	-78.1	177.3	-15.6	0	0	113.1	R79 Q80 G87	R79-Q83 WeakPolarHBondContact O-CB 3.3Å; R79-Q83 WeakPolarHBondContact O-CG 3.45Å; R79-Q83 PolarHBondContact O-N 2.97Å; Q80-Q83 PolarHBondContact O-N 3.06Å; Q83-G87 PolarHBondContact O-N 2.76Å; Q83-G87 VanDerWaalsContact O-N 3.17Å
84	S	56.3	Low	54.1	Low	66 Å²	66	120.1 Å²	120.1	46%	0.462	59%	0.586	S	S	.	*	H	α-helix	trans	-74.3	-25.9	174.1	56.2	0	0	0	0	112.9	Q80 F81 I82 M88	Q80-S84 PolarHBondContact O-N 2.92Å; Q80-S84 PolarHBondContact O-OG 2.86Å; F81-S84 VanDerWaalsContact CA-OG 3.29Å; F81-S84 WeakPolarHBondContact CA-OG 3.28Å; F81-S84 PolarHBondContact O-OG 2.93Å; I82-S84 VanDerWaalsContact C-N 3.34Å; I82-S84 PolarHBondContact O-N 3.11Å; S84-M88 PolarHBondContact O-N 3.27Å
85	F	49.3	Very low	51.8	Low	116 Å²	116	124.3 Å²	124.3	51%	0.509	61%	0.607	S	S	.	*	H	α-helix	trans	-79.1	-34.5	172.6	-115.2	-91	0	0	0	113.4	F81 I82 G87 M88 H89	F81-F85 HydrophobicContact CD1-CD2 4.5Å; F81-F85 HydrophobicContact CE1-CD2 4.08Å; F81-F85 HydrophobicContact CE1-CE2 4.19Å; F81-F85 PolarHBondContact O-N 2.81Å; I82-F85 PolarHBondContact O-N 2.71Å; F85-G87 PolarHBondContact O-N 2.76Å; F85-M88 PolarHBondContact O-N 2.75Å; F85-H89 PolarHBondContact O-N 2.81Å
86	D	42.9	Very low	49.4	Very low	115 Å²	115	127.1 Å²	127.1	62%	0.615	63%	0.625	S	S	*	*	H	α-helix	trans	-70.5	-22	171.6	-78.1	-21.7	0	0	0	112.2	I82	I82-D86 PolarHBondContact O-N 3.08Å
87	G	40.1	Very low	46.8	Very low	36 Å²	36	127.5 Å²	127.5	37%	0.371	64%	0.642	S	S	.	*	H	α-helix	trans	-69.2	-39.9	170	0	0	0	0	0	113.7	Q83 F85 S90	Q83-G87 PolarHBondContact O-N 2.76Å; Q83-G87 VanDerWaalsContact O-N 3.17Å; F85-G87 PolarHBondContact O-N 2.76Å; G87-S90 PolarHBondContact O-N 3.42Å; G87-S90 PolarHBondContact O-OG 3.35Å
88	M	38.4	Very low	44.5	Very low	146 Å²	146	129.3 Å²	129.3	72%	0.719	66%	0.657	S	S	*	*	H	α-helix	trans	-80.2	-16	-178.8	-83.2	-175.5	75.6	0	0	114.5	S84 F85	S84-M88 PolarHBondContact O-N 3.27Å; F85-M88 PolarHBondContact O-N 2.75Å
89	H	33.4	Very low	42.5	Very low	129 Å²	129	126.5 Å²	126.5	60%	0.597	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	0.8	170.1	-83.7	-66.6	0	0	0	114.1	F85	F85-H89 PolarHBondContact O-N 2.81Å
90	S	30.6	Very low	40.2	Very low	61 Å²	61	128.8 Å²	128.8	43%	0.427	68%	0.677	S	S	.	*	S	Bend	trans	-93.2	-0.4	176.5	79.3	0	0	0	0	115.4	G87	G87-S90 PolarHBondContact O-N 3.42Å; G87-S90 PolarHBondContact O-OG 3.35Å
91	E	32.4	Very low	37.9	Very low	178 Å²	178	130.6 Å²	130.6	83%	0.832	69%	0.69	S	S	*	*	S	Bend	trans	-104.4	2.4	174	-82.4	-173.1	158.1	0	0	114.8
92	I	32.1	Very low	36.2	Very low	154 Å²	154	129.1 Å²	129.1	79%	0.79	69%	0.694	S	S	*	*	S	Bend	trans	-122.4	6.5	179	-62.7	175.6	0	0	0	113.1
93	S	26.5	Very low	34.4	Very low	94 Å²	94	130.4 Å²	130.4	66%	0.657	71%	0.706	S	S	*	*			trans	-147.7	75.4	172.1	55.8	0	0	0	0	113
94	R	26.9	Very low	32.9	Very low	229 Å²	229	132.4 Å²	132.4	86%	0.864	72%	0.716	S	S	*	*			trans	-128.3	76.9	158.2	-78.7	-174.3	175.7	168.3	1.5	108.9
95	I	29.5	Very low	31.5	Very low	164 Å²	164	135.3 Å²	135.3	84%	0.841	73%	0.731	S	S	*	*			trans	-110.8	114.4	148.2	-65.3	176	0	0	0	104.8
96	D	27	Very low	30.5	Very low	156 Å²	156	138.9 Å²	138.9	83%	0.834	75%	0.749	S	S	*	*			trans	8	117.7	165	-60.5	-32.7	0	0	0	118.6
97	A	26.2	Very low	29.7	Very low	103 Å²	103	138.5 Å²	138.5	85%	0.851	75%	0.751	S	S	*	*				165.9	129.6	102.9	0	0	0	0	0	112.2
98	T	28.7	Very low	29.1	Very low	136 Å²	136	146.1 Å²	146.1	83%	0.834	77%	0.774	S	S	*	*			trans	-110.1	166.9	155.9	50.5	0	0	0	0	108.2
99	P	32.1	Very low	28.6	Very low	120 Å²	120	144.6 Å²	144.6	78%	0.779	78%	0.775	S	S	*	*			cis	-130.6	163.9	-33.7	31.1	-12.3	0	0	0	112.7
100	F	25.5	Very low	28.2	Very low	203 Å²	203	143.4 Å²	143.4	89%	0.89	78%	0.781	S	S	*	*			trans	-74.6	136	171.7	-101.3	-95.7	0	0	0	112.4
101	D	26.4	Very low	27.9	Very low	155 Å²	155	146.6 Å²	146.6	83%	0.829	80%	0.798	S	S	*	*			trans	-100.7	151.4	140.6	-104	-27.2	0	0	0	108.7
102	P	32.7	Very low	27.5	Very low	104 Å²	104	142.3 Å²	142.3	68%	0.675	79%	0.793	S	S	*	*			trans	-111.3	138.5	-153.3	36.2	-24.8	0	0	0	113.4
103	V	27.3	Very low	27.4	Very low	131 Å²	131	143 Å²	143	79%	0.794	80%	0.796	S	S	*	*			trans	-149.5	119.3	154.6	-178.5	0	0	0	0	111.8
104	E	26.6	Very low	27.4	Very low	184 Å²	184	146.7 Å²	146.7	86%	0.86	80%	0.804	S	S	*	*			trans	39.2	137	143.9	-61	179.5	155.6	0	0	123.6
105	V	26.6	Very low	27.9	Very low	128 Å²	128	141.1 Å²	141.1	78%	0.776	80%	0.797	S	S	*	*			trans	-71.9	133.7	178.7	172.6	0	0	0	0	110.7
106	E	28.2	Very low	27.8	Very low	191 Å²	191	137.7 Å²	137.7	89%	0.893	79%	0.793	S	S	*	*			trans	-157.2	143.5	131.5	-113.9	175.8	-162.3	0	0	114.3
107	T	26.5	Very low	27.7	Very low	107 Å²	107	134.6 Å²	134.6	66%	0.656	79%	0.789	S	S	*	*			trans	-75.4	141.7	-164.1	54.3	0	0	0	0	115.1
108	K	27.2	Very low	27.8	Very low	195 Å²	195	137.5 Å²	137.5	85%	0.848	79%	0.789	S	S	*	*				158.5	157.7	105.2	-88.4	-163.3	-179.2	166.3	0	114
109	P	28.1	Very low	27.6	Very low	114 Å²	114	137.8 Å²	137.8	74%	0.74	78%	0.784	S	S	*	*			trans	-119.1	-177	-147.8	41.2	-28.5	0	0	0	115.5
110	S	25.4	Very low	27.3	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	78%	0.783	S	S	*	*			trans	107.4	142.7	157.6	79.6	0	0	0	0	116.2
111	T	24.9	Very low	27.3	Very low	128 Å²	128	131.9 Å²	131.9	79%	0.785	78%	0.777	S	S	*	*			cis	-168	153.5	-15.6	18.6	0	0	0	0	105.4
112	A	24.3	Very low	27.5	Very low	88 Å²	88	129.8 Å²	129.8	73%	0.727	77%	0.772	S	S	*	*			trans	70.7	124.5	153.1	0	0	0	0	0	119.9
113	I	29.6	Very low	27.4	Very low	167 Å²	167	132.3 Å²	132.3	86%	0.856	78%	0.779	S	S	*	*				-172	117.2	99	-82.3	153.4	0	0	0	108.6
114	E	25.8	Very low	27.5	Very low	173 Å²	173	131.8 Å²	131.8	81%	0.808	78%	0.778	S	S	*	*			trans	-74.4	-176.7	159	-95.3	-167.7	174.7	0	0	110.6
115	P	38.5	Very low	27.3	Very low	112 Å²	112	132.7 Å²	132.7	73%	0.727	78%	0.779	S	S	*	*			cis	-141.6	-169.3	-44.7	39.5	-21	0	0	0	111.8
116	A	25.4	Very low	27.4	Very low	92 Å²	92	130.8 Å²	130.8	76%	0.76	78%	0.777	S	S	*	*			trans	130.9	105.5	133.3	0	0	0	0	0	117.7
117	A	25.2	Very low	27.2	Very low	91 Å²	91	130.9 Å²	130.9	75%	0.752	78%	0.777	S	S	*	*				53.9	125.1	120.3	0	0	0	0	0	123.7
118	L	28.4	Very low	27.2	Very low	163 Å²	163	133.5 Å²	133.5	85%	0.853	79%	0.787	S	S	*	*			trans	-167.7	108.7	137.5	-101.6	133.4	0	0	0	107.1
119	I	25.8	Very low	27.1	Very low	142 Å²	142	128.7 Å²	128.7	73%	0.728	78%	0.784	S	S	*	*				73.1	110.1	83.5	-64.4	174.4	0	0	0	115.4
120	S	24.8	Very low	27	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	79%	0.786	S	S	*	*			trans	76.7	132.1	138.5	75	0	0	0	0	124.4
121	A	25.5	Very low	26.8	Very low	91 Å²	91	134.2 Å²	134.2	75%	0.752	79%	0.792	S	S	*	*				119.7	155.3	127.4	0	0	0	0	0	116.1
122	P	31.4	Very low	26.8	Very low	111 Å²	111	135.4 Å²	135.4	72%	0.721	79%	0.792	S	S	*	*				-136	164.7	-107	31.7	-9.2	0	0	0	117.1
123	L	30.1	Very low	26.8	Very low	157 Å²	157	137.3 Å²	137.3	82%	0.822	79%	0.79	S	S	*	*			trans	59.8	146.6	149.8	-79.7	161.1	0	0	0	119
124	P	29.1	Very low	26.5	Very low	121 Å²	121	138.4 Å²	138.4	79%	0.786	79%	0.791	S	S	*	*				-155.6	163.4	69.6	38.7	-15.8	0	0	0	119.8
125	K	23.3	Very low	26.4	Very low	202 Å²	202	137.9 Å²	137.9	88%	0.878	79%	0.789	S	S	*	*			trans	-10.9	127.4	156	-60.7	173.7	176.5	179.7	0	119.4
126	A	28.5	Very low	25.7	Very low	89 Å²	89	140.1 Å²	140.1	74%	0.736	79%	0.789	S	S	*	*			trans	-147	115.2	138.4	0	0	0	0	0	105.1
127	Q	23.5	Very low	25.7	Very low	192 Å²	192	142.1 Å²	142.1	90%	0.897	80%	0.795	S	S	*	*				40	83.2	79.9	-84.2	-175.1	-25.6	0	0	112.5
128	D	27.1	Very low	25.6	Very low	162 Å²	162	141.1 Å²	141.1	87%	0.866	78%	0.782	S	S	*	*			trans	-139.2	129.9	143.2	-91.2	-37.4	0	0	0	109.5
129	A	23.4	Very low	25.5	Very low	94 Å²	94	137.8 Å²	137.8	78%	0.777	77%	0.773	S	S	*	*			trans	-71.1	123.1	178.2	0	0	0	0	0	109.4
130	I	26.1	Very low	25.6	Very low	154 Å²	154	142.3 Å²	142.3	79%	0.79	78%	0.781	S	S	*	*			trans	-103.3	101	154.7	-62.3	-179.5	0	0	0	105.1	I132	I130-I132 PolarHBondContact O-N 3.45Å
131	E	22.3	Very low	25.8	Very low	182 Å²	182	141.5 Å²	141.5	85%	0.85	77%	0.768	S	S	*	*			trans	-53.9	101.4	162.3	-78	177.5	144.3	0	0	108.2	N133	E131-N133 VanDerWaalsContact C-N 3.32Å; E131-N133 PolarHBondContact O-N 2.85Å; E131-N133 VanDerWaalsContact O-N 3.09Å
132	I	24.9	Very low	26	Very low	152 Å²	152	140.8 Å²	140.8	78%	0.779	76%	0.757	S	S	*	*			trans	-71.8	101.2	159.7	-64	174.2	0	0	0	104.9	I130 Q134	I130-I132 PolarHBondContact O-N 3.45Å; I132-Q134 PolarHBondContact O-N 3.05Å
133	N	24	Very low	26	Very low	129 Å²	129	139.2 Å²	139.2	69%	0.69	75%	0.747	S	S	*	*			trans	-44.5	108.3	172.1	-129.3	-15.9	0	0	0	109.1	E131 Q135	E131-N133 VanDerWaalsContact C-N 3.32Å; E131-N133 PolarHBondContact O-N 2.85Å; E131-N133 VanDerWaalsContact O-N 3.09Å; N133-Q135 PolarHBondContact O-N 3.24Å
134	Q	23.8	Very low	26.1	Very low	190 Å²	190	134.4 Å²	134.4	89%	0.888	72%	0.724	S	S	*	*			trans	-68.3	77.9	163.2	-72.7	-179.4	-6.3	0	0	107.5	I132 Q136	I132-Q134 PolarHBondContact O-N 3.05Å; Q134-Q136 PolarHBondContact O-N 3.32Å
135	Q	24.1	Very low	26.1	Very low	162 Å²	162	134.8 Å²	134.8	76%	0.757	71%	0.713	S	S	*	*			trans	-79.7	111.4	161.2	-80.9	-172.5	-21.2	0	0	107.9	N133	N133-Q135 PolarHBondContact O-N 3.24Å
136	Q	22.5	Very low	26.6	Very low	158 Å²	158	133.4 Å²	133.4	74%	0.738	71%	0.71	S	S	*	*			trans	-41.6	135.3	165.7	-63	-179.4	-44.1	0	0	111.1	Q134 S138	Q134-Q136 PolarHBondContact O-N 3.32Å; Q136-S138 PolarHBondContact O-N 3.11Å
137	P	25	Very low	26.7	Very low	135 Å²	135	135.4 Å²	135.4	88%	0.877	70%	0.698	S	S	*	*			trans	-83	68.7	161.7	35.5	-29	0	0	0	107.6
138	S	23.5	Very low	27	Very low	69 Å²	69	128.5 Å²	128.5	48%	0.483	67%	0.674	S	S	.	*			trans	-105	123.8	165.6	55.5	0	0	0	0	107.7	Q136	Q136-S138 PolarHBondContact O-N 3.11Å
139	S	25.9	Very low	27.1	Very low	94 Å²	94	127.5 Å²	127.5	66%	0.657	67%	0.669	S	S	*	*	S	Bend	trans	95.1	34.5	166.7	92.6	0	0	0	0	121
140	W	28.9	Very low	27.5	Very low	236 Å²	236	127.8 Å²	127.8	89%	0.894	67%	0.665	S	S	*	*	S	Bend	trans	-112.8	6.4	166.3	-66.1	82.3	0	0	0	114.6
141	L	29.5	Very low	27.6	Very low	92 Å²	92	123 Å²	123	48%	0.482	64%	0.641	S	S	.	*			trans	-99.7	8	174.8	-76.5	164.8	0	0	0	113.7	P143 V144	L141-P143 VanDerWaalsContact C-N 3.28Å; L141-P143 WeakPolarHBondContact O-CD 3.17Å; L141-P143 VanDerWaalsContact O-N 3.14Å; L141-V144 HydrophobicContact CD2-CG2 4.13Å; L141-V144 WeakPolarHBondContact O-CB 3.44Å; L141-V144 PolarHBondContact O-N 3.1Å
142	S	29.5	Very low	27.8	Very low	76 Å²	76	125.1 Å²	125.1	53%	0.531	64%	0.641	S	S	.	*	G	3₁₀ helix	trans	-52.7	-29.3	-179.9	-35.9	0	0	0	0	115.7	V144 F145	S142-V144 VanDerWaalsContact C-N 3.26Å; S142-V144 PolarHBondContact O-N 3.47Å; S142-F145 PolarHBondContact O-N 2.91Å
143	P	31.9	Very low	28	Very low	78 Å²	78	122.6 Å²	122.6	51%	0.506	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-71.4	-16.8	177.2	-15	29.4	0	0	0	114.2	L141 F145	L141-P143 VanDerWaalsContact C-N 3.28Å; L141-P143 WeakPolarHBondContact O-CD 3.17Å; L141-P143 VanDerWaalsContact O-N 3.14Å; P143-F145 VanDerWaalsContact C-N 3.3Å
144	V	31.8	Very low	28.1	Very low	55 Å²	55	118 Å²	118	33%	0.333	61%	0.612	S	S	.	*	G	3₁₀ helix	trans	-74.3	-24.3	-179.5	-178.8	0	0	0	0	111.5	L141 S142	L141-V144 HydrophobicContact CD2-CG2 4.13Å; L141-V144 WeakPolarHBondContact O-CB 3.44Å; L141-V144 PolarHBondContact O-N 3.1Å; S142-V144 VanDerWaalsContact C-N 3.26Å; S142-V144 PolarHBondContact O-N 3.47Å
145	F	29.6	Very low	28.5	Very low	130 Å²	130	113 Å²	113	57%	0.57	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-20.1	-169.7	-74.2	-81.5	0	0	0	114.9	S142 P143 W147	S142-F145 PolarHBondContact O-N 2.91Å; P143-F145 VanDerWaalsContact C-N 3.3Å; F145-W147 PolarHBondContact O-N 3.12Å
146	E	33.1	Very low	28.8	Very low	173 Å²	173	105.5 Å²	105.5	81%	0.808	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-7.7	171.8	-78.3	-174.4	159.6	0	0	113
147	W	30.8	Very low	29.2	Very low	130 Å²	130	98.2 Å²	98.2	49%	0.492	52%	0.52	S	S	.	.	S	Bend	trans	-89.7	-22.4	-175	-69.1	-20.2	0	0	0	115.4	F145 D149 S150 L151	F145-W147 PolarHBondContact O-N 3.12Å; W147-D149 VanDerWaalsContact C-N 3.34Å; W147-D149 PolarHBondContact O-N 3.03Å; W147-S150 PolarHBondContact O-N 2.81Å; W147-L151 HydrophobicContact CB-CD1 4.44Å; W147-L151 WeakPolarHBondContact O-CD1 3.43Å; W147-L151 WeakPolarHBondContact O-CG 3.24Å
148	A	28.8	Very low	29.6	Very low	47 Å²	47	92 Å²	92	39%	0.388	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-66.4	-31.3	-171.4	0	0	0	0	0	113.9
149	D	29.7	Very low	30.2	Very low	142 Å²	142	88.8 Å²	88.8	76%	0.759	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-82.5	-18.3	-178.1	-80.1	-28.3	0	0	0	113.9	W147	W147-D149 VanDerWaalsContact C-N 3.34Å; W147-D149 PolarHBondContact O-N 3.03Å
150	S	31.4	Very low	30.5	Very low	100 Å²	100	84.9 Å²	84.9	70%	0.699	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-89.2	-3.6	175.1	-96.4	0	0	0	0	114.4	W147	W147-S150 PolarHBondContact O-N 2.81Å
151	L	27.8	Very low	30.5	Very low	53 Å²	53	74.3 Å²	74.3	28%	0.277	39%	0.389	S	S	.	.			trans	-95.8	7.6	-169.8	-82.2	165.8	0	0	0	115.5	W147 S153	W147-L151 HydrophobicContact CB-CD1 4.44Å; W147-L151 WeakPolarHBondContact O-CD1 3.43Å; W147-L151 WeakPolarHBondContact O-CG 3.24Å; L151-S153 PolarHBondContact O-N 2.88Å
152	R	27.8	Very low	30.4	Very low	226 Å²	226	72.5 Å²	72.5	85%	0.853	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	1.9	-179.2	-68.7	-170.7	-171.6	-164.7	3.9	115.3
153	S	29.1	Very low	30.4	Very low	99 Å²	99	72.9 Å²	72.9	69%	0.692	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132	3.4	-174.9	76.4	0	0	0	0	118.5	L151	L151-S153 PolarHBondContact O-N 2.88Å
154	L	26.2	Very low	30.1	Very low	33 Å²	33	72.7 Å²	72.7	17%	0.173	37%	0.367	C	S	.	.			trans	-132.9	135.8	-164.6	-79.9	139.9	0	0	0	115.4
155	K	31.1	Very low	29.8	Very low	84 Å²	84	74.3 Å²	74.3	37%	0.365	38%	0.38	S	S	.	.			trans	-80.6	130.8	179.9	-62.4	170.9	-177.9	168.6	0	109.3	V1061 L1135	K155-V1061 HydrophobicContact CD-CG2 4.37Å; K155-L1135 HydrophobicContact CB-CD2 4.22Å; K155-L1135 HydrophobicContact CD-CD1 4.44Å
156	A	30.3	Very low	29.5	Very low	5 Å²	5	70.5 Å²	70.5	4%	0.041	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	157.4	-176.4	0	0	0	0	0	111.3	L1135 L1136 F1141	A156-L1135 CarbonylContact O-C 3.59Å; A156-L1135 VanDerWaalsContact O-CA 3.32Å; A156-L1135 WeakPolarHBondContact O-CA 3.25Å; A156-L1136 PolarHBondContact O-N 2.87Å; A156-F1141 HydrophobicContact CB-CB 3.7Å; A156-F1141 HydrophobicContact CB-CD1 3.79Å; A156-F1141 HydrophobicContact CB-CD2 3.13Å; A156-F1141 HydrophobicContact CB-CE1 4.23Å; A156-F1141 HydrophobicContact CB-CE2 3.62Å; A156-F1141 HydrophobicContact CB-CG 3.21Å; A156-F1141 HydrophobicContact CB-CZ 4.15Å
157	T	31.9	Very low	29	Very low	5 Å²	5	66 Å²	66	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.2	-165.7	-40.7	0	0	0	0	112.9	I1073 V1133 C1134 L1135 K1184 I1185 V1186	T157-I1073 VanDerWaalsContact CB-CD1 3.5Å; T157-I1073 HydrophobicContact CG2-CD1 3.71Å; T157-V1133 HydrophobicContact CG2-CG1 3.21Å; T157-C1134 CarbonylContact C-O 3.5Å; T157-C1134 WeakPolarHBondContact CA-O 3.1Å; T157-C1134 VanDerWaalsContact CG2-O 3.24Å; T157-C1134 WeakPolarHBondContact CG2-O 3.46Å; T157-L1135 HydrophobicContact CG2-CD2 4.26Å; T157-L1135 VanDerWaalsContact OG1-CD2 3.3Å; T157-L1135 WeakPolarHBondContact OG1-CD2 3.05Å; T157-K1184 PolarHBondContact N-O 3.48Å; T157-I1185 WeakPolarHBondContact O-CA 3.48Å; T157-V1186 PolarHBondContact O-N 3.18Å; T157-V1186 VanDerWaalsContact O-N 3.08Å
158	V	34.1	Very low	28.7	Very low	6 Å²	6	69.3 Å²	69.3	4%	0.036	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	137.1	169.9	175	0	0	0	0	109.4	V1133 C1134 L1136 V1186 M1236	V158-V1133 WeakPolarHBondContact O-CA 3.25Å; V158-C1134 PolarHBondContact N-O 3.13Å; V158-C1134 PolarHBondContact O-N 2.89Å; V158-L1136 HydrophobicContact CG2-CD1 3.21Å; V158-L1136 HydrophobicContact CG2-CD2 3.95Å; V158-L1136 HydrophobicContact CG2-CG 3.5Å; V158-L1136 VanDerWaalsContact CG2-CG 3.5Å; V158-V1186 WeakPolarHBondContact CA-O 3.5Å; V158-V1186 HydrophobicContact CG2-CB 3.87Å; V158-V1186 HydrophobicContact CG2-CG1 4.25Å; V158-V1186 HydrophobicContact CG2-CG2 4.48Å; V158-M1236 HydrophobicContact CB-CE 4.44Å; V158-M1236 HydrophobicContact CG1-CE 4.35Å; V158-M1236 HydrophobicContact CG2-CE 4.37Å
159	V	36.1	Very low	28.4	Very low	1 Å²	1	71 Å²	71	1%	0.006	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.4	172.8	-177.1	0	0	0	0	108.8	L1071 F1093 I1095 Y1123 V1133 I1185 V1186 G1188	V159-L1071 HydrophobicContact CG1-CD2 4.1Å; V159-L1071 HydrophobicContact CG2-CD2 3.69Å; V159-F1093 HydrophobicContact CB-CD1 4.23Å; V159-F1093 HydrophobicContact CB-CE1 4.04Å; V159-F1093 HydrophobicContact CG1-CD1 4.08Å; V159-F1093 HydrophobicContact CG1-CE1 3.88Å; V159-F1093 HydrophobicContact CG2-CD1 4.31Å; V159-I1095 HydrophobicContact CG1-CD1 4.3Å; V159-I1095 HydrophobicContact CG1-CG1 4.49Å; V159-Y1123 HydrophobicContact CG1-CE1 4.08Å; V159-Y1123 WeakPolarHBondContact CG1-OH 3.47Å; V159-V1133 HydrophobicContact CG2-CG2 4.32Å; V159-I1185 HydrophobicContact CB-CG2 4.47Å; V159-I1185 HydrophobicContact CG2-CG2 3.81Å; V159-V1186 PolarHBondContact N-O 3.34Å; V159-G1188 PolarHBondContact O-N 3.18Å
160	H	31.2	Very low	28.1	Very low	11 Å²	11	68.6 Å²	68.6	5%	0.051	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.6	175.1	-173.1	54.4	0	0	0	110.8	H162 Y1123 G1131 T1132 G1188 N1189 F1237	H160-H162 AromaticContact CD2-CE1 3.59Å; H160-H162 AromaticContact CD2-NE2 3.69Å; H160-H162 AromaticContact NE2-CE1 3.11Å; H160-H162 PolarHBondContact NE2-CE1 2.83Å; H160-H162 AromaticContact NE2-ND1 3.53Å; H160-H162 AromaticContact NE2-NE2 3.7Å; H160-Y1123 PolarHBondContact O-OH 2.94Å; H160-G1131 CarbonylContact O-C 3.59Å; H160-G1131 WeakPolarHBondContact O-CA 3.06Å; H160-T1132 PolarHBondContact N-O 3.49Å; H160-T1132 PolarHBondContact O-N 3.08Å; H160-G1188 PolarHBondContact ND1-O 2.9Å; H160-N1189 PolarHBondContact CE1-OD1 3.48Å; H160-N1189 VanDerWaalsContact CE1-OD1 3.26Å; H160-N1189 PolarHBondContact ND1-N 3.5Å; H160-N1189 PolarHBondContact ND1-OD1 2.95Å; H160-F1237 AromaticContact CD2-CD1 3.93Å; H160-F1237 AromaticContact CD2-CE1 3.76Å; H160-F1237 AromaticContact CE1-CE1 3.66Å; H160-F1237 AromaticContact CG-CE1 3.76Å; H160-F1237 AromaticContact ND1-CE1 3.69Å; H160-F1237 AromaticContact NE2-CD1 3.69Å; H160-F1237 AromaticContact NE2-CE1 3.69Å
161	D	28.5	Very low	27.8	Very low	14 Å²	14	72.7 Å²	72.7	8%	0.075	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	125.2	176	-78.1	-62.3	0	0	0	110.6	Y1123 N1189	D161-Y1123 WeakPolarHBondContact OD1-CE2 3.26Å; D161-Y1123 PolarHBondContact OD1-OH 3.47Å; D161-N1189 PolarHBondContact N-OD1 3.36Å; D161-N1189 PolarHBondContact O-OD1 2.86Å
162	H	28.6	Very low	27.5	Very low	55 Å²	55	81.4 Å²	81.4	26%	0.255	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	107.5	158.9	-71.3	-52.2	0	0	0	109.4	H160 Y164 S1129 V1130	H160-H162 AromaticContact CD2-CE1 3.59Å; H160-H162 AromaticContact CD2-NE2 3.69Å; H160-H162 AromaticContact NE2-CE1 3.11Å; H160-H162 PolarHBondContact NE2-CE1 2.83Å; H160-H162 AromaticContact NE2-ND1 3.53Å; H160-H162 AromaticContact NE2-NE2 3.7Å; H162-Y164 PolarHBondContact O-N 3.34Å; H162-S1129 WeakPolarHBondContact O-CA 3.3Å; H162-S1129 WeakPolarHBondContact O-CB 3.37Å; H162-V1130 WeakPolarHBondContact CA-O 3.39Å; H162-V1130 VanDerWaalsContact CB-O 3.3Å; H162-V1130 WeakPolarHBondContact CB-O 3.28Å; H162-V1130 PolarHBondContact N-O 3.02Å; H162-V1130 PolarHBondContact O-N 2.64Å
163	T	28	Very low	27.3	Very low	84 Å²	84	76.9 Å²	76.9	52%	0.515	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	109.9	171.4	-17.3	0	0	0	0	108.4	C165 S1129	T163-C165 PolarHBondContact O-N 2.62Å; T163-S1129 VanDerWaalsContact CG2-OG 3.23Å; T163-S1129 WeakPolarHBondContact CG2-OG 3.41Å
164	Y	27	Very low	26.9	Very low	74 Å²	74	77.5 Å²	77.5	29%	0.29	42%	0.416	S	S	.	.			trans	-77.5	64.8	164	-96.2	-84.8	0	0	0	109.3	H162 L435 V792	H162-Y164 PolarHBondContact O-N 3.34Å; Y164-L435 HydrophobicContact CD2-CD1 4.02Å; Y164-L435 HydrophobicContact CG-CD1 3.85Å; Y164-L435 HydrophobicContact CG-CG 4.48Å; Y164-V792 HydrophobicContact CE1-CB 4.31Å; Y164-V792 HydrophobicContact CE1-CG1 4.31Å; Y164-V792 HydrophobicContact CE2-CG1 4.34Å; Y164-V792 WeakPolarHBondContact OH-CB 3.47Å; Y164-V792 WeakPolarHBondContact OH-CG1 3.36Å; Y164-V792 WeakPolarHBondContact OH-CG2 3.03Å
165	C	24.3	Very low	26.7	Very low	88 Å²	88	82 Å²	82	60%	0.595	45%	0.445	S	S	*	.	S	Bend	trans	-102.5	139	156	-77.5	0	0	0	0	106.2	T163	T163-C165 PolarHBondContact O-N 2.62Å
166	A	24.2	Very low	26.3	Very low	51 Å²	51	83 Å²	83	42%	0.421	46%	0.46	S	S	.	.			trans	-38.6	139	179.4	0	0	0	0	0	111.1	E168 Y432	A166-E168 PolarHBondContact O-N 3.15Å; A166-Y432 HydrophobicContact CB-CD1 4.31Å
167	P	23	Very low	25.9	Very low	78 Å²	78	87.8 Å²	87.8	51%	0.506	49%	0.493	S	S	.	.			trans	-51.9	139	-170.7	22.4	-32.2	0	0	0	109.3	S169	P167-S169 PolarHBondContact O-N 2.86Å; P167-S169 PolarHBondContact O-OG 2.86Å
168	E	23.4	Very low	25.5	Very low	200 Å²	200	94.7 Å²	94.7	94%	0.935	53%	0.53	S	S	*	.			trans	-53.2	74.9	156.8	-71.6	-176.9	151.1	0	0	108.7	A166	A166-E168 PolarHBondContact O-N 3.15Å
169	S	22.3	Very low	25	Very low	81 Å²	81	100.2 Å²	100.2	57%	0.566	56%	0.564	S	S	*	*			trans	-104.9	84.7	172.2	47	0	0	0	0	104.1	P167 F171	P167-S169 PolarHBondContact O-N 2.86Å; P167-S169 PolarHBondContact O-OG 2.86Å; S169-F171 PolarHBondContact O-N 2.85Å
170	A	23	Very low	24.3	Very low	92 Å²	92	108.4 Å²	108.4	76%	0.76	61%	0.608	S	S	*	*			trans	44.7	78.5	151.7	0	0	0	0	0	116.4	R172	A170-R172 VanDerWaalsContact C-N 3.35Å
171	F	24.9	Very low	24	Very low	186 Å²	186	111.5 Å²	111.5	82%	0.816	63%	0.631	S	S	*	*			trans	-95.6	72.6	141.7	-85.8	-81.1	0	0	0	109.2	S169 L173	S169-F171 PolarHBondContact O-N 2.85Å; F171-L173 VanDerWaalsContact C-N 3.33Å; F171-L173 HydrophobicContact CD1-CD2 4.07Å; F171-L173 HydrophobicContact CD1-CG 4.15Å; F171-L173 HydrophobicContact CE1-CD2 4.35Å
172	R	22.2	Very low	23.8	Very low	237 Å²	237	117.1 Å²	117.1	89%	0.894	67%	0.668	S	S	*	*			trans	-84.1	92.9	139.8	-84.6	-172.1	-179.1	179.9	1	104.8	A170	A170-R172 VanDerWaalsContact C-N 3.35Å
173	L	23.4	Very low	23.6	Very low	130 Å²	130	122.8 Å²	122.8	68%	0.681	69%	0.692	S	S	*	*			trans	-53.2	127.4	163.8	-77.4	165.5	0	0	0	106.7	F171 V175	F171-L173 VanDerWaalsContact C-N 3.33Å; F171-L173 HydrophobicContact CD1-CD2 4.07Å; F171-L173 HydrophobicContact CD1-CG 4.15Å; F171-L173 HydrophobicContact CE1-CD2 4.35Å; L173-V175 PolarHBondContact O-N 2.73Å
174	P	21.1	Very low	23.7	Very low	112 Å²	112	122 Å²	122	73%	0.727	69%	0.69	S	S	*	*			trans	-62.1	113.1	161	9.1	2.5	0	0	0	104.8	P176	P174-P176 WeakPolarHBondContact O-CD 3.19Å
175	V	23.1	Very low	23.9	Very low	129 Å²	129	123.4 Å²	123.4	78%	0.782	71%	0.71	S	S	*	*			trans	-55.5	114.6	161	-179.5	0	0	0	0	104.5	L173 S177	L173-V175 PolarHBondContact O-N 2.73Å; V175-S177 PolarHBondContact O-N 3.25Å
176	P	21.8	Very low	24.4	Very low	104 Å²	104	122.1 Å²	122.1	68%	0.675	70%	0.698	S	S	*	*			trans	-65.5	106.8	176	16.7	-13	0	0	0	106.2	P174 N178	P174-P176 WeakPolarHBondContact O-CD 3.19Å; P176-N178 PolarHBondContact O-N 2.96Å
177	S	22.8	Very low	24.9	Very low	106 Å²	106	121.9 Å²	121.9	74%	0.741	69%	0.689	S	S	*	*	S	Bend	trans	-68.5	120.4	164.2	49.3	0	0	0	0	106.4	V175	V175-S177 PolarHBondContact O-N 3.25Å
178	N	22.4	Very low	25.6	Very low	149 Å²	149	119.2 Å²	119.2	80%	0.797	67%	0.672	S	S	*	*	S	Bend	trans	67.2	97.7	178.8	-59.3	-24.8	0	0	0	115.9	P176	P176-N178 PolarHBondContact O-N 2.96Å
179	T	23.3	Very low	26.2	Very low	123 Å²	123	117.4 Å²	117.4	76%	0.755	66%	0.658	S	S	*	*			trans	-168.6	136.3	131.1	25	0	0	0	0	108.3	S181	T179-S181 PolarHBondContact O-N 3.01Å; T179-S181 VanDerWaalsContact O-N 3.1Å
180	D	22.8	Very low	27.2	Very low	173 Å²	173	116.6 Å²	116.6	93%	0.925	64%	0.644	S	S	*	*			trans	-49.1	112.8	-178.8	-65.2	-54	0	0	0	111.8
181	S	23.1	Very low	27.8	Very low	76 Å²	76	115 Å²	115	53%	0.531	63%	0.627	S	S	.	*			trans	-105	129.9	175.8	60.9	0	0	0	0	110.1	T179 F183	T179-S181 PolarHBondContact O-N 3.01Å; T179-S181 VanDerWaalsContact O-N 3.1Å; S181-F183 VanDerWaalsContact CB-CD2 3.46Å; S181-F183 PolarHBondContact O-N 2.84Å; S181-F183 VanDerWaalsContact O-N 3.16Å; S181-F183 WeakPolarHBondContact OG-CD2 3.01Å
182	P	25.2	Very low	28	Very low	131 Å²	131	108.6 Å²	108.6	85%	0.851	61%	0.614	S	S	*	*			trans	-84.8	63.9	160.6	36	-28.8	0	0	0	107.5	S184	P182-S184 VanDerWaalsContact C-N 3.32Å; P182-S184 PolarHBondContact O-N 2.84Å
183	F	24.5	Very low	28.4	Very low	174 Å²	174	102.1 Å²	102.1	76%	0.763	60%	0.597	S	S	*	*			trans	-72.7	96.7	162.8	-86.1	-72.2	0	0	0	107	S181 S185	S181-F183 VanDerWaalsContact CB-CD2 3.46Å; S181-F183 PolarHBondContact O-N 2.84Å; S181-F183 VanDerWaalsContact O-N 3.16Å; S181-F183 WeakPolarHBondContact OG-CD2 3.01Å; F183-S185 PolarHBondContact O-N 2.85Å; F183-S185 VanDerWaalsContact O-N 3.12Å
184	S	30.4	Very low	28.6	Very low	69 Å²	69	97.4 Å²	97.4	48%	0.483	58%	0.577	S	S	.	*			trans	-58.5	117.9	171.5	66.3	0	0	0	0	108.4	P182 D186	P182-S184 VanDerWaalsContact C-N 3.32Å; P182-S184 PolarHBondContact O-N 2.84Å; S184-D186 PolarHBondContact O-N 2.86Å
185	S	31	Very low	28.9	Very low	102 Å²	102	97 Å²	97	71%	0.713	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	29.2	179.1	57.3	0	0	0	0	114.5	F183	F183-S185 PolarHBondContact O-N 2.85Å; F183-S185 VanDerWaalsContact O-N 3.12Å
186	D	33.7	Very low	29.1	Very low	62 Å²	62	93.4 Å²	93.4	33%	0.332	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.3	8.6	-166.5	-92	-17.1	0	0	0	114.7	S184 S213 H256	S184-D186 PolarHBondContact O-N 2.86Å; D186-S213 VanDerWaalsContact C-CB 3.43Å; D186-H256 PolarHBondContact O-CE1 3.36Å; D186-H256 VanDerWaalsContact O-CE1 3.31Å; D186-H256 PolarHBondContact O-NE2 3.21Å
187	L	35	Very low	29.2	Very low	46 Å²	46	91.3 Å²	91.3	24%	0.241	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-90.4	128.9	-177	-73.2	157.7	0	0	0	112.6	Y189 I349 A352	L187-Y189 HydrophobicContact CB-CE2 4.21Å; L187-I349 HydrophobicContact CD2-CD1 3.88Å; L187-A352 HydrophobicContact CD2-CB 4.16Å
188	S	37.6	Very low	29.3	Very low	21 Å²	21	93.6 Å²	93.6	15%	0.147	54%	0.538	C	S	.	.	P	Polyproline II helix	trans	-90.3	128.5	168.1	55.9	0	0	0	0	109.1	F211 H256	S188-F211 WeakPolarHBondContact CA-O 3.17Å; S188-F211 WeakPolarHBondContact CB-O 3.42Å; S188-H256 VanDerWaalsContact CB-CE1 3.45Å; S188-H256 WeakPolarHBondContact CB-CE1 3.33Å; S188-H256 PolarHBondContact N-CE1 2.84Å; S188-H256 PolarHBondContact OG-CE1 2.85Å
189	Y	36.6	Very low	29.6	Very low	163 Å²	163	92.9 Å²	92.9	64%	0.639	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-97.1	129.9	173.2	-76	-93.1	0	0	0	109.5	L187 F211	L187-Y189 HydrophobicContact CB-CE2 4.21Å; Y189-F211 PolarHBondContact O-N 2.63Å
190	K	44.1	Very low	29.8	Very low	64 Å²	64	95.6 Å²	95.6	28%	0.278	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	122.8	163.5	-75.8	-171.6	179.1	-173.1	0	107.6	L210 D251 V252 T253 M304	K190-L210 HydrophobicContact CD-CD2 4.43Å; K190-L210 HydrophobicContact CG-CD2 3.78Å; K190-D251 IonicContact NZ-OD1 2.62Å; K190-D251 PolarHBondContact NZ-OD1 2.9Å; K190-D251 IonicContact NZ-OD2 3.82Å; K190-D251 PolarHBondContact NZ-OD2 3.28Å; K190-V252 WeakPolarHBondContact CE-O 3.18Å; K190-V252 PolarHBondContact NZ-O 2.89Å; K190-T253 VanDerWaalsContact CE-CB 3.5Å; K190-T253 WeakPolarHBondContact CE-OG1 3.49Å; K190-M304 PolarHBondContact NZ-O 2.78Å
191	S	34	Very low	30.1	Very low	58 Å²	58	90.9 Å²	90.9	41%	0.406	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	109	167.9	62.4	0	0	0	0	108.6	F211	S191-F211 WeakPolarHBondContact OG-CE2 3.44Å
192	G	30.5	Very low	30.5	Very low	52 Å²	52	90.2 Å²	90.2	54%	0.536	53%	0.53	S	S	.	.	S	Bend	trans	137.5	137	177.9	0	0	0	0	0	112.2	A194	G192-A194 PolarHBondContact O-N 3.41Å
193	D	29.8	Very low	30.8	Very low	100 Å²	100	92 Å²	92	54%	0.535	53%	0.527	S	S	.	.			trans	-67.5	112.3	170.3	-84.6	-33	0	0	0	108.4	M195 Q391	D193-M195 PolarHBondContact O-N 2.82Å; D193-Q391 PolarHBondContact OD1-NE2 2.82Å
194	A	27.7	Very low	31.6	Very low	31 Å²	31	87.4 Å²	87.4	26%	0.256	51%	0.508	S	S	.	.			trans	-69.1	112	153.9	0	0	0	0	0	105.6	G192 S196	G192-A194 PolarHBondContact O-N 3.41Å; A194-S196 PolarHBondContact O-N 2.8Å
195	M	27.9	Very low	32.3	Very low	103 Å²	103	90.8 Å²	90.8	51%	0.507	51%	0.514	S	S	.	.			trans	-50.9	102.2	-178.1	-89	-162.4	-126.7	0	0	111.4	D193 S197 Q204 S206	D193-M195 PolarHBondContact O-N 2.82Å; M195-S197 PolarHBondContact O-N 2.8Å; M195-S197 VanDerWaalsContact O-N 3.15Å; M195-Q204 HydrophobicContact CE-CB 3.51Å; M195-S206 WeakPolarHBondContact CE-OG 3.38Å
196	S	26	Very low	33.4	Very low	55 Å²	55	87.5 Å²	87.5	39%	0.385	49%	0.491	S	S	.	.			trans	-76.4	100.2	164.2	65.3	0	0	0	0	108.2	A194	A194-S196 PolarHBondContact O-N 2.8Å
197	S	25.5	Very low	34.2	Very low	59 Å²	59	88.9 Å²	88.9	41%	0.413	50%	0.498	S	S	.	.	S	Bend	trans	47	93.9	153.7	65.4	0	0	0	0	116.9	M195	M195-S197 PolarHBondContact O-N 2.8Å; M195-S197 VanDerWaalsContact O-N 3.15Å
198	L	25	Very low	35.5	Very low	154 Å²	154	87 Å²	87	81%	0.806	49%	0.488	S	S	*	.			trans	-162.5	112.8	140.4	-102.7	135.2	0	0	0	110.4
199	D	28.5	Very low	36.5	Very low	134 Å²	134	89.9 Å²	89.9	72%	0.717	50%	0.498	S	S	*	.			trans	62.1	135.7	153	-63.1	-23.8	0	0	0	122.7	S201	D199-S201 PolarHBondContact O-N 3.46Å
200	N	27.5	Very low	37.9	Very low	181 Å²	181	82.2 Å²	82.2	97%	0.968	47%	0.468	S	S	*	.	S	Bend	trans	-62.4	38.5	-177.6	-81.4	-31.4	0	0	0	115.5
201	S	28.3	Very low	39	Very low	74 Å²	74	82.8 Å²	82.8	52%	0.517	47%	0.471	S	S	.	.			trans	-142.9	105.6	-178.5	57.2	0	0	0	0	111.7	D199	D199-S201 PolarHBondContact O-N 3.46Å
202	G	31.5	Very low	40.5	Very low	62 Å²	62	80.8 Å²	80.8	64%	0.639	46%	0.456	S	S	*	.			trans	120.3	114.2	162.7	0	0	0	0	0	113.6	Q204	G202-Q204 PolarHBondContact O-N 2.82Å
203	E	32.5	Very low	41.9	Very low	167 Å²	167	80 Å²	80	78%	0.78	44%	0.442	S	S	*	.			trans	-57.8	72.5	170	-63	175.8	144.4	0	0	112	K205	E203-K205 PolarHBondContact O-N 2.82Å
204	Q	39.9	Very low	43.6	Very low	78 Å²	78	82.2 Å²	82.2	36%	0.364	45%	0.447	S	S	.	.			trans	-84.6	100.1	174.4	-84.3	-161.4	-1.1	0	0	111	M195 G202 S206 Y1069	M195-Q204 HydrophobicContact CE-CB 3.51Å; G202-Q204 PolarHBondContact O-N 2.82Å; Q204-S206 VanDerWaalsContact C-N 3.27Å; Q204-S206 PolarHBondContact O-N 2.96Å; Q204-S206 PolarHBondContact O-OG 3.4Å; Q204-Y1069 PolarHBondContact NE2-OH 2.7Å
205	K	45.1	Very low	45	Very low	140 Å²	140	84.7 Å²	84.7	61%	0.609	46%	0.462	S	S	*	.			trans	-41.4	81.7	165.3	-64.1	173.2	-178.8	171	0	112.1	E203 V223	E203-K205 PolarHBondContact O-N 2.82Å; K205-V223 HydrophobicContact CG-CG2 4.3Å
206	S	54.8	Low	46.6	Very low	33 Å²	33	81.5 Å²	81.5	23%	0.231	45%	0.445	C	S	.	.			trans	-99	106.4	177.3	-52.1	0	0	0	0	106.3	M195 Q204 Y222	M195-S206 WeakPolarHBondContact CE-OG 3.38Å; Q204-S206 VanDerWaalsContact C-N 3.27Å; Q204-S206 PolarHBondContact O-N 2.96Å; Q204-S206 PolarHBondContact O-OG 3.4Å; S206-Y222 VanDerWaalsContact O-CD2 3.25Å; S206-Y222 WeakPolarHBondContact O-CD2 3.44Å
207	L	51.2	Low	48.2	Very low	92 Å²	92	80.1 Å²	80.1	48%	0.482	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113.6	165.8	-69.8	167.1	0	0	0	106.8	F209 V219 V220 D221	L207-F209 HydrophobicContact CB-CE2 4.03Å; L207-F209 HydrophobicContact CB-CZ 4.43Å; L207-V219 HydrophobicContact CB-CG1 4Å; L207-V219 HydrophobicContact CD2-CG1 3.59Å; L207-V219 HydrophobicContact CG-CG1 4.25Å; L207-V220 VanDerWaalsContact CA-O 3.27Å; L207-V220 WeakPolarHBondContact CA-O 3.33Å; L207-D221 HydrophobicContact CD2-CB 3.81Å
208	L	62	Low	50	Low	7 Å²	7	77.3 Å²	77.3	4%	0.037	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	122.9	172.9	177.4	70.5	0	0	0	109.2	L210 V219 V220 Y222 V252	L208-L210 HydrophobicContact CD2-CD1 4.31Å; L208-L210 HydrophobicContact CD2-CD2 3.88Å; L208-L210 HydrophobicContact CD2-CG 4.06Å; L208-L210 HydrophobicContact CG-CD2 4.12Å; L208-L210 HydrophobicContact CG-CG 4.12Å; L208-V219 CarbonylContact O-C 3.49Å; L208-V219 WeakPolarHBondContact O-CA 3.16Å; L208-V220 HydrophobicContact CB-CB 4.03Å; L208-V220 HydrophobicContact CB-CG2 4.07Å; L208-V220 HydrophobicContact CD2-CG2 4.2Å; L208-V220 HydrophobicContact CG-CG2 4.45Å; L208-V220 PolarHBondContact N-O 3.31Å; L208-V220 PolarHBondContact O-N 3.01Å; L208-Y222 HydrophobicContact CB-CE2 3.81Å; L208-V252 HydrophobicContact CD2-CB 4.2Å
209	F	58.7	Low	51.7	Low	80 Å²	80	70.7 Å²	70.7	35%	0.351	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119.7	173.6	-66	-91.4	0	0	0	109.9	L207 F211 V217 V219	L207-F209 HydrophobicContact CB-CE2 4.03Å; L207-F209 HydrophobicContact CB-CZ 4.43Å; F209-F211 HydrophobicContact CB-CE2 3.95Å; F209-F211 HydrophobicContact CB-CZ 4.28Å; F209-V217 HydrophobicContact CD1-CG1 4.02Å; F209-V219 HydrophobicContact CD1-CG2 3.75Å; F209-V219 HydrophobicContact CE1-CB 4.46Å; F209-V219 HydrophobicContact CE1-CG1 4.13Å; F209-V219 HydrophobicContact CE1-CG2 3.57Å; F209-V219 HydrophobicContact CZ-CG1 4.3Å; F209-V219 HydrophobicContact CZ-CG2 4.49Å
210	L	65.1	Low	53.5	Low	2 Å²	2	64.3 Å²	64.3	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127	177.8	-66.2	172.9	0	0	0	109.5	K190 L208 V217 A218 V220 V252 F254	K190-L210 HydrophobicContact CD-CD2 4.43Å; K190-L210 HydrophobicContact CG-CD2 3.78Å; L208-L210 HydrophobicContact CD2-CD1 4.31Å; L208-L210 HydrophobicContact CD2-CD2 3.88Å; L208-L210 HydrophobicContact CD2-CG 4.06Å; L208-L210 HydrophobicContact CG-CD2 4.12Å; L208-L210 HydrophobicContact CG-CG 4.12Å; L210-V217 CarbonylContact O-C 3.47Å; L210-V217 WeakPolarHBondContact O-CA 3.45Å; L210-A218 HydrophobicContact CB-CB 4.34Å; L210-A218 PolarHBondContact N-O 2.92Å; L210-A218 PolarHBondContact O-N 3.17Å; L210-V220 HydrophobicContact CD1-CG2 3.93Å; L210-V252 HydrophobicContact CD1-CB 3.9Å; L210-V252 HydrophobicContact CD1-CG1 3.35Å; L210-F254 HydrophobicContact CB-CD2 3.77Å; L210-F254 HydrophobicContact CB-CE2 3.64Å
211	F	66.6	Low	55.3	Low	77 Å²	77	57.3 Å²	57.3	34%	0.338	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.2	177.5	-61.4	-90.8	0	0	0	110	S188 Y189 S191 F209 V217	S188-F211 WeakPolarHBondContact CA-O 3.17Å; S188-F211 WeakPolarHBondContact CB-O 3.42Å; Y189-F211 PolarHBondContact O-N 2.63Å; S191-F211 WeakPolarHBondContact OG-CE2 3.44Å; F209-F211 HydrophobicContact CB-CE2 3.95Å; F209-F211 HydrophobicContact CB-CZ 4.28Å; F211-V217 HydrophobicContact CD1-CG2 3.72Å; F211-V217 HydrophobicContact CE1-CG1 4.34Å; F211-V217 HydrophobicContact CE1-CG2 3.55Å
212	T	67.6	Low	56.9	Low	16 Å²	16	56 Å²	56	10%	0.098	29%	0.294	C	S	.	.			trans	-76.5	160.3	166	64.4	0	0	0	0	110.3	K214 C215 Q216 F254	T212-K214 PolarHBondContact O-N 3.1Å; T212-K214 PolarHBondContact OG1-N 3.01Å; T212-C215 PolarHBondContact O-N 2.91Å; T212-C215 PolarHBondContact OG1-N 2.84Å; T212-Q216 HydrophobicContact CG2-CB 4.09Å; T212-Q216 PolarHBondContact N-O 2.68Å; T212-Q216 WeakPolarHBondContact OG1-CA 3.3Å; T212-Q216 WeakPolarHBondContact OG1-CB 3.4Å; T212-Q216 PolarHBondContact OG1-N 3.41Å; T212-Q216 PolarHBondContact OG1-O 3.19Å; T212-F254 HydrophobicContact CG2-CB 4.36Å; T212-F254 HydrophobicContact CG2-CD1 3.65Å; T212-F254 HydrophobicContact CG2-CD2 3.6Å; T212-F254 HydrophobicContact CG2-CE1 3.66Å; T212-F254 HydrophobicContact CG2-CE2 3.6Å; T212-F254 HydrophobicContact CG2-CG 3.61Å; T212-F254 HydrophobicContact CG2-CZ 3.62Å
213	S	59	Low	58.3	Low	34 Å²	34	56.5 Å²	56.5	24%	0.238	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-12.5	170.3	61.6	0	0	0	0	114.1	D186	D186-S213 VanDerWaalsContact C-CB 3.43Å
214	K	64.4	Low	59.7	Low	148 Å²	148	52.6 Å²	52.6	64%	0.643	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	21.6	175.2	-62.1	-175.9	178.8	178.2	0	112.7	T212 Q216	T212-K214 PolarHBondContact O-N 3.1Å; T212-K214 PolarHBondContact OG1-N 3.01Å; K214-Q216 PolarHBondContact O-N 2.68Å; K214-Q216 VanDerWaalsContact O-N 3.1Å
215	C	57.5	Low	60.9	Low	83 Å²	83	51.1 Å²	51.1	56%	0.561	26%	0.263	S	S	*	.	S	Bend	trans	59.9	17.2	178	-57.8	0	0	0	0	115.9	T212 T232	T212-C215 PolarHBondContact O-N 2.91Å; T212-C215 PolarHBondContact OG1-N 2.84Å; C215-T232 HydrophobicContact CB-CG2 4.18Å; C215-T232 WeakPolarHBondContact O-CG2 3.49Å
216	Q	62.6	Low	61.8	Low	36 Å²	36	44.7 Å²	44.7	17%	0.168	24%	0.236	C	C	.	.			trans	-79.7	138.2	168.5	-55.8	176.8	3.8	0	0	109.4	T212 K214 K282	T212-Q216 HydrophobicContact CG2-CB 4.09Å; T212-Q216 PolarHBondContact N-O 2.68Å; T212-Q216 WeakPolarHBondContact OG1-CA 3.3Å; T212-Q216 WeakPolarHBondContact OG1-CB 3.4Å; T212-Q216 PolarHBondContact OG1-N 3.41Å; T212-Q216 PolarHBondContact OG1-O 3.19Å; K214-Q216 PolarHBondContact O-N 2.68Å; K214-Q216 VanDerWaalsContact O-N 3.1Å; Q216-K282 VanDerWaalsContact CD-CE 3.43Å
217	V	59.2	Low	62.2	Low	26 Å²	26	43.1 Å²	43.1	16%	0.158	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132	-177.7	-177.3	0	0	0	0	108.4	F209 L210 F211 V219 T229 L230	F209-V217 HydrophobicContact CD1-CG1 4.02Å; L210-V217 CarbonylContact O-C 3.47Å; L210-V217 WeakPolarHBondContact O-CA 3.45Å; F211-V217 HydrophobicContact CD1-CG2 3.72Å; F211-V217 HydrophobicContact CE1-CG1 4.34Å; F211-V217 HydrophobicContact CE1-CG2 3.55Å; V217-V219 HydrophobicContact CG1-CG2 4.32Å; V217-T229 CarbonylContact O-C 3.59Å; V217-T229 VanDerWaalsContact O-CA 3.29Å; V217-T229 WeakPolarHBondContact O-CA 3.29Å; V217-L230 HydrophobicContact CB-CB 4.19Å; V217-L230 HydrophobicContact CG1-CD1 4.44Å; V217-L230 PolarHBondContact N-O 3.4Å; V217-L230 PolarHBondContact O-N 3.28Å
218	A	63.2	Low	62.8	Low	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.7	159.7	0	0	0	0	0	109.3	L210 V228 T229 F254 I263	L210-A218 HydrophobicContact CB-CB 4.34Å; L210-A218 PolarHBondContact N-O 2.92Å; L210-A218 PolarHBondContact O-N 3.17Å; A218-V228 CarbonylContact C-O 3.46Å; A218-V228 WeakPolarHBondContact CA-O 3.25Å; A218-T229 HydrophobicContact CB-CG2 4.08Å; A218-F254 HydrophobicContact CB-CE2 3.65Å; A218-F254 HydrophobicContact CB-CZ 3.51Å; A218-I263 HydrophobicContact CB-CD1 4.2Å
219	V	61	Low	62.7	Low	15 Å²	15	40.9 Å²	40.9	9%	0.091	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	119.9	172.3	-170.1	0	0	0	0	106.6	L207 L208 F209 V217 V228 L230	L207-V219 HydrophobicContact CB-CG1 4Å; L207-V219 HydrophobicContact CD2-CG1 3.59Å; L207-V219 HydrophobicContact CG-CG1 4.25Å; L208-V219 CarbonylContact O-C 3.49Å; L208-V219 WeakPolarHBondContact O-CA 3.16Å; F209-V219 HydrophobicContact CD1-CG2 3.75Å; F209-V219 HydrophobicContact CE1-CB 4.46Å; F209-V219 HydrophobicContact CE1-CG1 4.13Å; F209-V219 HydrophobicContact CE1-CG2 3.57Å; F209-V219 HydrophobicContact CZ-CG1 4.3Å; F209-V219 HydrophobicContact CZ-CG2 4.49Å; V217-V219 HydrophobicContact CG1-CG2 4.32Å; V219-V228 HydrophobicContact CB-CB 4.36Å; V219-V228 PolarHBondContact N-O 3.36Å; V219-V228 PolarHBondContact O-N 3.27Å; V219-L230 HydrophobicContact CG2-CD1 3.61Å; V219-L230 HydrophobicContact CG2-CG 4.35Å
220	V	65	Low	62.6	Low	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.2	170.8	-168	0	0	0	0	107.4	L207 L208 L210 Y222 F227 V252	L207-V220 VanDerWaalsContact CA-O 3.27Å; L207-V220 WeakPolarHBondContact CA-O 3.33Å; L208-V220 HydrophobicContact CB-CB 4.03Å; L208-V220 HydrophobicContact CB-CG2 4.07Å; L208-V220 HydrophobicContact CD2-CG2 4.2Å; L208-V220 HydrophobicContact CG-CG2 4.45Å; L208-V220 PolarHBondContact N-O 3.31Å; L208-V220 PolarHBondContact O-N 3.01Å; L210-V220 HydrophobicContact CD1-CG2 3.93Å; V220-Y222 HydrophobicContact CB-CE2 4.16Å; V220-Y222 HydrophobicContact CG1-CD1 4.31Å; V220-Y222 HydrophobicContact CG1-CD2 4.2Å; V220-Y222 HydrophobicContact CG1-CE1 4.11Å; V220-Y222 HydrophobicContact CG1-CE2 3.97Å; V220-Y222 HydrophobicContact CG1-CG 4.35Å; V220-F227 HydrophobicContact CB-CD1 4.17Å; V220-F227 HydrophobicContact CB-CE1 4.07Å; V220-F227 HydrophobicContact CG1-CD1 3.92Å; V220-F227 HydrophobicContact CG1-CE1 3.52Å; V220-F227 HydrophobicContact CG1-CZ 4.22Å; V220-F227 HydrophobicContact CG2-CD1 3.73Å; V220-F227 HydrophobicContact CG2-CE1 3.58Å; V220-V252 HydrophobicContact CG1-CG2 4.38Å; V220-V252 HydrophobicContact CG2-CB 4.29Å; V220-V252 HydrophobicContact CG2-CG1 4.12Å; V220-V252 HydrophobicContact CG2-CG2 4.25Å
221	D	66.3	Low	62.2	Low	34 Å²	34	42.1 Å²	42.1	18%	0.182	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	98.5	169.2	-176.5	-13.2	0	0	0	108.5	L207 V223 N224 N225 A226	L207-D221 HydrophobicContact CD2-CB 3.81Å; D221-V223 PolarHBondContact O-N 2.59Å; D221-V223 WeakPolarHBondContact OD1-CB 3.39Å; D221-V223 PolarHBondContact OD1-N 3.19Å; D221-N224 PolarHBondContact OD1-N 3.05Å; D221-N224 VanDerWaalsContact OD1-N 3.11Å; D221-N224 PolarHBondContact OD2-ND2 3.41Å; D221-N225 WeakPolarHBondContact O-CA 3.44Å; D221-N225 PolarHBondContact O-N 3.26Å; D221-N225 VanDerWaalsContact O-N 3.12Å; D221-A226 HydrophobicContact CB-CB 4.45Å; D221-A226 PolarHBondContact N-O 3.08Å; D221-A226 PolarHBondContact O-N 2.94Å
222	Y	62.4	Low	61.6	Low	47 Å²	47	42.5 Å²	42.5	18%	0.184	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-21.3	178.8	-69	-83	0	0	0	112.9	S206 L208 V220 N225 V249	S206-Y222 VanDerWaalsContact O-CD2 3.25Å; S206-Y222 WeakPolarHBondContact O-CD2 3.44Å; L208-Y222 HydrophobicContact CB-CE2 3.81Å; V220-Y222 HydrophobicContact CB-CE2 4.16Å; V220-Y222 HydrophobicContact CG1-CD1 4.31Å; V220-Y222 HydrophobicContact CG1-CD2 4.2Å; V220-Y222 HydrophobicContact CG1-CE1 4.11Å; V220-Y222 HydrophobicContact CG1-CE2 3.97Å; V220-Y222 HydrophobicContact CG1-CG 4.35Å; Y222-N225 PolarHBondContact O-OD1 3.16Å; Y222-V249 HydrophobicContact CD1-CB 4.02Å; Y222-V249 HydrophobicContact CD1-CG1 4.46Å; Y222-V249 HydrophobicContact CE1-CB 3.74Å; Y222-V249 HydrophobicContact CE1-CG1 3.73Å
223	V	60.9	Low	60.6	Low	71 Å²	71	52.1 Å²	52.1	43%	0.43	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-44.4	179.7	-179.5	0	0	0	0	109.9	K205 D221 N225	K205-V223 HydrophobicContact CG-CG2 4.3Å; D221-V223 PolarHBondContact O-N 2.59Å; D221-V223 WeakPolarHBondContact OD1-CB 3.39Å; D221-V223 PolarHBondContact OD1-N 3.19Å; V223-N225 VanDerWaalsContact C-N 3.33Å
224	N	60.8	Low	60.2	Low	86 Å²	86	58.6 Å²	58.6	46%	0.46	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	5.4	-178.9	-69.3	-58.3	0	0	0	113.6	D221 A226	D221-N224 PolarHBondContact OD1-N 3.05Å; D221-N224 VanDerWaalsContact OD1-N 3.11Å; D221-N224 PolarHBondContact OD2-ND2 3.41Å; N224-A226 HydrophobicContact CB-CB 4.2Å; N224-A226 PolarHBondContact O-N 2.96Å
225	N	64.7	Low	59.4	Low	47 Å²	47	56.7 Å²	56.7	25%	0.251	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	49.8	-171.9	-82.8	-16.1	0	0	0	111.5	D221 Y222 V223 R241 M242	D221-N225 WeakPolarHBondContact O-CA 3.44Å; D221-N225 PolarHBondContact O-N 3.26Å; D221-N225 VanDerWaalsContact O-N 3.12Å; Y222-N225 PolarHBondContact O-OD1 3.16Å; V223-N225 VanDerWaalsContact C-N 3.33Å; N225-R241 WeakPolarHBondContact O-CA 3.41Å; N225-M242 HydrophobicContact CB-CB 4.23Å; N225-M242 PolarHBondContact O-N 2.82Å
226	A	64.4	Low	59.1	Low	5 Å²	5	54.4 Å²	54.4	4%	0.041	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	143.1	-170.6	0	0	0	0	0	113.8	D221 N224 F240	D221-A226 HydrophobicContact CB-CB 4.45Å; D221-A226 PolarHBondContact N-O 3.08Å; D221-A226 PolarHBondContact O-N 2.94Å; N224-A226 HydrophobicContact CB-CB 4.2Å; N224-A226 PolarHBondContact O-N 2.96Å; A226-F240 CarbonylContact C-O 3.51Å; A226-F240 WeakPolarHBondContact CA-O 3.49Å
227	F	64.3	Low	58.9	Low	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.4	168.8	-64.9	-79	0	0	0	110.3	V220 C239 F240 M242 V252 I263 Y265 L278 I287	V220-F227 HydrophobicContact CB-CD1 4.17Å; V220-F227 HydrophobicContact CB-CE1 4.07Å; V220-F227 HydrophobicContact CG1-CD1 3.92Å; V220-F227 HydrophobicContact CG1-CE1 3.52Å; V220-F227 HydrophobicContact CG1-CZ 4.22Å; V220-F227 HydrophobicContact CG2-CD1 3.73Å; V220-F227 HydrophobicContact CG2-CE1 3.58Å; F227-C239 CarbonylContact O-C 3.4Å; F227-C239 VanDerWaalsContact O-CA 3.26Å; F227-C239 WeakPolarHBondContact O-CA 3.37Å; F227-F240 HydrophobicContact CB-CB 4.27Å; F227-F240 HydrophobicContact CD2-CB 4.47Å; F227-F240 HydrophobicContact CD2-CD1 4.02Å; F227-F240 PolarHBondContact N-O 2.93Å; F227-F240 PolarHBondContact O-N 3.44Å; F227-M242 HydrophobicContact CD2-CE 3.89Å; F227-M242 HydrophobicContact CD2-CG 4.32Å; F227-M242 HydrophobicContact CD2-SD 4.47Å; F227-M242 HydrophobicContact CE1-CE 4.33Å; F227-M242 HydrophobicContact CE2-CE 3.28Å; F227-M242 HydrophobicContact CE2-CG 3.85Å; F227-M242 HydrophobicContact CE2-SD 3.57Å; F227-M242 VanDerWaalsContact CE2-SD 3.57Å; F227-M242 HydrophobicContact CZ-CE 3.53Å; F227-M242 HydrophobicContact CZ-SD 4.03Å; F227-V252 HydrophobicContact CE1-CB 4.48Å; F227-V252 HydrophobicContact CE1-CG1 3.66Å; F227-V252 HydrophobicContact CE1-CG2 4Å; F227-V252 HydrophobicContact CZ-CG1 4.25Å; F227-V252 HydrophobicContact CZ-CG2 4.2Å; F227-I263 HydrophobicContact CD1-CD1 4.41Å; F227-I263 HydrophobicContact CE1-CG2 4.35Å; F227-Y265 HydrophobicContact CE2-CD1 4.45Å; F227-Y265 HydrophobicContact CZ-CD1 4.35Å; F227-Y265 HydrophobicContact CZ-CG 4.23Å; F227-L278 HydrophobicContact CD2-CD1 3.6Å; F227-L278 HydrophobicContact CE2-CD1 3.63Å; F227-L278 HydrophobicContact CG-CD1 4.39Å; F227-L278 HydrophobicContact CZ-CD1 4.47Å; F227-I287 HydrophobicContact CB-CD1 4.41Å
228	V	62.3	Low	59	Low	33 Å²	33	59 Å²	59	20%	0.2	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	116.9	176.3	-176.1	0	0	0	0	109.9	A218 V219 F238	A218-V228 CarbonylContact C-O 3.46Å; A218-V228 WeakPolarHBondContact CA-O 3.25Å; V219-V228 HydrophobicContact CB-CB 4.36Å; V219-V228 PolarHBondContact N-O 3.36Å; V219-V228 PolarHBondContact O-N 3.27Å; V228-F238 WeakPolarHBondContact CA-O 3.26Å
229	T	61.5	Low	59.1	Low	19 Å²	19	63 Å²	63	12%	0.117	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	132.6	172.4	53.8	0	0	0	0	111.2	V217 A218 F238 C280 I287	V217-T229 CarbonylContact O-C 3.59Å; V217-T229 VanDerWaalsContact O-CA 3.29Å; V217-T229 WeakPolarHBondContact O-CA 3.29Å; A218-T229 HydrophobicContact CB-CG2 4.08Å; T229-F238 PolarHBondContact N-O 2.89Å; T229-F238 WeakPolarHBondContact OG1-CD2 3.41Å; T229-C280 HydrophobicContact CG2-CB 4.42Å; T229-I287 HydrophobicContact CG2-CD1 4.14Å
230	L	55.8	Low	59.4	Low	51 Å²	51	63.8 Å²	63.8	27%	0.267	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	137.6	175.6	-64.9	163.5	0	0	0	110	V217 V219 V235	V217-L230 HydrophobicContact CB-CB 4.19Å; V217-L230 HydrophobicContact CG1-CD1 4.44Å; V217-L230 PolarHBondContact N-O 3.4Å; V217-L230 PolarHBondContact O-N 3.28Å; V219-L230 HydrophobicContact CG2-CD1 3.61Å; V219-L230 HydrophobicContact CG2-CG 4.35Å; L230-V235 HydrophobicContact CD2-CB 4.35Å; L230-V235 HydrophobicContact CD2-CG1 3.79Å; L230-V235 HydrophobicContact CD2-CG2 4.36Å
231	D	55.7	Low	59.7	Low	56 Å²	56	72.7 Å²	72.7	30%	0.299	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	150.8	173.3	-143.1	-3.3	0	0	0	110.8	Y233 K234 K282	D231-Y233 PolarHBondContact O-N 3.32Å; D231-K234 PolarHBondContact O-N 2.86Å; D231-K282 IonicContact OD1-NZ 3.88Å; D231-K282 PolarHBondContact OD1-NZ 2.84Å; D231-K282 IonicContact OD2-NZ 3.71Å; D231-K282 PolarHBondContact OD2-NZ 3.31Å
232	T	56	Low	59.9	Low	85 Å²	85	71.7 Å²	71.7	52%	0.521	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-15.3	-167.4	27.6	0	0	0	0	115.9	C215	C215-T232 HydrophobicContact CB-CG2 4.18Å; C215-T232 WeakPolarHBondContact O-CG2 3.49Å
233	Y	46.1	Very low	60.1	Low	218 Å²	218	71.4 Å²	71.4	86%	0.855	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.8	0.5	-177.3	-62.2	-75.9	0	0	0	115.3	D231	D231-Y233 PolarHBondContact O-N 3.32Å
234	K	49.4	Very low	60.3	Low	171 Å²	171	77.5 Å²	77.5	74%	0.743	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.8	129	176.3	-106	178.4	178.3	176.6	0	109	D231 S236	D231-K234 PolarHBondContact O-N 2.86Å; K234-S236 PolarHBondContact O-N 3.41Å
235	V	49.1	Very low	60.5	Low	108 Å²	108	76.8 Å²	76.8	66%	0.655	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	73.7	171	-177.8	0	0	0	0	108.3	L230 N237	L230-V235 HydrophobicContact CD2-CB 4.35Å; L230-V235 HydrophobicContact CD2-CG1 3.79Å; L230-V235 HydrophobicContact CD2-CG2 4.36Å; V235-N237 WeakPolarHBondContact CG1-OD1 3.27Å; V235-N237 PolarHBondContact O-N 2.85Å
236	S	50.9	Low	60.8	Low	34 Å²	34	74.6 Å²	74.6	24%	0.238	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	90	169.1	47.1	0	0	0	0	107.8	K234 F238	K234-S236 PolarHBondContact O-N 3.41Å; S236-F238 PolarHBondContact O-N 3.02Å
237	N	56.8	Low	60.9	Low	108 Å²	108	78.5 Å²	78.5	58%	0.578	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	89.4	-179.3	-74.7	-14.8	0	0	0	110.9	V235	V235-N237 WeakPolarHBondContact CG1-OD1 3.27Å; V235-N237 PolarHBondContact O-N 2.85Å
238	F	62.6	Low	61.4	Low	51 Å²	51	83.9 Å²	83.9	22%	0.224	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	112.7	164.6	-52	-58.6	0	0	0	107.9	V228 T229 S236 G285 I287	V228-F238 WeakPolarHBondContact CA-O 3.26Å; T229-F238 PolarHBondContact N-O 2.89Å; T229-F238 WeakPolarHBondContact OG1-CD2 3.41Å; S236-F238 PolarHBondContact O-N 3.02Å; F238-G285 WeakPolarHBondContact CD1-O 3.4Å; F238-G285 WeakPolarHBondContact CE1-O 3.45Å; F238-I287 HydrophobicContact CB-CD1 4.41Å; F238-I287 HydrophobicContact CB-CG1 4.4Å
239	C	65	Low	62.1	Low	84 Å²	84	82.9 Å²	82.9	57%	0.568	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.4	-178.5	-172.8	0	0	0	0	110	F227	F227-C239 CarbonylContact O-C 3.4Å; F227-C239 VanDerWaalsContact O-CA 3.26Å; F227-C239 WeakPolarHBondContact O-CA 3.37Å
240	F	67.4	Low	62.8	Low	31 Å²	31	83.2 Å²	83.2	14%	0.136	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.1	165.7	-174.2	-97.8	0	0	0	108.6	A226 F227 M242 L278 I287 E289	A226-F240 CarbonylContact C-O 3.51Å; A226-F240 WeakPolarHBondContact CA-O 3.49Å; F227-F240 HydrophobicContact CB-CB 4.27Å; F227-F240 HydrophobicContact CD2-CB 4.47Å; F227-F240 HydrophobicContact CD2-CD1 4.02Å; F227-F240 PolarHBondContact N-O 2.93Å; F227-F240 PolarHBondContact O-N 3.44Å; F240-M242 HydrophobicContact CD1-CG 4.38Å; F240-M242 HydrophobicContact CE1-CG 4.36Å; F240-L278 HydrophobicContact CD1-CD1 3.77Å; F240-L278 HydrophobicContact CD1-CD2 4.21Å; F240-L278 HydrophobicContact CE1-CD1 3.95Å; F240-L278 HydrophobicContact CE1-CD2 3.68Å; F240-L278 HydrophobicContact CE1-CG 4.49Å; F240-L278 HydrophobicContact CE2-CD2 4.08Å; F240-L278 HydrophobicContact CG-CD1 4.3Å; F240-L278 HydrophobicContact CZ-CD2 3.6Å; F240-I287 HydrophobicContact CB-CB 3.83Å; F240-I287 HydrophobicContact CB-CD1 4Å; F240-I287 HydrophobicContact CB-CG2 3.77Å; F240-I287 HydrophobicContact CD2-CB 4.13Å; F240-I287 HydrophobicContact CD2-CG2 3.92Å; F240-I287 WeakPolarHBondContact CD2-O 3.28Å; F240-I287 HydrophobicContact CG-CB 4.31Å; F240-I287 HydrophobicContact CG-CG2 3.94Å; F240-E289 HydrophobicContact CZ-CG 4.15Å
241	R	71.4	Confident	63.9	Low	188 Å²	188	81 Å²	81	71%	0.709	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.6	173.3	-135.1	-178.4	-142.3	172.7	4.8	108.9	N225	N225-R241 WeakPolarHBondContact O-CA 3.41Å
242	M	69.5	Low	65	Low	13 Å²	13	78.3 Å²	78.3	6%	0.064	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-71.4	159.5	178.4	-57.5	-178.8	-123.5	0	0	110.8	N225 F227 F240 V249 Y265	N225-M242 HydrophobicContact CB-CB 4.23Å; N225-M242 PolarHBondContact O-N 2.82Å; F227-M242 HydrophobicContact CD2-CE 3.89Å; F227-M242 HydrophobicContact CD2-CG 4.32Å; F227-M242 HydrophobicContact CD2-SD 4.47Å; F227-M242 HydrophobicContact CE1-CE 4.33Å; F227-M242 HydrophobicContact CE2-CE 3.28Å; F227-M242 HydrophobicContact CE2-CG 3.85Å; F227-M242 HydrophobicContact CE2-SD 3.57Å; F227-M242 VanDerWaalsContact CE2-SD 3.57Å; F227-M242 HydrophobicContact CZ-CE 3.53Å; F227-M242 HydrophobicContact CZ-SD 4.03Å; F240-M242 HydrophobicContact CD1-CG 4.38Å; F240-M242 HydrophobicContact CE1-CG 4.36Å; M242-V249 HydrophobicContact CE-CG2 3.83Å; M242-V249 HydrophobicContact SD-CG2 3.37Å; M242-V249 WeakPolarHBondContact SD-CG2 3.33Å; M242-Y265 HydrophobicContact SD-CE2 4.16Å
243	A	68.4	Low	66.2	Low	40 Å²	40	74.3 Å²	74.3	33%	0.331	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-71.1	145.4	178.6	0	0	0	0	0	111	S245 E246	A243-S245 PolarHBondContact O-N 3.15Å; A243-S245 VanDerWaalsContact O-N 3.07Å; A243-E246 HydrophobicContact CB-CG 4.44Å; A243-E246 WeakPolarHBondContact O-CB 3.45Å; A243-E246 PolarHBondContact O-N 3.11Å
244	E	64.2	Low	67.9	Low	199 Å²	199	64.2 Å²	64.2	93%	0.93	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.5	179.1	-70.2	-179.7	172	0	0	113.8	E246	E244-E246 PolarHBondContact O-N 3.16Å
245	S	65.7	Low	69.4	Low	71 Å²	71	58.2 Å²	58.2	50%	0.497	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-17.3	174.9	56	0	0	0	0	113.8	A243 T247 D269	A243-S245 PolarHBondContact O-N 3.15Å; A243-S245 VanDerWaalsContact O-N 3.07Å; S245-T247 PolarHBondContact O-N 3.05Å; S245-D269 WeakPolarHBondContact O-CB 3.49Å
246	E	70.1	Confident	70.6	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	28%	0.275	C	S	.	.			trans	-89.1	87.2	-179.2	-61	174.4	-166.1	0	0	107.8	A243 E244 R248 Y265 Y267 R293	A243-E246 HydrophobicContact CB-CG 4.44Å; A243-E246 WeakPolarHBondContact O-CB 3.45Å; A243-E246 PolarHBondContact O-N 3.11Å; E244-E246 PolarHBondContact O-N 3.16Å; E246-R248 PolarHBondContact O-N 2.91Å; E246-Y265 PolarHBondContact OE1-OH 3.29Å; E246-Y265 WeakPolarHBondContact OE2-CE2 3.43Å; E246-Y265 PolarHBondContact OE2-OH 3.11Å; E246-Y267 HydrophobicContact CB-CD2 4.02Å; E246-Y267 HydrophobicContact CB-CE2 4.5Å; E246-Y267 HydrophobicContact CB-CG 4.34Å; E246-Y267 HydrophobicContact CG-CD2 3.75Å; E246-Y267 HydrophobicContact CG-CE2 3.77Å; E246-Y267 HydrophobicContact CG-CG 4.15Å; E246-R293 IonicContact OE1-CZ 3.6Å; E246-R293 IonicContact OE1-NH1 2.92Å; E246-R293 PolarHBondContact OE1-NH1 3.14Å; E246-R293 IonicContact OE1-NH2 2.73Å; E246-R293 PolarHBondContact OE1-NH2 3.48Å
247	T	67.3	Low	71.4	Confident	87 Å²	87	54 Å²	54	53%	0.534	28%	0.278	S	S	.	.			trans	-70.1	-34.5	-168.5	59	0	0	0	0	112.3	S245 E268	S245-T247 PolarHBondContact O-N 3.05Å; T247-E268 PolarHBondContact N-O 3.08Å; T247-E268 PolarHBondContact OG1-O 2.79Å
248	R	73.9	Confident	72	Confident	114 Å²	114	50.6 Å²	50.6	43%	0.43	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	122	-176.7	-175.9	-177.8	178.5	-164.3	0.5	112.5	E246 Y267 E268	E246-R248 PolarHBondContact O-N 2.91Å; R248-Y267 CarbonylContact O-C 3.56Å; R248-Y267 WeakPolarHBondContact O-CA 3.32Å; R248-E268 HydrophobicContact CB-CB 4.37Å; R248-E268 PolarHBondContact N-O 2.85Å; R248-E268 IonicContact NH1-OE2 2.73Å; R248-E268 PolarHBondContact O-N 2.77Å
249	V	76.8	Confident	72.4	Confident	12 Å²	12	57.6 Å²	57.6	7%	0.073	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126.4	168.5	-177.6	0	0	0	0	109.3	Y222 M242 V252 Y265 L266	Y222-V249 HydrophobicContact CD1-CB 4.02Å; Y222-V249 HydrophobicContact CD1-CG1 4.46Å; Y222-V249 HydrophobicContact CE1-CB 3.74Å; Y222-V249 HydrophobicContact CE1-CG1 3.73Å; M242-V249 HydrophobicContact CE-CG2 3.83Å; M242-V249 HydrophobicContact SD-CG2 3.37Å; M242-V249 WeakPolarHBondContact SD-CG2 3.33Å; V249-V252 HydrophobicContact CG1-CG2 3.6Å; V249-Y265 HydrophobicContact CG1-CD2 4.28Å; V249-Y265 HydrophobicContact CG2-CD2 4.4Å; V249-L266 CarbonylContact C-O 3.57Å; V249-L266 WeakPolarHBondContact CG1-O 3.45Å
250	I	77.2	Confident	73	Confident	26 Å²	26	57.5 Å²	57.5	13%	0.133	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-54.6	-177.7	-61.3	168.7	0	0	0	110.6	L266 E268 C273 C301	I250-L266 HydrophobicContact CB-CB 4.17Å; I250-L266 PolarHBondContact N-O 2.91Å; I250-E268 HydrophobicContact CD1-CB 4.23Å; I250-C273 HydrophobicContact CD1-CB 4.41Å; I250-C273 VanDerWaalsContact CD1-SG 3.54Å; I250-C301 WeakPolarHBondContact CG2-O 3.41Å
251	D	77.5	Confident	73.5	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	150.9	-177.1	-167.2	14	0	0	0	111.2	K190 Y265 L266 M304	K190-D251 IonicContact NZ-OD1 2.62Å; K190-D251 PolarHBondContact NZ-OD1 2.9Å; K190-D251 IonicContact NZ-OD2 3.82Å; K190-D251 PolarHBondContact NZ-OD2 3.28Å; D251-Y265 CarbonylContact O-C 3.46Å; D251-Y265 VanDerWaalsContact O-CA 3.27Å; D251-Y265 WeakPolarHBondContact O-CA 3.22Å; D251-L266 PolarHBondContact O-N 2.89Å; D251-M304 HydrophobicContact CB-CB 4.41Å; D251-M304 WeakPolarHBondContact OD2-CA 3.25Å; D251-M304 WeakPolarHBondContact OD2-CB 3.5Å; D251-M304 PolarHBondContact OD2-N 2.92Å
252	V	80.1	Confident	73.9	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	137.3	-176.1	-172.6	0	0	0	0	109.4	K190 L208 L210 V220 F227 V249 I263 A264	K190-V252 WeakPolarHBondContact CE-O 3.18Å; K190-V252 PolarHBondContact NZ-O 2.89Å; L208-V252 HydrophobicContact CD2-CB 4.2Å; L210-V252 HydrophobicContact CD1-CB 3.9Å; L210-V252 HydrophobicContact CD1-CG1 3.35Å; V220-V252 HydrophobicContact CG1-CG2 4.38Å; V220-V252 HydrophobicContact CG2-CB 4.29Å; V220-V252 HydrophobicContact CG2-CG1 4.12Å; V220-V252 HydrophobicContact CG2-CG2 4.25Å; F227-V252 HydrophobicContact CE1-CB 4.48Å; F227-V252 HydrophobicContact CE1-CG1 3.66Å; F227-V252 HydrophobicContact CE1-CG2 4Å; F227-V252 HydrophobicContact CZ-CG1 4.25Å; F227-V252 HydrophobicContact CZ-CG2 4.2Å; V249-V252 HydrophobicContact CG1-CG2 3.6Å; V252-I263 HydrophobicContact CG1-CG2 3.42Å; V252-I263 VanDerWaalsContact CG1-CG2 3.42Å; V252-A264 CarbonylContact C-O 3.59Å; V252-A264 WeakPolarHBondContact CA-O 3.34Å
253	T	81.3	Confident	74.5	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	161.9	173.4	-160.5	0	0	0	0	112.8	K190 I263 A264 M304 P306 L314	K190-T253 VanDerWaalsContact CE-CB 3.5Å; K190-T253 WeakPolarHBondContact CE-OG1 3.49Å; T253-I263 CarbonylContact O-C 3.6Å; T253-I263 WeakPolarHBondContact O-CA 3.21Å; T253-A264 HydrophobicContact CG2-CB 4.33Å; T253-A264 PolarHBondContact N-O 2.95Å; T253-A264 PolarHBondContact O-N 2.89Å; T253-A264 VanDerWaalsContact O-O 3.09Å; T253-M304 HydrophobicContact CG2-CE 3.64Å; T253-M304 HydrophobicContact CG2-CG 4.38Å; T253-M304 HydrophobicContact CG2-SD 4.36Å; T253-P306 HydrophobicContact CG2-CB 4.47Å; T253-P306 HydrophobicContact CG2-CG 4.39Å; T253-P306 WeakPolarHBondContact OG1-CD 3.49Å; T253-L314 HydrophobicContact CG2-CD1 3.65Å
254	F	80.5	Confident	75.2	Confident	6 Å²	6	46.5 Å²	46.5	3%	0.026	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	132.5	168.3	-83.6	-72.8	0	0	0	110.5	L210 T212 A218 P261 T262 I263 P306	L210-F254 HydrophobicContact CB-CD2 3.77Å; L210-F254 HydrophobicContact CB-CE2 3.64Å; T212-F254 HydrophobicContact CG2-CB 4.36Å; T212-F254 HydrophobicContact CG2-CD1 3.65Å; T212-F254 HydrophobicContact CG2-CD2 3.6Å; T212-F254 HydrophobicContact CG2-CE1 3.66Å; T212-F254 HydrophobicContact CG2-CE2 3.6Å; T212-F254 HydrophobicContact CG2-CG 3.61Å; T212-F254 HydrophobicContact CG2-CZ 3.62Å; A218-F254 HydrophobicContact CB-CE2 3.65Å; A218-F254 HydrophobicContact CB-CZ 3.51Å; F254-P261 HydrophobicContact CE1-CB 4.13Å; F254-T262 WeakPolarHBondContact CA-O 3.36Å; F254-T262 WeakPolarHBondContact CD1-O 3.49Å; F254-I263 HydrophobicContact CD1-CG1 3.8Å; F254-I263 HydrophobicContact CE1-CD1 4.11Å; F254-I263 HydrophobicContact CE1-CG1 3.31Å; F254-I263 HydrophobicContact CZ-CD1 4.19Å; F254-I263 HydrophobicContact CZ-CG1 3.8Å; F254-P306 WeakPolarHBondContact O-CB 3.19Å; F254-P306 VanDerWaalsContact O-CG 3.3Å; F254-P306 WeakPolarHBondContact O-CG 3.32Å
255	L	80.5	Confident	76.1	Confident	45 Å²	45	37 Å²	37	24%	0.236	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-67.1	139.4	167.9	-69.2	177.2	0	0	0	110.2	T262 A264 T277 L314	L255-T262 HydrophobicContact CD1-CG2 3.84Å; L255-T262 PolarHBondContact N-O 2.76Å; L255-A264 HydrophobicContact CD2-CB 4.23Å; L255-A264 HydrophobicContact CG-CB 4.15Å; L255-T277 HydrophobicContact CD1-CG2 4.28Å; L255-L314 HydrophobicContact CD2-CB 4.29Å; L255-L314 HydrophobicContact CD2-CD1 3.98Å
256	H	75.7	Confident	76.9	Confident	10 Å²	10	33.7 Å²	33.7	5%	0.046	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	148.2	173.4	-77	-18.6	0	0	0	111.7	D186 S188 S258 P308 N312	D186-H256 PolarHBondContact O-CE1 3.36Å; D186-H256 VanDerWaalsContact O-CE1 3.31Å; D186-H256 PolarHBondContact O-NE2 3.21Å; S188-H256 VanDerWaalsContact CB-CE1 3.45Å; S188-H256 WeakPolarHBondContact CB-CE1 3.33Å; S188-H256 PolarHBondContact N-CE1 2.84Å; S188-H256 PolarHBondContact OG-CE1 2.85Å; H256-S258 PolarHBondContact O-N 2.88Å; H256-P308 HydrophobicContact CB-CB 4.46Å; H256-N312 PolarHBondContact O-ND2 2.64Å; H256-N312 VanDerWaalsContact O-ND2 3.13Å; H256-N312 PolarHBondContact O-OD1 3.16Å
257	S	67.9	Low	77.5	Confident	42 Å²	42	34 Å²	34	29%	0.294	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	22.5	167.7	-67.1	0	0	0	0	116.9	K309	S257-K309 WeakPolarHBondContact OG-CD 3.35Å; S257-K309 VanDerWaalsContact OG-CE 3.31Å; S257-K309 WeakPolarHBondContact OG-CE 3.47Å; S257-K309 WeakPolarHBondContact OG-CG 3.41Å
258	S	68	Low	78.1	Confident	37 Å²	37	32.9 Å²	32.9	26%	0.259	16%	0.162	S	C	.	.			trans	-76.5	143.1	170	57	0	0	0	0	110.6	H256 K260 T262	H256-S258 PolarHBondContact O-N 2.88Å; S258-K260 VanDerWaalsContact C-N 3.26Å; S258-K260 WeakPolarHBondContact CB-O 3.46Å; S258-K260 PolarHBondContact O-N 2.83Å; S258-K260 PolarHBondContact OG-O 2.82Å; S258-T262 WeakPolarHBondContact CB-OG1 3.39Å; S258-T262 PolarHBondContact OG-N 3.21Å; S258-T262 PolarHBondContact OG-OG1 2.76Å
259	Q	71.7	Confident	78.4	Confident	199 Å²	199	28.9 Å²	28.9	93%	0.93	15%	0.149	S	C	*	.	S	Bend	trans	-61	-39.3	179.3	-79.1	-166.8	-8.7	0	0	111.8
260	K	76.9	Confident	78.5	Confident	82 Å²	82	36.2 Å²	36.2	36%	0.357	19%	0.188	S	C	.	.	S	Bend	trans	-108.3	144.3	169.7	-64.3	-177.2	-179.7	-178.4	0	108.4	S258 T262 I279 D281 Y288	S258-K260 VanDerWaalsContact C-N 3.26Å; S258-K260 WeakPolarHBondContact CB-O 3.46Å; S258-K260 PolarHBondContact O-N 2.83Å; S258-K260 PolarHBondContact OG-O 2.82Å; K260-T262 PolarHBondContact O-N 2.91Å; K260-T262 PolarHBondContact O-OG1 2.99Å; K260-I279 HydrophobicContact CB-CG2 3.71Å; K260-I279 HydrophobicContact CD-CG2 3.77Å; K260-I279 HydrophobicContact CG-CG2 4.39Å; K260-D281 IonicContact NZ-OD1 3.62Å; K260-D281 IonicContact NZ-OD2 3.82Å; K260-D281 PolarHBondContact NZ-OD2 3.41Å; K260-Y288 PolarHBondContact NZ-OH 2.79Å
261	P	78.5	Confident	78.6	Confident	28 Å²	28	41.8 Å²	41.8	18%	0.182	21%	0.213	C	C	.	.			trans	-54.3	124.7	175.5	-13	21.5	0	0	0	109.7	F254 C280	F254-P261 HydrophobicContact CE1-CB 4.13Å; P261-C280 HydrophobicContact CB-CB 4.12Å; P261-C280 WeakPolarHBondContact CD-O 3.27Å; P261-C280 HydrophobicContact CG-CB 4.42Å; P261-C280 PolarHBondContact O-N 2.87Å
262	T	80.5	Confident	78.7	Confident	13 Å²	13	41.7 Å²	41.7	8%	0.08	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	119.5	-177.2	-53	0	0	0	0	109.1	F254 L255 S258 K260 L278 I279	F254-T262 WeakPolarHBondContact CA-O 3.36Å; F254-T262 WeakPolarHBondContact CD1-O 3.49Å; L255-T262 HydrophobicContact CD1-CG2 3.84Å; L255-T262 PolarHBondContact N-O 2.76Å; S258-T262 WeakPolarHBondContact CB-OG1 3.39Å; S258-T262 PolarHBondContact OG-N 3.21Å; S258-T262 PolarHBondContact OG-OG1 2.76Å; K260-T262 PolarHBondContact O-N 2.91Å; K260-T262 PolarHBondContact O-OG1 2.99Å; T262-L278 CarbonylContact C-O 3.55Å; T262-L278 WeakPolarHBondContact CA-O 3.31Å; T262-L278 WeakPolarHBondContact CG2-O 3.45Å; T262-I279 HydrophobicContact CG2-CG1 4.26Å
263	I	81.5	Confident	78.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	129.1	174.4	-58.5	171	0	0	0	107.1	A218 F227 V252 T253 F254 T277 L278	A218-I263 HydrophobicContact CB-CD1 4.2Å; F227-I263 HydrophobicContact CD1-CD1 4.41Å; F227-I263 HydrophobicContact CE1-CG2 4.35Å; V252-I263 HydrophobicContact CG1-CG2 3.42Å; V252-I263 VanDerWaalsContact CG1-CG2 3.42Å; T253-I263 CarbonylContact O-C 3.6Å; T253-I263 WeakPolarHBondContact O-CA 3.21Å; F254-I263 HydrophobicContact CD1-CG1 3.8Å; F254-I263 HydrophobicContact CE1-CD1 4.11Å; F254-I263 HydrophobicContact CE1-CG1 3.31Å; F254-I263 HydrophobicContact CZ-CD1 4.19Å; F254-I263 HydrophobicContact CZ-CG1 3.8Å; I263-T277 CarbonylContact O-C 3.57Å; I263-T277 VanDerWaalsContact O-CA 3.23Å; I263-T277 WeakPolarHBondContact O-CA 3.4Å; I263-L278 HydrophobicContact CB-CB 4.27Å; I263-L278 PolarHBondContact N-O 3.09Å; I263-L278 PolarHBondContact O-N 3.06Å
264	A	83.4	Confident	79	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	140.4	164.4	0	0	0	0	0	108.2	V252 T253 L255 L275 A276 T277 M304 L314	V252-A264 CarbonylContact C-O 3.59Å; V252-A264 WeakPolarHBondContact CA-O 3.34Å; T253-A264 HydrophobicContact CG2-CB 4.33Å; T253-A264 PolarHBondContact N-O 2.95Å; T253-A264 PolarHBondContact O-N 2.89Å; T253-A264 VanDerWaalsContact O-O 3.09Å; L255-A264 HydrophobicContact CD2-CB 4.23Å; L255-A264 HydrophobicContact CG-CB 4.15Å; A264-L275 HydrophobicContact CB-CD1 4.41Å; A264-A276 WeakPolarHBondContact CA-O 3.26Å; A264-T277 HydrophobicContact CB-CG2 4.15Å; A264-M304 HydrophobicContact CB-CE 4.32Å; A264-M304 HydrophobicContact CB-SD 4.35Å; A264-M304 WeakPolarHBondContact O-CE 3.38Å; A264-L314 HydrophobicContact CB-CD1 4.32Å; A264-L314 HydrophobicContact CB-CD2 4.41Å
265	Y	83.7	Confident	79.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	144.1	173.3	70	-79.9	0	0	0	111.6	F227 M242 E246 V249 D251 Y267 A276 L278	F227-Y265 HydrophobicContact CE2-CD1 4.45Å; F227-Y265 HydrophobicContact CZ-CD1 4.35Å; F227-Y265 HydrophobicContact CZ-CG 4.23Å; M242-Y265 HydrophobicContact SD-CE2 4.16Å; E246-Y265 PolarHBondContact OE1-OH 3.29Å; E246-Y265 WeakPolarHBondContact OE2-CE2 3.43Å; E246-Y265 PolarHBondContact OE2-OH 3.11Å; V249-Y265 HydrophobicContact CG1-CD2 4.28Å; V249-Y265 HydrophobicContact CG2-CD2 4.4Å; D251-Y265 CarbonylContact O-C 3.46Å; D251-Y265 VanDerWaalsContact O-CA 3.27Å; D251-Y265 WeakPolarHBondContact O-CA 3.22Å; Y265-Y267 HydrophobicContact CD2-CD1 4.07Å; Y265-Y267 AromaticContact CE2-CD1 3.6Å; Y265-Y267 HydrophobicContact CE2-CD1 3.6Å; Y265-Y267 HydrophobicContact CE2-CE1 4.39Å; Y265-Y267 HydrophobicContact CE2-CG 4.2Å; Y265-A276 HydrophobicContact CD1-CB 4.05Å; Y265-A276 HydrophobicContact CE1-CB 3.44Å; Y265-A276 VanDerWaalsContact CE1-CB 3.44Å; Y265-A276 HydrophobicContact CE2-CB 4.16Å; Y265-A276 PolarHBondContact N-O 3.11Å; Y265-A276 PolarHBondContact O-N 2.88Å; Y265-L278 HydrophobicContact CD1-CD1 4.15Å; Y265-L278 HydrophobicContact CD1-CG 4.21Å; Y265-L278 HydrophobicContact CE1-CD1 3.81Å; Y265-L278 HydrophobicContact CE1-CD2 4.15Å; Y265-L278 HydrophobicContact CE1-CG 3.75Å
266	L	82.9	Confident	79.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	133.8	171.1	-76.4	166	0	0	0	108.8	V249 I250 D251 H274 L275 C301 M304 I316	V249-L266 CarbonylContact C-O 3.57Å; V249-L266 WeakPolarHBondContact CG1-O 3.45Å; I250-L266 HydrophobicContact CB-CB 4.17Å; I250-L266 PolarHBondContact N-O 2.91Å; D251-L266 PolarHBondContact O-N 2.89Å; L266-H274 WeakPolarHBondContact CA-O 3.43Å; L266-L275 HydrophobicContact CD2-CB 4.08Å; L266-L275 HydrophobicContact CD2-CD1 4.09Å; L266-L275 HydrophobicContact CG-CD1 4.25Å; L266-C301 HydrophobicContact CD1-CB 4.35Å; L266-M304 HydrophobicContact CD1-CB 3.67Å; L266-M304 HydrophobicContact CD1-CG 4.29Å; L266-M304 HydrophobicContact CD1-SD 4.04Å; L266-M304 HydrophobicContact CG-SD 3.92Å; L266-I316 HydrophobicContact CD1-CG1 4.44Å; L266-I316 HydrophobicContact CD1-CG2 3.91Å; L266-I316 HydrophobicContact CD2-CD1 4.2Å; L266-I316 HydrophobicContact CD2-CG2 4.38Å
267	Y	81.4	Confident	79.8	Confident	8 Å²	8	40.5 Å²	40.5	3%	0.031	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	155	174.3	71.2	-89.7	0	0	0	110.9	E246 R248 Y265 D269 C273 H274 A276 R293	E246-Y267 HydrophobicContact CB-CD2 4.02Å; E246-Y267 HydrophobicContact CB-CE2 4.5Å; E246-Y267 HydrophobicContact CB-CG 4.34Å; E246-Y267 HydrophobicContact CG-CD2 3.75Å; E246-Y267 HydrophobicContact CG-CE2 3.77Å; E246-Y267 HydrophobicContact CG-CG 4.15Å; R248-Y267 CarbonylContact O-C 3.56Å; R248-Y267 WeakPolarHBondContact O-CA 3.32Å; Y265-Y267 HydrophobicContact CD2-CD1 4.07Å; Y265-Y267 AromaticContact CE2-CD1 3.6Å; Y265-Y267 HydrophobicContact CE2-CD1 3.6Å; Y265-Y267 HydrophobicContact CE2-CE1 4.39Å; Y265-Y267 HydrophobicContact CE2-CG 4.2Å; Y267-D269 HydrophobicContact CE2-CB 4.4Å; Y267-C273 CarbonylContact O-C 3.55Å; Y267-C273 WeakPolarHBondContact O-CA 3.3Å; Y267-H274 HydrophobicContact CD1-CB 4.29Å; Y267-H274 HydrophobicContact CD2-CB 4.5Å; Y267-H274 HydrophobicContact CE1-CB 3.7Å; Y267-H274 HydrophobicContact CE2-CB 3.93Å; Y267-H274 AromaticContact CE2-CD2 3.52Å; Y267-H274 AromaticContact CZ-CD2 3.91Å; Y267-H274 AromaticContact CZ-CG 3.98Å; Y267-H274 PolarHBondContact N-O 2.75Å; Y267-H274 PolarHBondContact O-N 3.38Å; Y267-A276 HydrophobicContact CD1-CB 4.32Å; Y267-A276 HydrophobicContact CE1-CB 3.93Å; Y267-R293 PolarHBondContact OH-NH1 2.77Å; Y267-R293 VanDerWaalsContact OH-NH1 3.12Å
268	E	80.7	Confident	80.5	Confident	63 Å²	63	38.5 Å²	38.5	29%	0.294	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	139.9	173.4	-166.9	177.2	-169.1	0	0	108.8	T247 R248 I250 G272	T247-E268 PolarHBondContact N-O 3.08Å; T247-E268 PolarHBondContact OG1-O 2.79Å; R248-E268 HydrophobicContact CB-CB 4.37Å; R248-E268 PolarHBondContact N-O 2.85Å; R248-E268 IonicContact NH1-OE2 2.73Å; R248-E268 PolarHBondContact O-N 2.77Å; I250-E268 HydrophobicContact CD1-CB 4.23Å; E268-G272 WeakPolarHBondContact CA-O 3.28Å
269	D	80.2	Confident	81.1	Confident	30 Å²	30	38.4 Å²	38.4	16%	0.16	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	-175.8	167.3	68.3	22	0	0	0	109.9	S245 Y267 Q271 G272 H274	S245-D269 WeakPolarHBondContact O-CB 3.49Å; Y267-D269 HydrophobicContact CE2-CB 4.4Å; D269-Q271 PolarHBondContact O-N 3.4Å; D269-Q271 VanDerWaalsContact OD1-CA 3.28Å; D269-Q271 WeakPolarHBondContact OD1-CA 3.49Å; D269-Q271 VanDerWaalsContact OD1-CB 3.28Å; D269-Q271 WeakPolarHBondContact OD1-CB 3.34Å; D269-Q271 PolarHBondContact OD1-N 2.98Å; D269-G272 PolarHBondContact N-O 3.25Å; D269-G272 PolarHBondContact O-N 3.26Å; D269-G272 PolarHBondContact OD1-N 2.88Å; D269-H274 VanDerWaalsContact CG-CD2 3.47Å; D269-H274 IonicContact OD1-CD2 2.75Å; D269-H274 PolarHBondContact OD1-CD2 3.11Å; D269-H274 IonicContact OD1-CE1 3.11Å; D269-H274 IonicContact OD1-NE2 3.08Å; D269-H274 PolarHBondContact OD1-NE2 2.91Å; D269-H274 IonicContact OD2-CD2 3.37Å; D269-H274 PolarHBondContact OD2-CD2 3.11Å; D269-H274 VanDerWaalsContact OD2-CD2 3.28Å; D269-H274 IonicContact OD2-NE2 2.63Å; D269-H274 PolarHBondContact OD2-NE2 3.1Å
270	D	79	Confident	81.4	Confident	166 Å²	166	29.2 Å²	29.2	89%	0.888	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-17.3	179.5	-62.4	-23	0	0	0	114.1
271	Q	79.5	Confident	81.5	Confident	144 Å²	144	25.7 Å²	25.7	67%	0.673	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-7.6	178.5	-53.6	-168.9	3.3	0	0	113.4	D269	D269-Q271 PolarHBondContact O-N 3.4Å; D269-Q271 VanDerWaalsContact OD1-CA 3.28Å; D269-Q271 WeakPolarHBondContact OD1-CA 3.49Å; D269-Q271 VanDerWaalsContact OD1-CB 3.28Å; D269-Q271 WeakPolarHBondContact OD1-CB 3.34Å; D269-Q271 PolarHBondContact OD1-N 2.98Å
272	G	78.2	Confident	81.1	Confident	2 Å²	2	28.4 Å²	28.4	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	122.3	-155.5	177.2	0	0	0	0	0	113.1	E268 D269 H274	E268-G272 WeakPolarHBondContact CA-O 3.28Å; D269-G272 PolarHBondContact N-O 3.25Å; D269-G272 PolarHBondContact O-N 3.26Å; D269-G272 PolarHBondContact OD1-N 2.88Å; G272-H274 PolarHBondContact O-CD2 3.41Å; G272-H274 PolarHBondContact O-NE2 3.37Å
273	C	82.2	Confident	80.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	133.2	-177.5	-174.2	0	0	0	0	112.6	I250 Y267 C296 V297 E298	I250-C273 HydrophobicContact CD1-CB 4.41Å; I250-C273 VanDerWaalsContact CD1-SG 3.54Å; Y267-C273 CarbonylContact O-C 3.55Å; Y267-C273 WeakPolarHBondContact O-CA 3.3Å; C273-C296 CarbonylContact O-C 3.52Å; C273-C296 WeakPolarHBondContact O-CA 3.49Å; C273-C296 PolarHBondContact O-N 3.18Å; C273-V297 PolarHBondContact O-N 2.92Å; C273-E298 WeakPolarHBondContact CB-O 3.41Å
274	H	85.5	Confident	80.2	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.014	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.3	-175.9	-48.7	-79.9	0	0	0	111.6	L266 Y267 D269 G272 L294 T295 C296	L266-H274 WeakPolarHBondContact CA-O 3.43Å; Y267-H274 HydrophobicContact CD1-CB 4.29Å; Y267-H274 HydrophobicContact CD2-CB 4.5Å; Y267-H274 HydrophobicContact CE1-CB 3.7Å; Y267-H274 HydrophobicContact CE2-CB 3.93Å; Y267-H274 AromaticContact CE2-CD2 3.52Å; Y267-H274 AromaticContact CZ-CD2 3.91Å; Y267-H274 AromaticContact CZ-CG 3.98Å; Y267-H274 PolarHBondContact N-O 2.75Å; Y267-H274 PolarHBondContact O-N 3.38Å; D269-H274 VanDerWaalsContact CG-CD2 3.47Å; D269-H274 IonicContact OD1-CD2 2.75Å; D269-H274 PolarHBondContact OD1-CD2 3.11Å; D269-H274 IonicContact OD1-CE1 3.11Å; D269-H274 IonicContact OD1-NE2 3.08Å; D269-H274 PolarHBondContact OD1-NE2 2.91Å; D269-H274 IonicContact OD2-CD2 3.37Å; D269-H274 PolarHBondContact OD2-CD2 3.11Å; D269-H274 VanDerWaalsContact OD2-CD2 3.28Å; D269-H274 IonicContact OD2-NE2 2.63Å; D269-H274 PolarHBondContact OD2-NE2 3.1Å; G272-H274 PolarHBondContact O-CD2 3.41Å; G272-H274 PolarHBondContact O-NE2 3.37Å; H274-L294 WeakPolarHBondContact CA-O 3.47Å; H274-T295 WeakPolarHBondContact ND1-CA 3.23Å; H274-C296 PolarHBondContact ND1-N 3.35Å
275	L	85.6	Confident	79.5	Confident	7 Å²	7	43.6 Å²	43.6	4%	0.037	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.4	175.3	176.3	76.5	0	0	0	110.4	A264 L266 L294 V297 M304 L314 I316	A264-L275 HydrophobicContact CB-CD1 4.41Å; L266-L275 HydrophobicContact CD2-CB 4.08Å; L266-L275 HydrophobicContact CD2-CD1 4.09Å; L266-L275 HydrophobicContact CG-CD1 4.25Å; L275-L294 HydrophobicContact CB-CB 4.14Å; L275-L294 HydrophobicContact CD2-CD1 3.91Å; L275-L294 PolarHBondContact N-O 2.92Å; L275-L294 PolarHBondContact O-N 2.84Å; L275-V297 HydrophobicContact CB-CG2 4.14Å; L275-M304 HydrophobicContact CD1-SD 3.7Å; L275-L314 HydrophobicContact CD1-CD2 3.49Å; L275-L314 VanDerWaalsContact CD1-CD2 3.49Å; L275-L314 HydrophobicContact CD2-CD2 3.66Å; L275-L314 HydrophobicContact CG-CD2 4.22Å; L275-I316 HydrophobicContact CD1-CD1 4.34Å; L275-I316 HydrophobicContact CD2-CD1 4.07Å
276	A	85.2	Confident	79.1	Confident	2 Å²	2	46.9 Å²	46.9	2%	0.017	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	159	172.6	0	0	0	0	0	111.8	A264 Y265 Y267 R293	A264-A276 WeakPolarHBondContact CA-O 3.26Å; Y265-A276 HydrophobicContact CD1-CB 4.05Å; Y265-A276 HydrophobicContact CE1-CB 3.44Å; Y265-A276 VanDerWaalsContact CE1-CB 3.44Å; Y265-A276 HydrophobicContact CE2-CB 4.16Å; Y265-A276 PolarHBondContact N-O 3.11Å; Y265-A276 PolarHBondContact O-N 2.88Å; Y267-A276 HydrophobicContact CD1-CB 4.32Å; Y267-A276 HydrophobicContact CE1-CB 3.93Å; A276-R293 HydrophobicContact CB-CG 4.34Å
277	T	84.4	Confident	78.7	Confident	24 Å²	24	47.7 Å²	47.7	15%	0.147	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.5	177.2	55.9	0	0	0	0	110.7	L255 I263 A264 S290	L255-T277 HydrophobicContact CD1-CG2 4.28Å; I263-T277 CarbonylContact O-C 3.57Å; I263-T277 VanDerWaalsContact O-CA 3.23Å; I263-T277 WeakPolarHBondContact O-CA 3.4Å; A264-T277 HydrophobicContact CB-CG2 4.15Å; T277-S290 PolarHBondContact O-N 3.28Å; T277-S290 WeakPolarHBondContact OG1-CB 3.35Å; T277-S290 PolarHBondContact OG1-O 2.82Å; T277-S290 PolarHBondContact OG1-OG 3Å
278	L	81.1	Confident	78.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	135.1	179.3	-56.6	172.8	0	0	0	109.3	F227 F240 T262 I263 Y265 I287 Y288 E289	F227-L278 HydrophobicContact CD2-CD1 3.6Å; F227-L278 HydrophobicContact CE2-CD1 3.63Å; F227-L278 HydrophobicContact CG-CD1 4.39Å; F227-L278 HydrophobicContact CZ-CD1 4.47Å; F240-L278 HydrophobicContact CD1-CD1 3.77Å; F240-L278 HydrophobicContact CD1-CD2 4.21Å; F240-L278 HydrophobicContact CE1-CD1 3.95Å; F240-L278 HydrophobicContact CE1-CD2 3.68Å; F240-L278 HydrophobicContact CE1-CG 4.49Å; F240-L278 HydrophobicContact CE2-CD2 4.08Å; F240-L278 HydrophobicContact CG-CD1 4.3Å; F240-L278 HydrophobicContact CZ-CD2 3.6Å; T262-L278 CarbonylContact C-O 3.55Å; T262-L278 WeakPolarHBondContact CA-O 3.31Å; T262-L278 WeakPolarHBondContact CG2-O 3.45Å; I263-L278 HydrophobicContact CB-CB 4.27Å; I263-L278 PolarHBondContact N-O 3.09Å; I263-L278 PolarHBondContact O-N 3.06Å; Y265-L278 HydrophobicContact CD1-CD1 4.15Å; Y265-L278 HydrophobicContact CD1-CG 4.21Å; Y265-L278 HydrophobicContact CE1-CD1 3.81Å; Y265-L278 HydrophobicContact CE1-CD2 4.15Å; Y265-L278 HydrophobicContact CE1-CG 3.75Å; L278-I287 HydrophobicContact CB-CG2 3.85Å; L278-I287 HydrophobicContact CD1-CG2 4.25Å; L278-I287 HydrophobicContact CG-CG2 4.48Å; L278-Y288 CarbonylContact C-O 3.42Å; L278-Y288 WeakPolarHBondContact CA-O 3.43Å; L278-E289 HydrophobicContact CD2-CB 4.38Å; L278-E289 HydrophobicContact CD2-CG 3.51Å
279	I	82.1	Confident	78.4	Confident	35 Å²	35	51.4 Å²	51.4	18%	0.179	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	123.7	173.4	-64.6	172.1	0	0	0	108.5	K260 T262 I287 Y288	K260-I279 HydrophobicContact CB-CG2 3.71Å; K260-I279 HydrophobicContact CD-CG2 3.77Å; K260-I279 HydrophobicContact CG-CG2 4.39Å; T262-I279 HydrophobicContact CG2-CG1 4.26Å; I279-I287 WeakPolarHBondContact O-CA 3.14Å; I279-Y288 HydrophobicContact CB-CD2 4.33Å; I279-Y288 HydrophobicContact CB-CE2 3.91Å; I279-Y288 HydrophobicContact CD1-CE2 4.04Å; I279-Y288 HydrophobicContact CG2-CE1 4.47Å; I279-Y288 HydrophobicContact CG2-CE2 4.2Å; I279-Y288 PolarHBondContact N-O 2.62Å; I279-Y288 PolarHBondContact O-N 3.11Å; I279-Y288 VanDerWaalsContact O-N 3.08Å
280	C	77.7	Confident	78.1	Confident	7 Å²	7	51.6 Å²	51.6	5%	0.047	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	108.3	170.5	-55.3	0	0	0	0	108.8	T229 P261 I287	T229-C280 HydrophobicContact CG2-CB 4.42Å; P261-C280 HydrophobicContact CB-CB 4.12Å; P261-C280 WeakPolarHBondContact CD-O 3.27Å; P261-C280 HydrophobicContact CG-CB 4.42Å; P261-C280 PolarHBondContact O-N 2.87Å; C280-I287 HydrophobicContact CB-CG1 4.49Å
281	D	77.9	Confident	77.4	Confident	7 Å²	7	49 Å²	49	4%	0.037	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	94.2	-177.6	-164.3	-18.4	0	0	0	110.7	K260 L283 K284 G285 T286 Y288	K260-D281 IonicContact NZ-OD1 3.62Å; K260-D281 IonicContact NZ-OD2 3.82Å; K260-D281 PolarHBondContact NZ-OD2 3.41Å; D281-L283 PolarHBondContact O-N 2.83Å; D281-L283 PolarHBondContact OD1-N 3.07Å; D281-K284 HydrophobicContact CB-CB 4.15Å; D281-K284 HydrophobicContact CB-CG 4.46Å; D281-K284 PolarHBondContact O-N 3.27Å; D281-K284 VanDerWaalsContact O-N 3.08Å; D281-G285 PolarHBondContact O-N 2.8Å; D281-T286 PolarHBondContact N-O 2.81Å; D281-T286 PolarHBondContact O-N 2.65Å; D281-Y288 HydrophobicContact CB-CD1 4.32Å; D281-Y288 HydrophobicContact CB-CE1 3.45Å; D281-Y288 VanDerWaalsContact CB-CE1 3.45Å; D281-Y288 PolarHBondContact OD2-OH 2.84Å
282	K	69.9	Low	76.6	Confident	86 Å²	86	46.8 Å²	46.8	37%	0.374	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-33.7	178.5	-73.5	-167.6	169.9	-164.7	0	113	Q216 D231 K284 G285	Q216-K282 VanDerWaalsContact CD-CE 3.43Å; D231-K282 IonicContact OD1-NZ 3.88Å; D231-K282 PolarHBondContact OD1-NZ 2.84Å; D231-K282 IonicContact OD2-NZ 3.71Å; D231-K282 PolarHBondContact OD2-NZ 3.31Å; K282-K284 VanDerWaalsContact C-N 3.35Å; K282-G285 PolarHBondContact O-N 3.48Å
283	L	72.5	Confident	76	Confident	166 Å²	166	50.3 Å²	50.3	87%	0.869	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-33.9	-179.3	-68	168.3	0	0	0	111.7	D281	D281-L283 PolarHBondContact O-N 2.83Å; D281-L283 PolarHBondContact OD1-N 3.07Å
284	K	71.4	Confident	75.3	Confident	139 Å²	139	52 Å²	52	60%	0.604	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-14.2	176.3	-68.5	-172.9	177.8	-178.2	0	113.3	D281 K282 T286 Y288	D281-K284 HydrophobicContact CB-CB 4.15Å; D281-K284 HydrophobicContact CB-CG 4.46Å; D281-K284 PolarHBondContact O-N 3.27Å; D281-K284 VanDerWaalsContact O-N 3.08Å; K282-K284 VanDerWaalsContact C-N 3.35Å; K284-T286 PolarHBondContact O-N 2.8Å; K284-Y288 HydrophobicContact CD-CE1 4.16Å
285	G	69.1	Low	74.2	Confident	26 Å²	26	56.7 Å²	56.7	27%	0.268	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	30.1	-172.6	0	0	0	0	0	112.8	F238 D281 K282	F238-G285 WeakPolarHBondContact CD1-O 3.4Å; F238-G285 WeakPolarHBondContact CE1-O 3.45Å; D281-G285 PolarHBondContact O-N 2.8Å; K282-G285 PolarHBondContact O-N 3.48Å
286	T	73.8	Confident	73.1	Confident	70 Å²	70	59.7 Å²	59.7	43%	0.429	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	156.5	-178.9	58.6	0	0	0	0	111.4	D281 K284	D281-T286 PolarHBondContact N-O 2.81Å; D281-T286 PolarHBondContact O-N 2.65Å; K284-T286 PolarHBondContact O-N 2.8Å
287	I	75.3	Confident	72.1	Confident	16 Å²	16	61 Å²	61	8%	0.082	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	132	169.3	-58.9	170.7	0	0	0	106.2	F227 T229 F238 F240 L278 I279 C280	F227-I287 HydrophobicContact CB-CD1 4.41Å; T229-I287 HydrophobicContact CG2-CD1 4.14Å; F238-I287 HydrophobicContact CB-CD1 4.41Å; F238-I287 HydrophobicContact CB-CG1 4.4Å; F240-I287 HydrophobicContact CB-CB 3.83Å; F240-I287 HydrophobicContact CB-CD1 4Å; F240-I287 HydrophobicContact CB-CG2 3.77Å; F240-I287 HydrophobicContact CD2-CB 4.13Å; F240-I287 HydrophobicContact CD2-CG2 3.92Å; F240-I287 WeakPolarHBondContact CD2-O 3.28Å; F240-I287 HydrophobicContact CG-CB 4.31Å; F240-I287 HydrophobicContact CG-CG2 3.94Å; L278-I287 HydrophobicContact CB-CG2 3.85Å; L278-I287 HydrophobicContact CD1-CG2 4.25Å; L278-I287 HydrophobicContact CG-CG2 4.48Å; I279-I287 WeakPolarHBondContact O-CA 3.14Å; C280-I287 HydrophobicContact CB-CG1 4.49Å
288	Y	80.7	Confident	71.4	Confident	70 Å²	70	61.7 Å²	61.7	28%	0.275	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	153.8	178	55.7	-93.4	0	0	0	111.8	K260 L278 I279 D281 K284	K260-Y288 PolarHBondContact NZ-OH 2.79Å; L278-Y288 CarbonylContact C-O 3.42Å; L278-Y288 WeakPolarHBondContact CA-O 3.43Å; I279-Y288 HydrophobicContact CB-CD2 4.33Å; I279-Y288 HydrophobicContact CB-CE2 3.91Å; I279-Y288 HydrophobicContact CD1-CE2 4.04Å; I279-Y288 HydrophobicContact CG2-CE1 4.47Å; I279-Y288 HydrophobicContact CG2-CE2 4.2Å; I279-Y288 PolarHBondContact N-O 2.62Å; I279-Y288 PolarHBondContact O-N 3.11Å; I279-Y288 VanDerWaalsContact O-N 3.08Å; D281-Y288 HydrophobicContact CB-CD1 4.32Å; D281-Y288 HydrophobicContact CB-CE1 3.45Å; D281-Y288 VanDerWaalsContact CB-CE1 3.45Å; D281-Y288 PolarHBondContact OD2-OH 2.84Å; K284-Y288 HydrophobicContact CD-CE1 4.16Å
289	E	76	Confident	70.8	Confident	80 Å²	80	67.8 Å²	67.8	37%	0.374	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	137.2	177.8	-81.6	178.5	-144.9	0	0	113	F240 L278 R293	F240-E289 HydrophobicContact CZ-CG 4.15Å; L278-E289 HydrophobicContact CD2-CB 4.38Å; L278-E289 HydrophobicContact CD2-CG 3.51Å; E289-R293 IonicContact OE1-CZ 3.38Å; E289-R293 IonicContact OE1-NE 3.76Å; E289-R293 IonicContact OE1-NH2 3.73Å; E289-R293 PolarHBondContact OE1-NH2 2.89Å; E289-R293 IonicContact OE2-CZ 2.72Å; E289-R293 IonicContact OE2-NE 2.73Å; E289-R293 PolarHBondContact OE2-NE 3.4Å; E289-R293 IonicContact OE2-NH2 2.78Å; E289-R293 PolarHBondContact OE2-NH2 3.14Å
290	S	72.5	Confident	70.3	Confident	33 Å²	33	70.5 Å²	70.5	23%	0.231	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.1	166	147	0	0	0	0	108.4	T277	T277-S290 PolarHBondContact O-N 3.28Å; T277-S290 WeakPolarHBondContact OG1-CB 3.35Å; T277-S290 PolarHBondContact OG1-O 2.82Å; T277-S290 PolarHBondContact OG1-OG 3Å
291	S	65.3	Low	70.2	Confident	113 Å²	113	70.6 Å²	70.6	79%	0.79	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	151	-178.5	45.3	0	0	0	0	112.3
292	P	62.9	Low	70.1	Confident	97 Å²	97	71.4 Å²	71.4	63%	0.63	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	cis	-95.7	154.6	-6.8	35.8	-28.5	0	0	0	113
293	R	65.9	Low	70.7	Confident	75 Å²	75	68.4 Å²	68.4	28%	0.283	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	134.5	168.2	-63.6	178.6	178.4	-148.5	-1.7	109.2	E246 Y267 A276 E289	E246-R293 IonicContact OE1-CZ 3.6Å; E246-R293 IonicContact OE1-NH1 2.92Å; E246-R293 PolarHBondContact OE1-NH1 3.14Å; E246-R293 IonicContact OE1-NH2 2.73Å; E246-R293 PolarHBondContact OE1-NH2 3.48Å; Y267-R293 PolarHBondContact OH-NH1 2.77Å; Y267-R293 VanDerWaalsContact OH-NH1 3.12Å; A276-R293 HydrophobicContact CB-CG 4.34Å; E289-R293 IonicContact OE1-CZ 3.38Å; E289-R293 IonicContact OE1-NE 3.76Å; E289-R293 IonicContact OE1-NH2 3.73Å; E289-R293 PolarHBondContact OE1-NH2 2.89Å; E289-R293 IonicContact OE2-CZ 2.72Å; E289-R293 IonicContact OE2-NE 2.73Å; E289-R293 PolarHBondContact OE2-NE 3.4Å; E289-R293 IonicContact OE2-NH2 2.78Å; E289-R293 PolarHBondContact OE2-NH2 3.14Å
294	L	66.3	Low	71.4	Confident	37 Å²	37	60.5 Å²	60.5	19%	0.194	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	110.4	173.4	-86.8	163.2	0	0	0	108	H274 L275 S325 T330	H274-L294 WeakPolarHBondContact CA-O 3.47Å; L275-L294 HydrophobicContact CB-CB 4.14Å; L275-L294 HydrophobicContact CD2-CD1 3.91Å; L275-L294 PolarHBondContact N-O 2.92Å; L275-L294 PolarHBondContact O-N 2.84Å; L294-S325 WeakPolarHBondContact CD1-OG 3.46Å; L294-T330 HydrophobicContact CD1-CG2 3.79Å; L294-T330 HydrophobicContact CD2-CG2 3.88Å; L294-T330 HydrophobicContact CG-CG2 4.46Å
295	T	63.3	Low	72.1	Confident	101 Å²	101	53.9 Å²	53.9	62%	0.62	31%	0.306	S	S	*	.			trans	-87.2	139.7	-178	49.6	0	0	0	0	111.9	H274	H274-T295 WeakPolarHBondContact ND1-CA 3.23Å
296	C	61.1	Low	72.9	Confident	69 Å²	69	53.2 Å²	53.2	47%	0.466	30%	0.297	S	S	.	.			trans	59.8	64.3	170.1	-138.5	0	0	0	0	113.7	C273 H274	C273-C296 CarbonylContact O-C 3.52Å; C273-C296 WeakPolarHBondContact O-CA 3.49Å; C273-C296 PolarHBondContact O-N 3.18Å; H274-C296 PolarHBondContact ND1-N 3.35Å
297	V	64.5	Low	73.5	Confident	30 Å²	30	49.9 Å²	49.9	18%	0.182	28%	0.277	C	S	.	.	S	Bend	trans	-67.9	-57.5	178.5	-173.8	0	0	0	0	110.4	C273 L275 I316 V323	C273-V297 PolarHBondContact O-N 2.92Å; L275-V297 HydrophobicContact CB-CG2 4.14Å; V297-I316 HydrophobicContact CG1-CD1 3.97Å; V297-I316 HydrophobicContact CG1-CG2 4.18Å; V297-I316 HydrophobicContact CG2-CD1 4.4Å; V297-V323 HydrophobicContact CG1-CB 4.03Å; V297-V323 HydrophobicContact CG1-CG1 4.03Å; V297-V323 HydrophobicContact CG1-CG2 3.91Å
298	E	70.2	Confident	74	Confident	39 Å²	39	49.6 Å²	49.6	18%	0.182	28%	0.276	C	S	.	.			trans	-169.5	141.1	172.3	-163	176.1	162.6	0	0	106.5	C273 D300 C301 G318 L319 E320 S321	C273-E298 WeakPolarHBondContact CB-O 3.41Å; E298-D300 VanDerWaalsContact C-N 3.31Å; E298-D300 PolarHBondContact O-N 3.07Å; E298-C301 PolarHBondContact O-SG 2.79Å; E298-G318 WeakPolarHBondContact OE2-CA 3.46Å; E298-L319 PolarHBondContact OE1-N 2.76Å; E298-E320 PolarHBondContact OE1-N 2.97Å; E298-S321 WeakPolarHBondContact OE2-CB 3.42Å; E298-S321 PolarHBondContact OE2-N 3.32Å; E298-S321 PolarHBondContact OE2-OG 2.83Å
299	F	67.9	Low	73.7	Confident	127 Å²	127	52.7 Å²	52.7	56%	0.557	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-41	-174.3	-82.7	-86.7	0	0	0	113.2
300	D	73	Confident	73.7	Confident	93 Å²	93	53.2 Å²	53.2	50%	0.497	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	54.3	-175.1	-65.1	-39.8	0	0	0	112.2	E298 L319	E298-D300 VanDerWaalsContact C-N 3.31Å; E298-D300 PolarHBondContact O-N 3.07Å; D300-L319 HydrophobicContact CB-CB 3.98Å; D300-L319 PolarHBondContact O-N 2.85Å
301	C	74.9	Confident	74	Confident	9 Å²	9	51.8 Å²	51.8	6%	0.061	29%	0.291	C	S	.	.			trans	-73.1	132.8	169.7	-68.7	0	0	0	0	110.5	I250 L266 E298 I316	I250-C301 WeakPolarHBondContact CG2-O 3.41Å; L266-C301 HydrophobicContact CD1-CB 4.35Å; E298-C301 PolarHBondContact O-SG 2.79Å; C301-I316 HydrophobicContact CB-CG2 4.08Å
302	A	76.4	Confident	74.8	Confident	23 Å²	23	48.3 Å²	48.3	19%	0.19	26%	0.264	C	S	.	.			trans	-118.4	-33.1	-177.2	0	0	0	0	0	114.2	L317 L343 F344	A302-L317 PolarHBondContact N-O 3.46Å; A302-L343 HydrophobicContact CB-CD1 3.9Å; A302-L343 HydrophobicContact CB-CD2 4.28Å; A302-L343 HydrophobicContact CB-CG 3.97Å; A302-F344 WeakPolarHBondContact CB-O 3.44Å
303	L	82.7	Confident	75.8	Confident	23 Å²	23	44.1 Å²	44.1	12%	0.12	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	141.6	-169.1	-173.3	66.9	0	0	0	112	L317 F347	L303-L317 HydrophobicContact CB-CB 4.32Å; L303-L317 HydrophobicContact CB-CD1 4.27Å; L303-L317 HydrophobicContact CD2-CD1 3.8Å; L303-L317 HydrophobicContact CG-CD1 4.39Å; L303-L317 PolarHBondContact O-N 3Å; L303-F347 HydrophobicContact CD1-CD1 4.42Å; L303-F347 HydrophobicContact CD2-CB 4.33Å; L303-F347 HydrophobicContact CD2-CD1 3.82Å; L303-F347 HydrophobicContact CG-CD1 4.33Å
304	M	85.8	Confident	76.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	137.1	178.9	179.5	-172.2	63.2	0	0	112.4	K190 D251 T253 A264 L266 L275 L314 I315 I316	K190-M304 PolarHBondContact NZ-O 2.78Å; D251-M304 HydrophobicContact CB-CB 4.41Å; D251-M304 WeakPolarHBondContact OD2-CA 3.25Å; D251-M304 WeakPolarHBondContact OD2-CB 3.5Å; D251-M304 PolarHBondContact OD2-N 2.92Å; T253-M304 HydrophobicContact CG2-CE 3.64Å; T253-M304 HydrophobicContact CG2-CG 4.38Å; T253-M304 HydrophobicContact CG2-SD 4.36Å; A264-M304 HydrophobicContact CB-CE 4.32Å; A264-M304 HydrophobicContact CB-SD 4.35Å; A264-M304 WeakPolarHBondContact O-CE 3.38Å; L266-M304 HydrophobicContact CD1-CB 3.67Å; L266-M304 HydrophobicContact CD1-CG 4.29Å; L266-M304 HydrophobicContact CD1-SD 4.04Å; L266-M304 HydrophobicContact CG-SD 3.92Å; L275-M304 HydrophobicContact CD1-SD 3.7Å; M304-L314 HydrophobicContact CG-CD1 3.44Å; M304-L314 VanDerWaalsContact CG-CD1 3.44Å; M304-L314 HydrophobicContact CG-CD2 3.71Å; M304-L314 HydrophobicContact CG-CG 3.56Å; M304-L314 HydrophobicContact SD-CD1 3.64Å; M304-L314 HydrophobicContact SD-CD2 3.26Å; M304-L314 WeakPolarHBondContact SD-CD2 3.43Å; M304-L314 HydrophobicContact SD-CG 3.78Å; M304-I315 VanDerWaalsContact CA-O 3.27Å; M304-I315 WeakPolarHBondContact CA-O 3.28Å; M304-I316 HydrophobicContact CG-CG1 4.09Å; M304-I316 HydrophobicContact SD-CG1 4.49Å
305	F	87.2	Confident	77.9	Confident	1 Å²	1	39 Å²	39	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	147.6	175.2	63.3	-88.7	0	0	0	113.3	I315 L317 F347 Y356 L368	F305-I315 HydrophobicContact CD1-CB 4.36Å; F305-I315 HydrophobicContact CD2-CB 4.39Å; F305-I315 HydrophobicContact CE1-CB 3.96Å; F305-I315 HydrophobicContact CE1-CG2 3.91Å; F305-I315 HydrophobicContact CE2-CB 3.99Å; F305-I315 HydrophobicContact CE2-CD1 3.69Å; F305-I315 HydrophobicContact CE2-CG1 4.05Å; F305-I315 HydrophobicContact CZ-CB 3.77Å; F305-I315 HydrophobicContact CZ-CD1 3.72Å; F305-I315 HydrophobicContact CZ-CG1 4.16Å; F305-I315 HydrophobicContact CZ-CG2 3.86Å; F305-I315 PolarHBondContact N-O 2.81Å; F305-I315 PolarHBondContact O-N 3.39Å; F305-L317 HydrophobicContact CE1-CD1 4.19Å; F305-L317 HydrophobicContact CE1-CG 4.4Å; F305-F347 HydrophobicContact CB-CD1 4.2Å; F305-F347 HydrophobicContact CB-CD2 4.41Å; F305-F347 HydrophobicContact CB-CE1 3.62Å; F305-F347 HydrophobicContact CB-CE2 3.85Å; F305-F347 HydrophobicContact CB-CZ 3.42Å; F305-F347 VanDerWaalsContact CB-CZ 3.42Å; F305-F347 HydrophobicContact CD1-CB 4.39Å; F305-F347 AromaticContact CD1-CD1 3.85Å; F305-F347 HydrophobicContact CD1-CD1 3.85Å; F305-F347 HydrophobicContact CD1-CD2 4.16Å; F305-F347 HydrophobicContact CD1-CE1 4.16Å; F305-F347 HydrophobicContact CD1-CE2 4.44Å; F305-F347 AromaticContact CD1-CG 3.86Å; F305-F347 HydrophobicContact CD1-CG 3.86Å; F305-F347 HydrophobicContact CD1-CZ 4.44Å; F305-F347 HydrophobicContact CD2-CD2 4.2Å; F305-F347 HydrophobicContact CD2-CE2 4.12Å; F305-F347 HydrophobicContact CE1-CB 4.24Å; F305-F347 HydrophobicContact CE1-CD2 4.46Å; F305-F347 HydrophobicContact CE1-CG 4.16Å; F305-F347 HydrophobicContact CE2-CD2 4.5Å; F305-F347 HydrophobicContact CG-CD1 4.17Å; F305-F347 HydrophobicContact CG-CD2 4.01Å; F305-F347 HydrophobicContact CG-CE1 4.07Å; F305-F347 AromaticContact CG-CE2 3.9Å; F305-F347 HydrophobicContact CG-CE2 3.9Å; F305-F347 HydrophobicContact CG-CG 4.16Å; F305-F347 AromaticContact CG-CZ 3.93Å; F305-F347 HydrophobicContact CG-CZ 3.93Å; F305-Y356 HydrophobicContact CD2-CD1 4.33Å; F305-Y356 HydrophobicContact CD2-CE1 4.13Å; F305-Y356 AromaticContact CE2-CD1 3.68Å; F305-Y356 HydrophobicContact CE2-CD1 3.68Å; F305-Y356 HydrophobicContact CE2-CD2 4.31Å; F305-Y356 AromaticContact CE2-CE1 3.76Å; F305-Y356 HydrophobicContact CE2-CE1 3.76Å; F305-Y356 HydrophobicContact CE2-CE2 4.41Å; F305-Y356 AromaticContact CE2-CG 3.96Å; F305-Y356 HydrophobicContact CE2-CG 3.96Å; F305-Y356 HydrophobicContact CZ-CD1 4.33Å; F305-Y356 HydrophobicContact CZ-CG 4.32Å; F305-L368 HydrophobicContact CZ-CD2 4.16Å
306	P	86.3	Confident	79.1	Confident	12 Å²	12	34.2 Å²	34.2	8%	0.078	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	147.5	-178.2	34.4	-35.4	0	0	0	111.2	T253 F254 G313	T253-P306 HydrophobicContact CG2-CB 4.47Å; T253-P306 HydrophobicContact CG2-CG 4.39Å; T253-P306 WeakPolarHBondContact OG1-CD 3.49Å; F254-P306 WeakPolarHBondContact O-CB 3.19Å; F254-P306 VanDerWaalsContact O-CG 3.3Å; F254-P306 WeakPolarHBondContact O-CG 3.32Å; P306-G313 WeakPolarHBondContact CA-O 3.46Å
307	I	86.3	Confident	80.3	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	128.5	170.1	-48.1	-173.5	0	0	0	108.9	V311 N312 G313 I315 F324 V370	I307-V311 HydrophobicContact CB-CG1 4.38Å; I307-V311 HydrophobicContact CD1-CG1 4.06Å; I307-V311 HydrophobicContact CG2-CB 3.89Å; I307-V311 HydrophobicContact CG2-CG1 3.97Å; I307-N312 WeakPolarHBondContact O-CA 3.47Å; I307-N312 PolarHBondContact O-OD1 3.44Å; I307-G313 PolarHBondContact N-O 2.92Å; I307-I315 HydrophobicContact CD1-CD1 3.51Å; I307-I315 HydrophobicContact CD1-CG1 3.5Å; I307-I315 VanDerWaalsContact CD1-CG1 3.5Å; I307-I315 HydrophobicContact CG1-CD1 3.88Å; I307-I315 HydrophobicContact CG1-CG1 3.65Å; I307-F324 HydrophobicContact CD1-CD2 3.77Å; I307-F324 HydrophobicContact CD1-CE2 3.45Å; I307-F324 VanDerWaalsContact CD1-CE2 3.45Å; I307-F324 HydrophobicContact CD1-CZ 4.49Å; I307-F324 HydrophobicContact CG1-CE2 4.27Å; I307-V370 HydrophobicContact CD1-CG1 3.98Å; I307-V370 HydrophobicContact CD1-CG2 4.15Å
308	P	83.9	Confident	81.1	Confident	10 Å²	10	29.6 Å²	29.6	7%	0.065	16%	0.157	C	C	.	.			trans	-72.5	179.2	175.9	24.6	-26.1	0	0	0	112.6	H256 V311 N312 A352 Y356	H256-P308 HydrophobicContact CB-CB 4.46Å; P308-V311 PolarHBondContact O-N 3.4Å; P308-N312 PolarHBondContact O-N 3.5Å; P308-N312 VanDerWaalsContact O-N 3.13Å; P308-A352 HydrophobicContact CG-CB 3.93Å; P308-Y356 VanDerWaalsContact CD-OH 3.3Å; P308-Y356 WeakPolarHBondContact CD-OH 3.27Å
309	K	75.8	Confident	81.3	Confident	135 Å²	135	30.4 Å²	30.4	59%	0.587	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	146.3	169.8	-84.7	173.9	-175.5	174.4	0	110.6	S257	S257-K309 WeakPolarHBondContact OG-CD 3.35Å; S257-K309 VanDerWaalsContact OG-CE 3.31Å; S257-K309 WeakPolarHBondContact OG-CE 3.47Å; S257-K309 WeakPolarHBondContact OG-CG 3.41Å
310	P	75.3	Confident	81.6	Confident	91 Å²	91	29.2 Å²	29.2	59%	0.591	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	cis	-90	-11.8	10	34.1	-35.6	0	0	0	115.1	A373	P310-A373 HydrophobicContact CB-CB 3.99Å; P310-A373 HydrophobicContact CG-CB 4.2Å
311	V	79.5	Confident	82.1	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.012	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-54.7	-174.9	164.4	0	0	0	0	110.7	I307 P308 F324 R326 V370 A373 F376	I307-V311 HydrophobicContact CB-CG1 4.38Å; I307-V311 HydrophobicContact CD1-CG1 4.06Å; I307-V311 HydrophobicContact CG2-CB 3.89Å; I307-V311 HydrophobicContact CG2-CG1 3.97Å; P308-V311 PolarHBondContact O-N 3.4Å; V311-F324 HydrophobicContact CG1-CE2 4.08Å; V311-F324 HydrophobicContact CG1-CZ 3.75Å; V311-R326 PolarHBondContact O-NE 2.89Å; V311-R326 PolarHBondContact O-NH1 3.26Å; V311-R326 PolarHBondContact O-NH2 2.97Å; V311-V370 HydrophobicContact CB-CG1 4.49Å; V311-V370 HydrophobicContact CG1-CG1 4.13Å; V311-V370 HydrophobicContact CG2-CG1 3.93Å; V311-A373 HydrophobicContact CG2-CB 4.44Å; V311-F376 HydrophobicContact CB-CE2 4.35Å; V311-F376 HydrophobicContact CG1-CE2 3.44Å; V311-F376 VanDerWaalsContact CG1-CE2 3.44Å; V311-F376 HydrophobicContact CG1-CZ 3.94Å; V311-F376 HydrophobicContact CG2-CE2 4.07Å
312	N	81.4	Confident	82.6	Confident	41 Å²	41	25.1 Å²	25.1	22%	0.219	14%	0.137	C	C	.	.			trans	57.1	128.4	-173.7	-136.6	38.8	0	0	0	114.7	H256 I307 P308 R326	H256-N312 PolarHBondContact O-ND2 2.64Å; H256-N312 VanDerWaalsContact O-ND2 3.13Å; H256-N312 PolarHBondContact O-OD1 3.16Å; I307-N312 WeakPolarHBondContact O-CA 3.47Å; I307-N312 PolarHBondContact O-OD1 3.44Å; P308-N312 PolarHBondContact O-N 3.5Å; P308-N312 VanDerWaalsContact O-N 3.13Å; N312-R326 WeakPolarHBondContact O-CD 3.14Å; N312-R326 WeakPolarHBondContact O-CG 3.27Å
313	G	83.6	Confident	83.1	Confident	9 Å²	9	24.3 Å²	24.3	9%	0.093	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.6	-159.9	-179.6	0	0	0	0	0	111.1	P306 I307 S325	P306-G313 WeakPolarHBondContact CA-O 3.46Å; I307-G313 PolarHBondContact N-O 2.92Å; G313-S325 WeakPolarHBondContact CA-O 3.35Å
314	L	87.3	Confident	83.3	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	135.6	-170.6	-168.8	76.9	0	0	0	110	T253 L255 A264 L275 M304 I316 F324 S325	T253-L314 HydrophobicContact CG2-CD1 3.65Å; L255-L314 HydrophobicContact CD2-CB 4.29Å; L255-L314 HydrophobicContact CD2-CD1 3.98Å; A264-L314 HydrophobicContact CB-CD1 4.32Å; A264-L314 HydrophobicContact CB-CD2 4.41Å; L275-L314 HydrophobicContact CD1-CD2 3.49Å; L275-L314 VanDerWaalsContact CD1-CD2 3.49Å; L275-L314 HydrophobicContact CD2-CD2 3.66Å; L275-L314 HydrophobicContact CG-CD2 4.22Å; M304-L314 HydrophobicContact CG-CD1 3.44Å; M304-L314 VanDerWaalsContact CG-CD1 3.44Å; M304-L314 HydrophobicContact CG-CD2 3.71Å; M304-L314 HydrophobicContact CG-CG 3.56Å; M304-L314 HydrophobicContact SD-CD1 3.64Å; M304-L314 HydrophobicContact SD-CD2 3.26Å; M304-L314 WeakPolarHBondContact SD-CD2 3.43Å; M304-L314 HydrophobicContact SD-CG 3.78Å; L314-I316 HydrophobicContact CD2-CD1 3.96Å; L314-I316 HydrophobicContact CD2-CG1 3.91Å; L314-I316 HydrophobicContact CG-CG1 4.31Å; L314-F324 CarbonylContact O-C 3.44Å; L314-F324 WeakPolarHBondContact O-CA 3.38Å; L314-F324 VanDerWaalsContact O-CD2 3.28Å; L314-F324 WeakPolarHBondContact O-CD2 3.44Å; L314-S325 PolarHBondContact N-O 3.31Å; L314-S325 PolarHBondContact O-N 2.93Å
315	I	88.6	Confident	83.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.5	168.5	-55.4	-167.5	0	0	0	108	M304 F305 I307 L317 V322 F324 L368 V370 L379	M304-I315 VanDerWaalsContact CA-O 3.27Å; M304-I315 WeakPolarHBondContact CA-O 3.28Å; F305-I315 HydrophobicContact CD1-CB 4.36Å; F305-I315 HydrophobicContact CD2-CB 4.39Å; F305-I315 HydrophobicContact CE1-CB 3.96Å; F305-I315 HydrophobicContact CE1-CG2 3.91Å; F305-I315 HydrophobicContact CE2-CB 3.99Å; F305-I315 HydrophobicContact CE2-CD1 3.69Å; F305-I315 HydrophobicContact CE2-CG1 4.05Å; F305-I315 HydrophobicContact CZ-CB 3.77Å; F305-I315 HydrophobicContact CZ-CD1 3.72Å; F305-I315 HydrophobicContact CZ-CG1 4.16Å; F305-I315 HydrophobicContact CZ-CG2 3.86Å; F305-I315 PolarHBondContact N-O 2.81Å; F305-I315 PolarHBondContact O-N 3.39Å; I307-I315 HydrophobicContact CD1-CD1 3.51Å; I307-I315 HydrophobicContact CD1-CG1 3.5Å; I307-I315 VanDerWaalsContact CD1-CG1 3.5Å; I307-I315 HydrophobicContact CG1-CD1 3.88Å; I307-I315 HydrophobicContact CG1-CG1 3.65Å; I315-L317 HydrophobicContact CG2-CD2 3.95Å; I315-L317 HydrophobicContact CG2-CG 4.48Å; I315-V322 HydrophobicContact CG2-CG1 3.61Å; I315-F324 HydrophobicContact CG1-CD2 4.3Å; I315-L368 HydrophobicContact CD1-CD2 3.52Å; I315-L368 HydrophobicContact CG2-CD2 4.07Å; I315-V370 HydrophobicContact CD1-CG2 4.26Å; I315-L379 HydrophobicContact CD1-CD2 4.14Å
316	I	88.4	Confident	82.9	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.1	174.8	-58.3	163.5	0	0	0	106.9	L266 L275 V297 C301 M304 L314 V323	L266-I316 HydrophobicContact CD1-CG1 4.44Å; L266-I316 HydrophobicContact CD1-CG2 3.91Å; L266-I316 HydrophobicContact CD2-CD1 4.2Å; L266-I316 HydrophobicContact CD2-CG2 4.38Å; L275-I316 HydrophobicContact CD1-CD1 4.34Å; L275-I316 HydrophobicContact CD2-CD1 4.07Å; V297-I316 HydrophobicContact CG1-CD1 3.97Å; V297-I316 HydrophobicContact CG1-CG2 4.18Å; V297-I316 HydrophobicContact CG2-CD1 4.4Å; C301-I316 HydrophobicContact CB-CG2 4.08Å; M304-I316 HydrophobicContact CG-CG1 4.09Å; M304-I316 HydrophobicContact SD-CG1 4.49Å; L314-I316 HydrophobicContact CD2-CD1 3.96Å; L314-I316 HydrophobicContact CD2-CG1 3.91Å; L314-I316 HydrophobicContact CG-CG1 4.31Å; I316-V323 HydrophobicContact CB-CB 4.32Å; I316-V323 PolarHBondContact N-O 3.21Å; I316-V323 PolarHBondContact O-N 3.38Å
317	L	87.5	Confident	82.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	111.2	178.3	-57.7	179.4	0	0	0	108.8	A302 L303 F305 I315 V322 F344 I358	A302-L317 PolarHBondContact N-O 3.46Å; L303-L317 HydrophobicContact CB-CB 4.32Å; L303-L317 HydrophobicContact CB-CD1 4.27Å; L303-L317 HydrophobicContact CD2-CD1 3.8Å; L303-L317 HydrophobicContact CG-CD1 4.39Å; L303-L317 PolarHBondContact O-N 3Å; F305-L317 HydrophobicContact CE1-CD1 4.19Å; F305-L317 HydrophobicContact CE1-CG 4.4Å; I315-L317 HydrophobicContact CG2-CD2 3.95Å; I315-L317 HydrophobicContact CG2-CG 4.48Å; L317-V322 HydrophobicContact CD2-CB 4.07Å; L317-V322 HydrophobicContact CD2-CG1 3.63Å; L317-V322 HydrophobicContact CD2-CG2 3.5Å; L317-F344 HydrophobicContact CB-CB 4Å; L317-F344 HydrophobicContact CB-CD2 3.84Å; L317-F344 HydrophobicContact CB-CG 4.22Å; L317-F344 HydrophobicContact CD1-CB 3.91Å; L317-F344 HydrophobicContact CD1-CG 4.25Å; L317-I358 HydrophobicContact CD1-CD1 3.86Å; L317-I358 HydrophobicContact CD1-CG1 4.28Å; L317-I358 HydrophobicContact CD1-CG2 3.73Å; L317-I358 HydrophobicContact CD2-CD1 3.78Å; L317-I358 HydrophobicContact CG-CD1 4.49Å
318	G	80.8	Confident	81.6	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.01	20%	0.202	C	C	.	.			trans	-95.8	-180	168.6	0	0	0	0	0	112.1	E298 S321 F344	E298-G318 WeakPolarHBondContact OE2-CA 3.46Å; G318-S321 WeakPolarHBondContact CA-O 3.4Å; G318-S321 PolarHBondContact N-O 3.25Å; G318-F344 WeakPolarHBondContact O-CD2 3.28Å; G318-F344 VanDerWaalsContact O-CE2 3.3Å; G318-F344 WeakPolarHBondContact O-CE2 3.36Å
319	L	75.1	Confident	81.2	Confident	56 Å²	56	40 Å²	40	29%	0.293	23%	0.225	S	C	.	.	S	Bend	trans	-66	-40.5	-177.6	-172.9	69.1	0	0	0	112.5	E298 D300 P341 L343	E298-L319 PolarHBondContact OE1-N 2.76Å; D300-L319 HydrophobicContact CB-CB 3.98Å; D300-L319 PolarHBondContact O-N 2.85Å; L319-P341 WeakPolarHBondContact O-CG 3.49Å; L319-L343 HydrophobicContact CD1-CB 4.44Å; L319-L343 HydrophobicContact CD1-CD1 4.02Å
320	E	74.9	Confident	81.2	Confident	102 Å²	102	37.4 Å²	37.4	48%	0.477	22%	0.22	S	C	.	.	S	Bend	trans	-114	-13.2	-178.4	-65.1	-163.3	173	0	0	114.3	E298 K334 P335	E298-E320 PolarHBondContact OE1-N 2.97Å; E320-K334 IonicContact OE2-NZ 2.87Å; E320-P335 WeakPolarHBondContact O-CD 3.48Å
321	S	81.8	Confident	81.4	Confident	16 Å²	16	37.5 Å²	37.5	11%	0.112	21%	0.212	C	C	.	.			trans	-136.2	153.4	-175	90.3	0	0	0	0	113.6	E298 G318 I333	E298-S321 WeakPolarHBondContact OE2-CB 3.42Å; E298-S321 PolarHBondContact OE2-N 3.32Å; E298-S321 PolarHBondContact OE2-OG 2.83Å; G318-S321 WeakPolarHBondContact CA-O 3.4Å; G318-S321 PolarHBondContact N-O 3.25Å; S321-I333 WeakPolarHBondContact CA-O 3.18Å
322	V	86.4	Confident	81.4	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	117.9	168.5	176.7	0	0	0	0	107.6	I315 L317 S332 I333 L368 L379 M381	I315-V322 HydrophobicContact CG2-CG1 3.61Å; L317-V322 HydrophobicContact CD2-CB 4.07Å; L317-V322 HydrophobicContact CD2-CG1 3.63Å; L317-V322 HydrophobicContact CD2-CG2 3.5Å; V322-S332 CarbonylContact O-C 3.58Å; V322-S332 WeakPolarHBondContact O-CA 3.25Å; V322-I333 HydrophobicContact CB-CD1 4.21Å; V322-I333 HydrophobicContact CB-CG1 3.76Å; V322-I333 HydrophobicContact CG1-CG1 4.42Å; V322-I333 PolarHBondContact N-O 2.59Å; V322-I333 PolarHBondContact O-N 2.7Å; V322-L368 HydrophobicContact CG1-CD2 4.38Å; V322-L379 HydrophobicContact CG1-CD1 4Å; V322-M381 HydrophobicContact CG2-SD 3.58Å; V322-M381 VanDerWaalsContact CG2-SD 3.58Å
323	V	86.5	Confident	81.4	Confident	7 Å²	7	40.1 Å²	40.1	4%	0.042	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.5	-178.2	-173.8	0	0	0	0	109.6	V297 I316 T330 F331	V297-V323 HydrophobicContact CG1-CB 4.03Å; V297-V323 HydrophobicContact CG1-CG1 4.03Å; V297-V323 HydrophobicContact CG1-CG2 3.91Å; I316-V323 HydrophobicContact CB-CB 4.32Å; I316-V323 PolarHBondContact N-O 3.21Å; I316-V323 PolarHBondContact O-N 3.38Å; V323-T330 HydrophobicContact CG1-CG2 4.28Å; V323-F331 CarbonylContact C-O 3.47Å; V323-F331 WeakPolarHBondContact CA-O 3.43Å
324	F	86.7	Confident	81	Confident	11 Å²	11	46.9 Å²	46.9	5%	0.048	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.9	166	178.2	-115	0	0	0	109.8	I307 V311 L314 I315 R326 T330 F331 F376 L379	I307-F324 HydrophobicContact CD1-CD2 3.77Å; I307-F324 HydrophobicContact CD1-CE2 3.45Å; I307-F324 VanDerWaalsContact CD1-CE2 3.45Å; I307-F324 HydrophobicContact CD1-CZ 4.49Å; I307-F324 HydrophobicContact CG1-CE2 4.27Å; V311-F324 HydrophobicContact CG1-CE2 4.08Å; V311-F324 HydrophobicContact CG1-CZ 3.75Å; L314-F324 CarbonylContact O-C 3.44Å; L314-F324 WeakPolarHBondContact O-CA 3.38Å; L314-F324 VanDerWaalsContact O-CD2 3.28Å; L314-F324 WeakPolarHBondContact O-CD2 3.44Å; I315-F324 HydrophobicContact CG1-CD2 4.3Å; F324-R326 HydrophobicContact CE1-CB 3.79Å; F324-R326 HydrophobicContact CZ-CB 3.84Å; F324-T330 CarbonylContact O-C 3.58Å; F324-T330 VanDerWaalsContact O-CA 3.26Å; F324-T330 WeakPolarHBondContact O-CA 3.32Å; F324-F331 PolarHBondContact N-O 2.63Å; F324-F331 PolarHBondContact O-N 3.45Å; F324-F376 HydrophobicContact CD1-CD1 4.47Å; F324-F376 AromaticContact CD1-CE1 3.61Å; F324-F376 HydrophobicContact CD1-CE1 3.61Å; F324-F376 AromaticContact CD1-CZ 3.73Å; F324-F376 HydrophobicContact CD1-CZ 3.73Å; F324-F376 HydrophobicContact CD2-CZ 4.39Å; F324-F376 HydrophobicContact CE1-CD1 4.49Å; F324-F376 AromaticContact CE1-CE1 3.73Å; F324-F376 HydrophobicContact CE1-CE1 3.73Å; F324-F376 HydrophobicContact CE1-CE2 4.01Å; F324-F376 AromaticContact CE1-CZ 3.44Å; F324-F376 HydrophobicContact CE1-CZ 3.44Å; F324-F376 VanDerWaalsContact CE1-CZ 3.44Å; F324-F376 HydrophobicContact CE2-CZ 4.17Å; F324-F376 HydrophobicContact CG-CE1 4.18Å; F324-F376 HydrophobicContact CG-CZ 4.19Å; F324-F376 HydrophobicContact CZ-CE1 4.4Å; F324-F376 HydrophobicContact CZ-CE2 4.12Å; F324-F376 AromaticContact CZ-CZ 3.68Å; F324-F376 HydrophobicContact CZ-CZ 3.68Å; F324-L379 HydrophobicContact CB-CD1 3.6Å; F324-L379 HydrophobicContact CB-CG 4.33Å
325	S	84.2	Confident	80.2	Confident	9 Å²	9	47.4 Å²	47.4	6%	0.063	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.4	175.1	-179.8	0	0	0	0	111	L294 G313 L314 A329	L294-S325 WeakPolarHBondContact CD1-OG 3.46Å; G313-S325 WeakPolarHBondContact CA-O 3.35Å; L314-S325 PolarHBondContact N-O 3.31Å; L314-S325 PolarHBondContact O-N 2.93Å; S325-A329 WeakPolarHBondContact CA-O 3.03Å
326	R	80.2	Confident	79.5	Confident	91 Å²	91	54.1 Å²	54.1	34%	0.343	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	123.6	175.5	-177.3	-177	179.2	174.4	3.9	110.3	V311 N312 F324 G328 A329	V311-R326 PolarHBondContact O-NE 2.89Å; V311-R326 PolarHBondContact O-NH1 3.26Å; V311-R326 PolarHBondContact O-NH2 2.97Å; N312-R326 WeakPolarHBondContact O-CD 3.14Å; N312-R326 WeakPolarHBondContact O-CG 3.27Å; F324-R326 HydrophobicContact CE1-CB 3.79Å; F324-R326 HydrophobicContact CZ-CB 3.84Å; R326-G328 PolarHBondContact O-N 2.88Å; R326-G328 VanDerWaalsContact O-N 3.15Å; R326-A329 PolarHBondContact N-O 3.29Å; R326-A329 PolarHBondContact O-N 3.11Å
327	N	75.7	Confident	78.6	Confident	157 Å²	157	55.8 Å²	55.8	84%	0.84	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	38.1	175.6	-59.7	-15.6	0	0	0	113.7	A329	N327-A329 VanDerWaalsContact C-N 3.3Å; N327-A329 PolarHBondContact O-N 2.71Å
328	G	69.3	Low	77.4	Confident	41 Å²	41	60.4 Å²	60.4	42%	0.423	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	-4.4	-178.8	0	0	0	0	0	115.6	R326	R326-G328 PolarHBondContact O-N 2.88Å; R326-G328 VanDerWaalsContact O-N 3.15Å
329	A	75.9	Confident	76.7	Confident	66 Å²	66	64.2 Å²	64.2	55%	0.545	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	135.2	170.1	0	0	0	0	0	110.4	S325 R326 N327	S325-A329 WeakPolarHBondContact CA-O 3.03Å; R326-A329 PolarHBondContact N-O 3.29Å; R326-A329 PolarHBondContact O-N 3.11Å; N327-A329 VanDerWaalsContact C-N 3.3Å; N327-A329 PolarHBondContact O-N 2.71Å
330	T	77	Confident	76.4	Confident	80 Å²	80	65.7 Å²	65.7	49%	0.491	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	144.1	177.3	53.9	0	0	0	0	111.5	L294 V323 F324	L294-T330 HydrophobicContact CD1-CG2 3.79Å; L294-T330 HydrophobicContact CD2-CG2 3.88Å; L294-T330 HydrophobicContact CG-CG2 4.46Å; V323-T330 HydrophobicContact CG1-CG2 4.28Å; F324-T330 CarbonylContact O-C 3.58Å; F324-T330 VanDerWaalsContact O-CA 3.26Å; F324-T330 WeakPolarHBondContact O-CA 3.32Å
331	F	79.1	Confident	76.2	Confident	93 Å²	93	61.4 Å²	61.4	41%	0.408	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	122.6	174.4	178.3	-98.9	0	0	0	108.3	V323 F324 I333	V323-F331 CarbonylContact C-O 3.47Å; V323-F331 WeakPolarHBondContact CA-O 3.43Å; F324-F331 PolarHBondContact N-O 2.63Å; F324-F331 PolarHBondContact O-N 3.45Å; F331-I333 HydrophobicContact CD1-CG2 4.07Å; F331-I333 HydrophobicContact CE1-CG2 3.33Å; F331-I333 HydrophobicContact CZ-CG2 3.99Å
332	S	80.2	Confident	76	Confident	76 Å²	76	60.8 Å²	60.8	53%	0.531	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	145.3	179.4	66	0	0	0	0	111.8	V322	V322-S332 CarbonylContact O-C 3.58Å; V322-S332 WeakPolarHBondContact O-CA 3.25Å
333	I	80.6	Confident	75.9	Confident	23 Å²	23	62.9 Å²	62.9	12%	0.118	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153	170.8	61.7	157.7	0	0	0	109.9	S321 V322 F331 L368 L379 M381	S321-I333 WeakPolarHBondContact CA-O 3.18Å; V322-I333 HydrophobicContact CB-CD1 4.21Å; V322-I333 HydrophobicContact CB-CG1 3.76Å; V322-I333 HydrophobicContact CG1-CG1 4.42Å; V322-I333 PolarHBondContact N-O 2.59Å; V322-I333 PolarHBondContact O-N 2.7Å; F331-I333 HydrophobicContact CD1-CG2 4.07Å; F331-I333 HydrophobicContact CE1-CG2 3.33Å; F331-I333 HydrophobicContact CZ-CG2 3.99Å; I333-L368 HydrophobicContact CD1-CD1 4.29Å; I333-L379 HydrophobicContact CD1-CB 3.52Å; I333-L379 HydrophobicContact CD1-CD1 4.47Å; I333-L379 HydrophobicContact CG1-CB 3.99Å; I333-L379 HydrophobicContact CG1-CD1 4.32Å; I333-L379 HydrophobicContact CG2-CB 4Å; I333-M381 HydrophobicContact CD1-CB 3.97Å
334	K	74.7	Confident	75.9	Confident	150 Å²	150	62.6 Å²	62.6	65%	0.652	36%	0.357	S	S	*	.			trans	-96.5	138.7	163.4	-67.3	-162	174.8	-151.7	0	109.1	E320	E320-K334 IonicContact OE2-NZ 2.87Å
335	P	71.8	Confident	75.9	Confident	16 Å²	16	63.2 Å²	63.2	10%	0.104	36%	0.363	C	S	.	.			trans	-61.1	138.3	175.9	20.1	-27.6	0	0	0	111.6	E320 C337 P341 M381	E320-P335 WeakPolarHBondContact O-CD 3.48Å; P335-C337 VanDerWaalsContact C-N 3.3Å; P335-C337 PolarHBondContact O-N 3.35Å; P335-P341 HydrophobicContact CG-CG 4.13Å; P335-M381 HydrophobicContact CB-CB 4.39Å; P335-M381 HydrophobicContact CB-CG 4.2Å; P335-M381 HydrophobicContact CB-SD 3.84Å
336	E	72.8	Confident	76.1	Confident	140 Å²	140	63.2 Å²	63.2	65%	0.654	36%	0.362	S	S	*	.	B	Isolated β-bridge	trans	-77.5	80.7	175.2	-69.1	-178.6	-177.5	0	0	109.8	M381	E336-M381 PolarHBondContact N-O 2.93Å
337	C	68.7	Low	76.6	Confident	37 Å²	37	61.4 Å²	61.4	25%	0.25	36%	0.357	C	S	.	.			trans	-138.7	144.4	177.5	52.2	0	0	0	0	112	P335 F339	P335-C337 VanDerWaalsContact C-N 3.3Å; P335-C337 PolarHBondContact O-N 3.35Å; C337-F339 HydrophobicContact CB-CD2 4.08Å; C337-F339 HydrophobicContact CB-CE2 3.96Å; C337-F339 PolarHBondContact O-N 3.3Å; C337-F339 PolarHBondContact SG-O 2.79Å
338	A	63.3	Low	77.3	Confident	96 Å²	96	54.1 Å²	54.1	79%	0.793	32%	0.319	S	S	*	.	S	Bend	trans	-74.7	-2.1	179.1	0	0	0	0	0	113.5
339	F	66.8	Low	78.3	Confident	81 Å²	81	55.5 Å²	55.5	36%	0.355	32%	0.316	S	S	.	.	S	Bend	trans	-140.6	148.8	-170.4	32	-99.6	0	0	0	110	C337 Y383	C337-F339 HydrophobicContact CB-CD2 4.08Å; C337-F339 HydrophobicContact CB-CE2 3.96Å; C337-F339 PolarHBondContact O-N 3.3Å; C337-F339 PolarHBondContact SG-O 2.79Å; F339-Y383 HydrophobicContact CE2-CD2 4.03Å; F339-Y383 HydrophobicContact CE2-CE2 4.28Å; F339-Y383 HydrophobicContact CE2-CG 4.35Å; F339-Y383 HydrophobicContact CZ-CD1 4.17Å; F339-Y383 HydrophobicContact CZ-CD2 4.03Å; F339-Y383 HydrophobicContact CZ-CE1 4.28Å; F339-Y383 HydrophobicContact CZ-CE2 4.14Å; F339-Y383 HydrophobicContact CZ-CG 4.03Å
340	T	68.9	Low	78.9	Confident	87 Å²	87	54.4 Å²	54.4	53%	0.534	30%	0.301	S	S	.	.			trans	-62.6	123.5	175.6	-43.6	0	0	0	0	109.7	R362 R364	T340-R362 PolarHBondContact O-NH1 2.7Å; T340-R364 PolarHBondContact O-NH1 2.97Å
341	P	69.9	Low	79.4	Confident	12 Å²	12	54.9 Å²	54.9	8%	0.078	30%	0.297	C	S	.	.			trans	-61.8	157.6	177.7	25.6	-32.8	0	0	0	111.4	L319 P335 F344	L319-P341 WeakPolarHBondContact O-CG 3.49Å; P335-P341 HydrophobicContact CG-CG 4.13Å; P341-F344 HydrophobicContact CB-CE1 4.26Å; P341-F344 HydrophobicContact CB-CZ 3.95Å; P341-F344 HydrophobicContact CG-CZ 4.29Å
342	G	77.1	Confident	79.5	Confident	4 Å²	4	52.1 Å²	52.1	4%	0.041	29%	0.292	C	S	.	.			trans	-75.7	175.7	163.7	0	0	0	0	0	110.8	F344 D360	G342-F344 PolarHBondContact O-N 3.46Å; G342-D360 PolarHBondContact N-OD2 2.81Å
343	L	83.6	Confident	79.4	Confident	43 Å²	43	48.6 Å²	48.6	23%	0.225	27%	0.267	C	S	.	.			trans	-60.6	124.4	170.6	-169.1	76.2	0	0	0	109.1	A302 L319 C345 D360 T361	A302-L343 HydrophobicContact CB-CD1 3.9Å; A302-L343 HydrophobicContact CB-CD2 4.28Å; A302-L343 HydrophobicContact CB-CG 3.97Å; L319-L343 HydrophobicContact CD1-CB 4.44Å; L319-L343 HydrophobicContact CD1-CD1 4.02Å; L343-C345 PolarHBondContact O-N 3.03Å; L343-D360 CarbonylContact O-C 3.47Å; L343-D360 WeakPolarHBondContact O-CA 3.21Å; L343-T361 HydrophobicContact CB-CG2 4.07Å; L343-T361 PolarHBondContact N-OG1 2.83Å; L343-T361 WeakPolarHBondContact O-CG2 3.24Å; L343-T361 PolarHBondContact O-N 3.33Å; L343-T361 PolarHBondContact O-OG1 3.16Å
344	F	87.1	Confident	79.7	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.009	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	130.2	174.4	-60.6	-61.2	0	0	0	110	A302 L317 G318 P341 G342 I358 D360 Y366 M381	A302-F344 WeakPolarHBondContact CB-O 3.44Å; L317-F344 HydrophobicContact CB-CB 4Å; L317-F344 HydrophobicContact CB-CD2 3.84Å; L317-F344 HydrophobicContact CB-CG 4.22Å; L317-F344 HydrophobicContact CD1-CB 3.91Å; L317-F344 HydrophobicContact CD1-CG 4.25Å; G318-F344 WeakPolarHBondContact O-CD2 3.28Å; G318-F344 VanDerWaalsContact O-CE2 3.3Å; G318-F344 WeakPolarHBondContact O-CE2 3.36Å; P341-F344 HydrophobicContact CB-CE1 4.26Å; P341-F344 HydrophobicContact CB-CZ 3.95Å; P341-F344 HydrophobicContact CG-CZ 4.29Å; G342-F344 PolarHBondContact O-N 3.46Å; F344-I358 HydrophobicContact CB-CG2 4.26Å; F344-I358 HydrophobicContact CD1-CG2 3.53Å; F344-I358 HydrophobicContact CE1-CG2 4.16Å; F344-I358 HydrophobicContact CG-CG2 4.07Å; F344-D360 HydrophobicContact CD1-CB 4.07Å; F344-D360 HydrophobicContact CE1-CB 4.46Å; F344-Y366 HydrophobicContact CD1-CE2 4.45Å; F344-Y366 AromaticContact CE1-CD2 3.92Å; F344-Y366 HydrophobicContact CE1-CD2 3.92Å; F344-Y366 AromaticContact CE1-CE2 3.75Å; F344-Y366 HydrophobicContact CE1-CE2 3.75Å; F344-M381 HydrophobicContact CD1-CE 4.17Å; F344-M381 HydrophobicContact CE1-CE 3.34Å; F344-M381 HydrophobicContact CE2-CE 4.43Å; F344-M381 HydrophobicContact CZ-CE 3.49Å; F344-M381 VanDerWaalsContact CZ-CE 3.49Å; F344-M381 HydrophobicContact CZ-SD 4.17Å
345	C	86.3	Confident	80.4	Confident	24 Å²	24	48.3 Å²	48.3	16%	0.162	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	-24.9	-172.3	55	0	0	0	0	114	L343 G359 D360 T361 P390	L343-C345 PolarHBondContact O-N 3.03Å; C345-G359 PolarHBondContact N-O 3Å; C345-G359 PolarHBondContact SG-O 2.6Å; C345-D360 VanDerWaalsContact SG-C 3.6Å; C345-T361 HydrophobicContact CB-CG2 4.11Å; C345-P390 PolarHBondContact SG-O 2.86Å
346	C	88.9	Confident	81.3	Confident	8 Å²	8	47.7 Å²	47.7	5%	0.054	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	161.2	-176.2	59.1	0	0	0	0	112.1	G359 P390 Q391	C346-G359 PolarHBondContact O-N 2.82Å; C346-P390 VanDerWaalsContact SG-CB 3.6Å; C346-Q391 VanDerWaalsContact CB-O 3.24Å; C346-Q391 WeakPolarHBondContact CB-O 3.22Å
347	F	90.7	Very high	82.3	Confident	53 Å²	53	41 Å²	41	23%	0.232	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	157.2	173.6	75.4	-80.7	0	0	0	110.7	L303 F305 I349 Y356 V357 I358	L303-F347 HydrophobicContact CD1-CD1 4.42Å; L303-F347 HydrophobicContact CD2-CB 4.33Å; L303-F347 HydrophobicContact CD2-CD1 3.82Å; L303-F347 HydrophobicContact CG-CD1 4.33Å; F305-F347 HydrophobicContact CB-CD1 4.2Å; F305-F347 HydrophobicContact CB-CD2 4.41Å; F305-F347 HydrophobicContact CB-CE1 3.62Å; F305-F347 HydrophobicContact CB-CE2 3.85Å; F305-F347 HydrophobicContact CB-CZ 3.42Å; F305-F347 VanDerWaalsContact CB-CZ 3.42Å; F305-F347 HydrophobicContact CD1-CB 4.39Å; F305-F347 AromaticContact CD1-CD1 3.85Å; F305-F347 HydrophobicContact CD1-CD1 3.85Å; F305-F347 HydrophobicContact CD1-CD2 4.16Å; F305-F347 HydrophobicContact CD1-CE1 4.16Å; F305-F347 HydrophobicContact CD1-CE2 4.44Å; F305-F347 AromaticContact CD1-CG 3.86Å; F305-F347 HydrophobicContact CD1-CG 3.86Å; F305-F347 HydrophobicContact CD1-CZ 4.44Å; F305-F347 HydrophobicContact CD2-CD2 4.2Å; F305-F347 HydrophobicContact CD2-CE2 4.12Å; F305-F347 HydrophobicContact CE1-CB 4.24Å; F305-F347 HydrophobicContact CE1-CD2 4.46Å; F305-F347 HydrophobicContact CE1-CG 4.16Å; F305-F347 HydrophobicContact CE2-CD2 4.5Å; F305-F347 HydrophobicContact CG-CD1 4.17Å; F305-F347 HydrophobicContact CG-CD2 4.01Å; F305-F347 HydrophobicContact CG-CE1 4.07Å; F305-F347 AromaticContact CG-CE2 3.9Å; F305-F347 HydrophobicContact CG-CE2 3.9Å; F305-F347 HydrophobicContact CG-CG 4.16Å; F305-F347 AromaticContact CG-CZ 3.93Å; F305-F347 HydrophobicContact CG-CZ 3.93Å; F347-I349 HydrophobicContact CE2-CG1 4.24Å; F347-Y356 HydrophobicContact CD2-CD1 4.46Å; F347-V357 CarbonylContact C-O 3.59Å; F347-V357 WeakPolarHBondContact CA-O 3.44Å; F347-V357 WeakPolarHBondContact CB-O 3.44Å; F347-I358 HydrophobicContact CB-CG1 4.41Å
348	G	90.5	Very high	83.4	Confident	4 Å²	4	39.2 Å²	39.2	4%	0.041	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	153.9	171.9	0	0	0	0	0	110.7	Y356 V357 L393	G348-Y356 WeakPolarHBondContact O-CA 3.39Å; G348-V357 PolarHBondContact N-O 3.09Å; G348-V357 PolarHBondContact O-N 3.23Å; G348-L393 WeakPolarHBondContact CA-O 3.28Å
349	I	90	Very high	84.7	Confident	70 Å²	70	34.7 Å²	34.7	36%	0.359	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.3	-177.4	-57.6	171.6	0	0	0	108.5	L187 F347 A352 Y356	L187-I349 HydrophobicContact CD2-CD1 3.88Å; F347-I349 HydrophobicContact CE2-CG1 4.24Å; I349-A352 HydrophobicContact CG2-CB 4.11Å; I349-Y356 HydrophobicContact CG1-CD1 4.23Å; I349-Y356 HydrophobicContact CG1-CE1 4.16Å
350	I	88.8	Confident	85.7	Confident	43 Å²	43	30.8 Å²	30.8	22%	0.221	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-57.8	171.7	-58.2	160.4	0	0	0	108.5	M355 V357 Y395 L418	I350-M355 HydrophobicContact CB-CB 4.09Å; I350-M355 HydrophobicContact CD1-CB 4.37Å; I350-M355 HydrophobicContact CG2-CB 4.42Å; I350-M355 PolarHBondContact N-O 3.03Å; I350-M355 VanDerWaalsContact N-O 3.13Å; I350-V357 HydrophobicContact CD1-CB 4.18Å; I350-V357 HydrophobicContact CG1-CB 4.47Å; I350-Y395 HydrophobicContact CB-CD1 4.33Å; I350-Y395 HydrophobicContact CG1-CD1 4.47Å; I350-Y395 HydrophobicContact CG1-CD2 4.49Å; I350-Y395 HydrophobicContact CG1-CG 4.22Å; I350-Y395 HydrophobicContact CG2-CD1 4Å; I350-Y395 HydrophobicContact CG2-CE1 3.83Å; I350-L418 HydrophobicContact CD1-CD2 3.66Å
351	E	86.9	Confident	86.5	Confident	90 Å²	90	28.5 Å²	28.5	42%	0.421	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	110.6	175.2	-169.1	-174.6	172.2	0	0	108.3	G353 K354 M355	E351-G353 PolarHBondContact O-N 2.89Å; E351-K354 HydrophobicContact CB-CB 4.4Å; E351-K354 HydrophobicContact CG-CB 4.39Å; E351-K354 PolarHBondContact O-N 3.01Å; E351-K354 WeakPolarHBondContact OE1-CD 3.4Å; E351-K354 VanDerWaalsContact OE1-CE 3.29Å; E351-K354 WeakPolarHBondContact OE1-CE 3.27Å; E351-K354 IonicContact OE1-NZ 2.99Å; E351-K354 PolarHBondContact OE1-NZ 3.49Å; E351-K354 IonicContact OE2-NZ 3.48Å; E351-M355 HydrophobicContact CB-CB 4.26Å; E351-M355 PolarHBondContact N-O 2.68Å; E351-M355 PolarHBondContact O-N 3.22Å
352	A	81.3	Confident	87.2	Confident	35 Å²	35	33 Å²	33	29%	0.289	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	125.3	-175.7	0	0	0	0	0	111.4	L187 P308 I349 K354	L187-A352 HydrophobicContact CD2-CB 4.16Å; P308-A352 HydrophobicContact CG-CB 3.93Å; I349-A352 HydrophobicContact CG2-CB 4.11Å; A352-K354 VanDerWaalsContact C-N 3.32Å; A352-K354 PolarHBondContact O-N 3.13Å
353	G	79.8	Confident	87.7	Confident	2 Å²	2	32.8 Å²	32.8	2%	0.021	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	-4.7	-179.8	0	0	0	0	0	115.5	E351 Y356	E351-G353 PolarHBondContact O-N 2.89Å; G353-Y356 PolarHBondContact N-OH 2.81Å
354	K	85.2	Confident	87.9	Confident	109 Å²	109	32.5 Å²	32.5	47%	0.474	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.5	-47.9	179.3	-63.9	-166.5	-160	150.7	0	114.2	E351 A352 S369 V370	E351-K354 HydrophobicContact CB-CB 4.4Å; E351-K354 HydrophobicContact CG-CB 4.39Å; E351-K354 PolarHBondContact O-N 3.01Å; E351-K354 WeakPolarHBondContact OE1-CD 3.4Å; E351-K354 VanDerWaalsContact OE1-CE 3.29Å; E351-K354 WeakPolarHBondContact OE1-CE 3.27Å; E351-K354 IonicContact OE1-NZ 2.99Å; E351-K354 PolarHBondContact OE1-NZ 3.49Å; E351-K354 IonicContact OE2-NZ 3.48Å; A352-K354 VanDerWaalsContact C-N 3.32Å; A352-K354 PolarHBondContact O-N 3.13Å; K354-S369 WeakPolarHBondContact O-CA 3.38Å; K354-V370 PolarHBondContact O-N 2.93Å
355	M	89	Confident	88.1	Confident	58 Å²	58	32.4 Å²	32.4	29%	0.286	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	129.7	-169.2	-70.5	-63.9	-68.5	0	0	111.8	I350 E351 S369	I350-M355 HydrophobicContact CB-CB 4.09Å; I350-M355 HydrophobicContact CD1-CB 4.37Å; I350-M355 HydrophobicContact CG2-CB 4.42Å; I350-M355 PolarHBondContact N-O 3.03Å; I350-M355 VanDerWaalsContact N-O 3.13Å; E351-M355 HydrophobicContact CB-CB 4.26Å; E351-M355 PolarHBondContact N-O 2.68Å; E351-M355 PolarHBondContact O-N 3.22Å; M355-S369 VanDerWaalsContact SD-CA 3.55Å; M355-S369 WeakPolarHBondContact SD-CB 3.3Å
356	Y	92	Very high	88.4	Confident	3 Å²	3	31.3 Å²	31.3	1%	0.012	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	157.6	-180	-59.4	-94.6	0	0	0	110.1	F305 P308 F347 G348 I349 G353 S367 L368 V370	F305-Y356 HydrophobicContact CD2-CD1 4.33Å; F305-Y356 HydrophobicContact CD2-CE1 4.13Å; F305-Y356 AromaticContact CE2-CD1 3.68Å; F305-Y356 HydrophobicContact CE2-CD1 3.68Å; F305-Y356 HydrophobicContact CE2-CD2 4.31Å; F305-Y356 AromaticContact CE2-CE1 3.76Å; F305-Y356 HydrophobicContact CE2-CE1 3.76Å; F305-Y356 HydrophobicContact CE2-CE2 4.41Å; F305-Y356 AromaticContact CE2-CG 3.96Å; F305-Y356 HydrophobicContact CE2-CG 3.96Å; F305-Y356 HydrophobicContact CZ-CD1 4.33Å; F305-Y356 HydrophobicContact CZ-CG 4.32Å; P308-Y356 VanDerWaalsContact CD-OH 3.3Å; P308-Y356 WeakPolarHBondContact CD-OH 3.27Å; F347-Y356 HydrophobicContact CD2-CD1 4.46Å; G348-Y356 WeakPolarHBondContact O-CA 3.39Å; I349-Y356 HydrophobicContact CG1-CD1 4.23Å; I349-Y356 HydrophobicContact CG1-CE1 4.16Å; G353-Y356 PolarHBondContact N-OH 2.81Å; Y356-S367 WeakPolarHBondContact O-CA 3.46Å; Y356-L368 PolarHBondContact N-O 2.87Å; Y356-L368 PolarHBondContact O-N 3.33Å; Y356-V370 HydrophobicContact CD2-CG2 4.06Å; Y356-V370 HydrophobicContact CE2-CG2 3.87Å
357	V	93	Very high	88.5	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139.9	169.6	86.2	0	0	0	0	108.8	F347 G348 I350 I365 Y366 L384 L393 L401	F347-V357 CarbonylContact C-O 3.59Å; F347-V357 WeakPolarHBondContact CA-O 3.44Å; F347-V357 WeakPolarHBondContact CB-O 3.44Å; G348-V357 PolarHBondContact N-O 3.09Å; G348-V357 PolarHBondContact O-N 3.23Å; I350-V357 HydrophobicContact CD1-CB 4.18Å; I350-V357 HydrophobicContact CG1-CB 4.47Å; V357-I365 HydrophobicContact CG2-CG2 3.32Å; V357-Y366 CarbonylContact C-O 3.56Å; V357-Y366 WeakPolarHBondContact CA-O 3.39Å; V357-Y366 WeakPolarHBondContact CG2-O 3.46Å; V357-L384 HydrophobicContact CG2-CD1 4.25Å; V357-L393 HydrophobicContact CG1-CB 4Å; V357-L393 HydrophobicContact CG1-CD1 3.92Å; V357-L401 HydrophobicContact CG1-CD1 3.97Å; V357-L401 HydrophobicContact CG2-CD2 4.41Å
358	I	92.2	Very high	88.5	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.9	-176.8	-61	174.9	0	0	0	108.7	L317 F344 F347 I365 Y366 L368 M381	L317-I358 HydrophobicContact CD1-CD1 3.86Å; L317-I358 HydrophobicContact CD1-CG1 4.28Å; L317-I358 HydrophobicContact CD1-CG2 3.73Å; L317-I358 HydrophobicContact CD2-CD1 3.78Å; L317-I358 HydrophobicContact CG-CD1 4.49Å; F344-I358 HydrophobicContact CB-CG2 4.26Å; F344-I358 HydrophobicContact CD1-CG2 3.53Å; F344-I358 HydrophobicContact CE1-CG2 4.16Å; F344-I358 HydrophobicContact CG-CG2 4.07Å; F347-I358 HydrophobicContact CB-CG1 4.41Å; I358-I365 CarbonylContact O-C 3.59Å; I358-I365 WeakPolarHBondContact O-CA 3.39Å; I358-Y366 PolarHBondContact N-O 3.45Å; I358-Y366 PolarHBondContact O-N 3.22Å; I358-L368 HydrophobicContact CD1-CB 3.77Å; I358-L368 HydrophobicContact CD1-CD2 3.7Å; I358-L368 HydrophobicContact CD1-CG 4.32Å; I358-L368 HydrophobicContact CG1-CB 4.42Å; I358-M381 HydrophobicContact CB-CE 4.09Å; I358-M381 HydrophobicContact CD1-CE 3.94Å; I358-M381 HydrophobicContact CG2-CE 4.05Å
359	G	91.1	Very high	88.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	144.2	174.7	0	0	0	0	0	112.3	C345 C346 R364	C345-G359 PolarHBondContact N-O 3Å; C345-G359 PolarHBondContact SG-O 2.6Å; C346-G359 PolarHBondContact O-N 2.82Å; G359-R364 WeakPolarHBondContact CA-O 3.32Å
360	D	88.2	Confident	88.2	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	165.1	169.9	76.6	18	0	0	0	113.2	G342 L343 F344 C345 R362 G363 R364 Y366 P390	G342-D360 PolarHBondContact N-OD2 2.81Å; L343-D360 CarbonylContact O-C 3.47Å; L343-D360 WeakPolarHBondContact O-CA 3.21Å; F344-D360 HydrophobicContact CD1-CB 4.07Å; F344-D360 HydrophobicContact CE1-CB 4.46Å; C345-D360 VanDerWaalsContact SG-C 3.6Å; D360-R362 PolarHBondContact O-N 2.83Å; D360-R362 VanDerWaalsContact O-N 3.1Å; D360-R362 WeakPolarHBondContact OD1-CA 3.43Å; D360-R362 WeakPolarHBondContact OD1-CB 3.42Å; D360-R362 PolarHBondContact OD1-N 2.91Å; D360-G363 PolarHBondContact O-N 2.93Å; D360-G363 PolarHBondContact OD1-N 3.27Å; D360-R364 PolarHBondContact N-O 2.94Å; D360-R364 WeakPolarHBondContact OD1-CB 3.32Å; D360-R364 PolarHBondContact OD1-N 2.87Å; D360-R364 WeakPolarHBondContact OD2-CB 3.38Å; D360-R364 WeakPolarHBondContact OD2-CD 3.37Å; D360-Y366 HydrophobicContact CB-CE2 4.15Å; D360-Y366 PolarHBondContact OD2-OH 2.84Å; D360-P390 WeakPolarHBondContact O-CD 3.48Å
361	T	85.2	Confident	87.7	Confident	38 Å²	38	26.8 Å²	26.8	23%	0.233	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.9	179.4	51.2	0	0	0	0	114.4	L343 C345 G363 R389	L343-T361 HydrophobicContact CB-CG2 4.07Å; L343-T361 PolarHBondContact N-OG1 2.83Å; L343-T361 WeakPolarHBondContact O-CG2 3.24Å; L343-T361 PolarHBondContact O-N 3.33Å; L343-T361 PolarHBondContact O-OG1 3.16Å; C345-T361 HydrophobicContact CB-CG2 4.11Å; T361-G363 VanDerWaalsContact C-N 3.35Å; T361-R389 VanDerWaalsContact O-CD 3.28Å; T361-R389 WeakPolarHBondContact O-CD 3.46Å; T361-R389 WeakPolarHBondContact O-CG 3.41Å
362	R	84.1	Confident	87	Confident	107 Å²	107	26.4 Å²	26.4	40%	0.404	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	0.4	174.2	-66.8	-178.2	169.1	171	-2.4	112.4	T340 D360 K463	T340-R362 PolarHBondContact O-NH1 2.7Å; D360-R362 PolarHBondContact O-N 2.83Å; D360-R362 VanDerWaalsContact O-N 3.1Å; D360-R362 WeakPolarHBondContact OD1-CA 3.43Å; D360-R362 WeakPolarHBondContact OD1-CB 3.42Å; D360-R362 PolarHBondContact OD1-N 2.91Å; R362-K463 WeakPolarHBondContact O-CE 3.45Å; R362-K463 PolarHBondContact O-NZ 2.95Å
363	G	87.7	Confident	86.1	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	82.4	18.8	179.3	0	0	0	0	0	113.9	D360 T361 E386 V387	D360-G363 PolarHBondContact O-N 2.93Å; D360-G363 PolarHBondContact OD1-N 3.27Å; T361-G363 VanDerWaalsContact C-N 3.35Å; G363-E386 CarbonylContact O-C 3.51Å; G363-E386 WeakPolarHBondContact O-CA 3.36Å; G363-V387 WeakPolarHBondContact CA-O 3.42Å; G363-V387 WeakPolarHBondContact O-CG2 3.5Å; G363-V387 PolarHBondContact O-N 2.83Å; G363-V387 VanDerWaalsContact O-O 3.08Å
364	R	88.8	Confident	85.1	Confident	37 Å²	37	35.7 Å²	35.7	14%	0.14	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	140.1	176.1	-57.8	170.9	-176.9	160.8	-2.3	109.7	T340 G359 D360 Y366 Y383	T340-R364 PolarHBondContact O-NH1 2.97Å; G359-R364 WeakPolarHBondContact CA-O 3.32Å; D360-R364 PolarHBondContact N-O 2.94Å; D360-R364 WeakPolarHBondContact OD1-CB 3.32Å; D360-R364 PolarHBondContact OD1-N 2.87Å; D360-R364 WeakPolarHBondContact OD2-CB 3.38Å; D360-R364 WeakPolarHBondContact OD2-CD 3.37Å; R364-Y366 HydrophobicContact CB-CE2 3.72Å; R364-Y366 WeakPolarHBondContact CB-OH 3.3Å; R364-Y366 VanDerWaalsContact CD-OH 3.3Å; R364-Y366 WeakPolarHBondContact CD-OH 3.43Å; R364-Y383 HydrophobicContact CB-CD2 4.28Å; R364-Y383 HydrophobicContact CB-CE2 3.91Å; R364-Y383 HydrophobicContact CG-CE2 4.11Å
365	I	91.6	Very high	83.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.1	-178.7	-54.2	-60	0	0	0	109.2	V357 I358 L384 C385 V387 P390 L393 L401	V357-I365 HydrophobicContact CG2-CG2 3.32Å; I358-I365 CarbonylContact O-C 3.59Å; I358-I365 WeakPolarHBondContact O-CA 3.39Å; I365-L384 HydrophobicContact CG2-CD1 4.27Å; I365-L384 WeakPolarHBondContact O-CB 3.43Å; I365-L384 PolarHBondContact O-N 2.83Å; I365-C385 PolarHBondContact N-O 3.48Å; I365-C385 PolarHBondContact O-N 2.98Å; I365-V387 HydrophobicContact CD1-CG2 3.61Å; I365-V387 HydrophobicContact CG1-CG1 4.28Å; I365-V387 HydrophobicContact CG1-CG2 3.49Å; I365-V387 VanDerWaalsContact CG1-CG2 3.49Å; I365-P390 HydrophobicContact CD1-CG 4.19Å; I365-L393 HydrophobicContact CD1-CD1 3.89Å; I365-L393 HydrophobicContact CD1-CD2 3.98Å; I365-L401 HydrophobicContact CG2-CD2 4.31Å
366	Y	90.9	Very high	82.1	Confident	1 Å²	1	37.1 Å²	37.1	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	144.3	-179	-50.7	-96.8	0	0	0	109.5	F344 V357 I358 D360 R364 M381 R382 Y383	F344-Y366 HydrophobicContact CD1-CE2 4.45Å; F344-Y366 AromaticContact CE1-CD2 3.92Å; F344-Y366 HydrophobicContact CE1-CD2 3.92Å; F344-Y366 AromaticContact CE1-CE2 3.75Å; F344-Y366 HydrophobicContact CE1-CE2 3.75Å; V357-Y366 CarbonylContact C-O 3.56Å; V357-Y366 WeakPolarHBondContact CA-O 3.39Å; V357-Y366 WeakPolarHBondContact CG2-O 3.46Å; I358-Y366 PolarHBondContact N-O 3.45Å; I358-Y366 PolarHBondContact O-N 3.22Å; D360-Y366 HydrophobicContact CB-CE2 4.15Å; D360-Y366 PolarHBondContact OD2-OH 2.84Å; R364-Y366 HydrophobicContact CB-CE2 3.72Å; R364-Y366 WeakPolarHBondContact CB-OH 3.3Å; R364-Y366 VanDerWaalsContact CD-OH 3.3Å; R364-Y366 WeakPolarHBondContact CD-OH 3.43Å; Y366-M381 HydrophobicContact CD1-CE 4.01Å; Y366-M381 HydrophobicContact CD2-CE 3.78Å; Y366-M381 HydrophobicContact CG-CE 3.46Å; Y366-M381 VanDerWaalsContact CG-CE 3.46Å; Y366-R382 CarbonylContact C-O 3.59Å; Y366-R382 VanDerWaalsContact CA-O 3.31Å; Y366-R382 WeakPolarHBondContact CA-O 3.41Å; Y366-Y383 HydrophobicContact CD1-CD2 4.33Å; Y366-Y383 HydrophobicContact CE1-CD2 4.02Å
367	S	91.3	Very high	80.4	Confident	13 Å²	13	42.5 Å²	42.5	9%	0.091	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	137.1	163	55.1	0	0	0	0	109.1	Y356 M381 R382	Y356-S367 WeakPolarHBondContact O-CA 3.46Å; S367-M381 CarbonylContact O-C 3.58Å; S367-M381 VanDerWaalsContact O-CA 3.28Å; S367-M381 WeakPolarHBondContact O-CA 3.45Å; S367-R382 PolarHBondContact N-O 2.84Å; S367-R382 PolarHBondContact O-N 3.02Å; S367-R382 PolarHBondContact OG-O 3.25Å
368	L	90.6	Very high	79.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.9	169.1	-179.4	66.4	0	0	0	108.9	F305 I315 V322 I333 Y356 I358 L379 M381	F305-L368 HydrophobicContact CZ-CD2 4.16Å; I315-L368 HydrophobicContact CD1-CD2 3.52Å; I315-L368 HydrophobicContact CG2-CD2 4.07Å; V322-L368 HydrophobicContact CG1-CD2 4.38Å; I333-L368 HydrophobicContact CD1-CD1 4.29Å; Y356-L368 PolarHBondContact N-O 2.87Å; Y356-L368 PolarHBondContact O-N 3.33Å; I358-L368 HydrophobicContact CD1-CB 3.77Å; I358-L368 HydrophobicContact CD1-CD2 3.7Å; I358-L368 HydrophobicContact CD1-CG 4.32Å; I358-L368 HydrophobicContact CG1-CB 4.42Å; L368-L379 HydrophobicContact CD1-CB 4.33Å; L368-L379 HydrophobicContact CD1-CD2 4.2Å; L368-L379 HydrophobicContact CG-CD2 4.5Å; L368-M381 HydrophobicContact CD1-CB 3.99Å; L368-M381 HydrophobicContact CD1-CG 4.5Å
369	S	89.1	Confident	78.8	Confident	39 Å²	39	43.9 Å²	43.9	27%	0.273	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134	175.8	62.4	0	0	0	0	110.5	K354 M355 R380	K354-S369 WeakPolarHBondContact O-CA 3.38Å; M355-S369 VanDerWaalsContact SD-CA 3.55Å; M355-S369 WeakPolarHBondContact SD-CB 3.3Å; S369-R380 PolarHBondContact N-O 3.19Å; S369-R380 PolarHBondContact O-N 2.73Å; S369-R380 VanDerWaalsContact O-N 3.08Å; S369-R380 WeakPolarHBondContact OG-CB 3.2Å; S369-R380 PolarHBondContact OG-O 3.46Å; S369-R380 VanDerWaalsContact OG-O 3.09Å
370	V	86.2	Confident	78.6	Confident	13 Å²	13	50.9 Å²	50.9	8%	0.079	27%	0.265	C	S	.	.			trans	-109.5	121.9	-179.7	-172.2	0	0	0	0	108.4	I307 V311 I315 K354 Y356 F376 L379	I307-V370 HydrophobicContact CD1-CG1 3.98Å; I307-V370 HydrophobicContact CD1-CG2 4.15Å; V311-V370 HydrophobicContact CB-CG1 4.49Å; V311-V370 HydrophobicContact CG1-CG1 4.13Å; V311-V370 HydrophobicContact CG2-CG1 3.93Å; I315-V370 HydrophobicContact CD1-CG2 4.26Å; K354-V370 PolarHBondContact O-N 2.93Å; Y356-V370 HydrophobicContact CD2-CG2 4.06Å; Y356-V370 HydrophobicContact CE2-CG2 3.87Å; V370-F376 HydrophobicContact CG1-CE2 4.13Å; V370-F376 HydrophobicContact CG1-CZ 3.87Å; V370-L379 HydrophobicContact CB-CD2 4.46Å; V370-L379 HydrophobicContact CG1-CD2 4.35Å; V370-L379 HydrophobicContact CG2-CD2 3.95Å
371	G	78.7	Confident	78.6	Confident	18 Å²	18	51 Å²	51	19%	0.186	27%	0.265	C	S	.	.			trans	-63.4	164.6	178	0	0	0	0	0	113.9	D377	G371-D377 WeakPolarHBondContact CA-O 3.33Å
372	S	71.6	Confident	78.7	Confident	82 Å²	82	56.2 Å²	56.2	57%	0.573	28%	0.281	S	S	*	.			trans	-64.7	147.5	-178	-177.5	0	0	0	0	112.8	K374 N375 F376	S372-K374 PolarHBondContact O-N 2.76Å; S372-K374 VanDerWaalsContact O-N 3.16Å; S372-N375 CarbonylContact O-C 3.56Å; S372-N375 PolarHBondContact O-N 2.76Å; S372-F376 PolarHBondContact O-N 3.47Å
373	A	62.7	Low	78.9	Confident	37 Å²	37	54.6 Å²	54.6	31%	0.306	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.4	-178.8	0	0	0	0	0	114.8	P310 V311	P310-A373 HydrophobicContact CB-CB 3.99Å; P310-A373 HydrophobicContact CG-CB 4.2Å; V311-A373 HydrophobicContact CG2-CB 4.44Å
374	K	58.8	Low	78.9	Confident	194 Å²	194	56 Å²	56	84%	0.843	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-29.8	-176.8	-72.8	-174.3	177.1	-179	0	113.8	S372	S372-K374 PolarHBondContact O-N 2.76Å; S372-K374 VanDerWaalsContact O-N 3.16Å
375	N	53.4	Low	78.9	Confident	132 Å²	132	54.9 Å²	54.9	71%	0.706	28%	0.28	S	S	*	.	S	Bend	trans	-142.9	102.5	172.5	-87.1	-13.6	0	0	0	104.8	S372 D377	S372-N375 CarbonylContact O-C 3.56Å; S372-N375 PolarHBondContact O-N 2.76Å; N375-D377 PolarHBondContact O-N 2.87Å
376	F	56.9	Low	78.8	Confident	65 Å²	65	58.4 Å²	58.4	29%	0.285	30%	0.297	S	S	.	.			trans	-71.1	69.6	177	-142.1	-99.8	0	0	0	108.8	V311 F324 V370 S372 G378 L379	V311-F376 HydrophobicContact CB-CE2 4.35Å; V311-F376 HydrophobicContact CG1-CE2 3.44Å; V311-F376 VanDerWaalsContact CG1-CE2 3.44Å; V311-F376 HydrophobicContact CG1-CZ 3.94Å; V311-F376 HydrophobicContact CG2-CE2 4.07Å; F324-F376 HydrophobicContact CD1-CD1 4.47Å; F324-F376 AromaticContact CD1-CE1 3.61Å; F324-F376 HydrophobicContact CD1-CE1 3.61Å; F324-F376 AromaticContact CD1-CZ 3.73Å; F324-F376 HydrophobicContact CD1-CZ 3.73Å; F324-F376 HydrophobicContact CD2-CZ 4.39Å; F324-F376 HydrophobicContact CE1-CD1 4.49Å; F324-F376 AromaticContact CE1-CE1 3.73Å; F324-F376 HydrophobicContact CE1-CE1 3.73Å; F324-F376 HydrophobicContact CE1-CE2 4.01Å; F324-F376 AromaticContact CE1-CZ 3.44Å; F324-F376 HydrophobicContact CE1-CZ 3.44Å; F324-F376 VanDerWaalsContact CE1-CZ 3.44Å; F324-F376 HydrophobicContact CE2-CZ 4.17Å; F324-F376 HydrophobicContact CG-CE1 4.18Å; F324-F376 HydrophobicContact CG-CZ 4.19Å; F324-F376 HydrophobicContact CZ-CE1 4.4Å; F324-F376 HydrophobicContact CZ-CE2 4.12Å; F324-F376 AromaticContact CZ-CZ 3.68Å; F324-F376 HydrophobicContact CZ-CZ 3.68Å; V370-F376 HydrophobicContact CG1-CE2 4.13Å; V370-F376 HydrophobicContact CG1-CZ 3.87Å; S372-F376 PolarHBondContact O-N 3.47Å; F376-G378 PolarHBondContact O-N 2.77Å; F376-L379 HydrophobicContact CE1-CG 4.5Å
377	D	56.5	Low	78.8	Confident	116 Å²	116	58.8 Å²	58.8	62%	0.62	30%	0.299	S	S	*	.			trans	-61.6	105.3	164	-122.6	16	0	0	0	104.2	G371 N375	G371-D377 WeakPolarHBondContact CA-O 3.33Å; N375-D377 PolarHBondContact O-N 2.87Å
378	G	70	Confident	78.6	Confident	22 Å²	22	58.7 Å²	58.7	23%	0.227	30%	0.298	C	S	.	.			trans	-51	168.1	-152.2	0	0	0	0	0	117.1	F376 R380	F376-G378 PolarHBondContact O-N 2.77Å; G378-R380 PolarHBondContact O-N 2.78Å
379	L	82.4	Confident	78.6	Confident	7 Å²	7	62 Å²	62	4%	0.037	31%	0.311	C	S	.	.			trans	-46.2	135.2	170.7	-68.9	171.6	0	0	0	110.3	I315 V322 F324 I333 L368 V370 F376	I315-L379 HydrophobicContact CD1-CD2 4.14Å; V322-L379 HydrophobicContact CG1-CD1 4Å; F324-L379 HydrophobicContact CB-CD1 3.6Å; F324-L379 HydrophobicContact CB-CG 4.33Å; I333-L379 HydrophobicContact CD1-CB 3.52Å; I333-L379 HydrophobicContact CD1-CD1 4.47Å; I333-L379 HydrophobicContact CG1-CB 3.99Å; I333-L379 HydrophobicContact CG1-CD1 4.32Å; I333-L379 HydrophobicContact CG2-CB 4Å; L368-L379 HydrophobicContact CD1-CB 4.33Å; L368-L379 HydrophobicContact CD1-CD2 4.2Å; L368-L379 HydrophobicContact CG-CD2 4.5Å; V370-L379 HydrophobicContact CB-CD2 4.46Å; V370-L379 HydrophobicContact CG1-CD2 4.35Å; V370-L379 HydrophobicContact CG2-CD2 3.95Å; F376-L379 HydrophobicContact CE1-CG 4.5Å
380	R	86.3	Confident	78.7	Confident	147 Å²	147	60.2 Å²	60.2	56%	0.555	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.5	168.2	-61.3	-175.5	-163.1	178.6	4.7	109.9	S369 G378	S369-R380 PolarHBondContact N-O 3.19Å; S369-R380 PolarHBondContact O-N 2.73Å; S369-R380 VanDerWaalsContact O-N 3.08Å; S369-R380 WeakPolarHBondContact OG-CB 3.2Å; S369-R380 PolarHBondContact OG-O 3.46Å; S369-R380 VanDerWaalsContact OG-O 3.09Å; G378-R380 PolarHBondContact O-N 2.78Å
381	M	87.7	Confident	78.9	Confident	3 Å²	3	62.1 Å²	62.1	2%	0.015	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.2	177.4	-171.2	171.2	-173.1	0	0	109.5	V322 I333 P335 E336 F344 I358 Y366 S367 L368	V322-M381 HydrophobicContact CG2-SD 3.58Å; V322-M381 VanDerWaalsContact CG2-SD 3.58Å; I333-M381 HydrophobicContact CD1-CB 3.97Å; P335-M381 HydrophobicContact CB-CB 4.39Å; P335-M381 HydrophobicContact CB-CG 4.2Å; P335-M381 HydrophobicContact CB-SD 3.84Å; E336-M381 PolarHBondContact N-O 2.93Å; F344-M381 HydrophobicContact CD1-CE 4.17Å; F344-M381 HydrophobicContact CE1-CE 3.34Å; F344-M381 HydrophobicContact CE2-CE 4.43Å; F344-M381 HydrophobicContact CZ-CE 3.49Å; F344-M381 VanDerWaalsContact CZ-CE 3.49Å; F344-M381 HydrophobicContact CZ-SD 4.17Å; I358-M381 HydrophobicContact CB-CE 4.09Å; I358-M381 HydrophobicContact CD1-CE 3.94Å; I358-M381 HydrophobicContact CG2-CE 4.05Å; Y366-M381 HydrophobicContact CD1-CE 4.01Å; Y366-M381 HydrophobicContact CD2-CE 3.78Å; Y366-M381 HydrophobicContact CG-CE 3.46Å; Y366-M381 VanDerWaalsContact CG-CE 3.46Å; S367-M381 CarbonylContact O-C 3.58Å; S367-M381 VanDerWaalsContact O-CA 3.28Å; S367-M381 WeakPolarHBondContact O-CA 3.45Å; L368-M381 HydrophobicContact CD1-CB 3.99Å; L368-M381 HydrophobicContact CD1-CG 4.5Å
382	R	87.4	Confident	79.5	Confident	148 Å²	148	64.4 Å²	64.4	56%	0.558	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.9	-177.5	179.6	179.8	177.3	164.9	2	110.5	Y366 S367	Y366-R382 CarbonylContact C-O 3.59Å; Y366-R382 VanDerWaalsContact CA-O 3.31Å; Y366-R382 WeakPolarHBondContact CA-O 3.41Å; S367-R382 PolarHBondContact N-O 2.84Å; S367-R382 PolarHBondContact O-N 3.02Å; S367-R382 PolarHBondContact OG-O 3.25Å
383	Y	88.1	Confident	80.5	Confident	72 Å²	72	60.8 Å²	60.8	28%	0.282	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	134.7	171	172.5	-98.2	0	0	0	111.5	F339 R364 Y366 C385 E386	F339-Y383 HydrophobicContact CE2-CD2 4.03Å; F339-Y383 HydrophobicContact CE2-CE2 4.28Å; F339-Y383 HydrophobicContact CE2-CG 4.35Å; F339-Y383 HydrophobicContact CZ-CD1 4.17Å; F339-Y383 HydrophobicContact CZ-CD2 4.03Å; F339-Y383 HydrophobicContact CZ-CE1 4.28Å; F339-Y383 HydrophobicContact CZ-CE2 4.14Å; F339-Y383 HydrophobicContact CZ-CG 4.03Å; R364-Y383 HydrophobicContact CB-CD2 4.28Å; R364-Y383 HydrophobicContact CB-CE2 3.91Å; R364-Y383 HydrophobicContact CG-CE2 4.11Å; Y366-Y383 HydrophobicContact CD1-CD2 4.33Å; Y366-Y383 HydrophobicContact CE1-CD2 4.02Å; Y383-C385 WeakPolarHBondContact CE2-O 3.36Å; Y383-E386 PolarHBondContact OH-N 3.2Å
384	L	88.5	Confident	82	Confident	31 Å²	31	62 Å²	62	16%	0.162	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-59.4	-180	-60.4	-179.4	0	0	0	111.8	V357 I365 V415 A417 L418	V357-L384 HydrophobicContact CG2-CD1 4.25Å; I365-L384 HydrophobicContact CG2-CD1 4.27Å; I365-L384 WeakPolarHBondContact O-CB 3.43Å; I365-L384 PolarHBondContact O-N 2.83Å; L384-V415 HydrophobicContact CB-CG1 4.25Å; L384-V415 HydrophobicContact CD1-CG1 4.34Å; L384-A417 HydrophobicContact CD2-CB 4.01Å; L384-L418 HydrophobicContact CD1-CD2 3.55Å; L384-L418 HydrophobicContact CD1-CG 4.16Å
385	C	88.6	Confident	83.6	Confident	12 Å²	12	55.4 Å²	55.4	8%	0.081	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	176.4	-171.4	62.5	0	0	0	0	111.7	I365 Y383 L426	I365-C385 PolarHBondContact N-O 3.48Å; I365-C385 PolarHBondContact O-N 2.98Å; Y383-C385 WeakPolarHBondContact CE2-O 3.36Å; C385-L426 HydrophobicContact CB-CD1 4.25Å
386	E	88.5	Confident	85.4	Confident	75 Å²	75	54.3 Å²	54.3	35%	0.35	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.5	173.6	-176.4	170.4	175.3	0	0	109.8	G363 Y383 K463	G363-E386 CarbonylContact O-C 3.51Å; G363-E386 WeakPolarHBondContact O-CA 3.36Å; Y383-E386 PolarHBondContact OH-N 3.2Å; E386-K463 VanDerWaalsContact CD-NZ 3.33Å; E386-K463 WeakPolarHBondContact OE1-CD 3.43Å; E386-K463 IonicContact OE1-NZ 3.5Å; E386-K463 PolarHBondContact OE1-NZ 2.79Å
387	V	90.9	Very high	87	Confident	9 Å²	9	52.3 Å²	52.3	6%	0.055	26%	0.256	C	S	.	.			trans	-133.2	-178.5	-179.3	-61.6	0	0	0	0	109.2	G363 I365 V403 M411 V413 L426 K463	G363-V387 WeakPolarHBondContact CA-O 3.42Å; G363-V387 WeakPolarHBondContact O-CG2 3.5Å; G363-V387 PolarHBondContact O-N 2.83Å; G363-V387 VanDerWaalsContact O-O 3.08Å; I365-V387 HydrophobicContact CD1-CG2 3.61Å; I365-V387 HydrophobicContact CG1-CG1 4.28Å; I365-V387 HydrophobicContact CG1-CG2 3.49Å; I365-V387 VanDerWaalsContact CG1-CG2 3.49Å; V387-V403 HydrophobicContact CG2-CG1 4.07Å; V387-V403 HydrophobicContact CG2-CG2 4.31Å; V387-M411 HydrophobicContact CB-SD 3.76Å; V387-M411 HydrophobicContact CG1-SD 4.16Å; V387-V413 HydrophobicContact CG1-CG1 4.45Å; V387-V413 HydrophobicContact CG1-CG2 4.43Å; V387-L426 HydrophobicContact CG1-CD1 4.25Å; V387-L426 HydrophobicContact CG1-CD2 4.24Å; V387-K463 WeakPolarHBondContact O-CE 3.39Å; V387-K463 PolarHBondContact O-NZ 3.06Å
388	S	88.5	Confident	88.4	Confident	10 Å²	10	52.7 Å²	52.7	7%	0.07	26%	0.258	C	S	.	.	S	Bend	trans	-67.5	155.1	170.9	-67.4	0	0	0	0	111.9	P390 S408 M411 D464	S388-P390 WeakPolarHBondContact O-CD 3.31Å; S388-S408 WeakPolarHBondContact CB-OG 3.22Å; S388-M411 VanDerWaalsContact CB-CE 3.43Å; S388-M411 WeakPolarHBondContact OG-CE 3.37Å; S388-D464 VanDerWaalsContact CA-OD2 3.24Å; S388-D464 WeakPolarHBondContact CA-OD2 3.28Å; S388-D464 VanDerWaalsContact CB-OD2 3.25Å; S388-D464 WeakPolarHBondContact CB-OD2 3.46Å; S388-D464 PolarHBondContact OG-OD1 3.39Å; S388-D464 PolarHBondContact OG-OD2 3.12Å
389	R	90	Very high	89.3	Confident	71 Å²	71	51.7 Å²	51.7	27%	0.268	25%	0.247	S	C	.	.			trans	-52.3	111	-173.5	179.5	175.2	173.1	-176.6	-2.3	112.1	T361 S405 V407 D464	T361-R389 VanDerWaalsContact O-CD 3.28Å; T361-R389 WeakPolarHBondContact O-CD 3.46Å; T361-R389 WeakPolarHBondContact O-CG 3.41Å; R389-S405 WeakPolarHBondContact O-CB 3.31Å; R389-S405 PolarHBondContact O-OG 3.03Å; R389-S405 VanDerWaalsContact O-OG 3.04Å; R389-V407 HydrophobicContact CB-CG2 3.93Å; R389-V407 HydrophobicContact CG-CG2 4.24Å; R389-D464 PolarHBondContact N-OD2 2.89Å; R389-D464 VanDerWaalsContact N-OD2 3.13Å
390	P	91.7	Very high	89.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.256	C	S	.	.			trans	-78.6	136.1	-178	33.1	-36.9	0	0	0	111.1	C345 C346 D360 I365 S388 L393 V403	C345-P390 PolarHBondContact SG-O 2.86Å; C346-P390 VanDerWaalsContact SG-CB 3.6Å; D360-P390 WeakPolarHBondContact O-CD 3.48Å; I365-P390 HydrophobicContact CD1-CG 4.19Å; S388-P390 WeakPolarHBondContact O-CD 3.31Å; P390-L393 HydrophobicContact CB-CD2 3.78Å; P390-L393 HydrophobicContact CB-CG 4.08Å; P390-V403 HydrophobicContact CB-CG1 3.91Å
391	Q	89.1	Confident	90.1	Very high	54 Å²	54	46.5 Å²	46.5	25%	0.252	23%	0.23	S	C	.	.	S	Bend	trans	-97.8	-35.7	161.3	-173.3	66.7	18.1	0	0	110.3	D193 C346 G404 R406	D193-Q391 PolarHBondContact OD1-NE2 2.82Å; C346-Q391 VanDerWaalsContact CB-O 3.24Å; C346-Q391 WeakPolarHBondContact CB-O 3.22Å; Q391-G404 PolarHBondContact N-O 3Å; Q391-R406 HydrophobicContact CB-CB 4.36Å; Q391-R406 HydrophobicContact CG-CB 4.5Å
392	T	91.1	Very high	90.5	Very high	66 Å²	66	49.2 Å²	49.2	41%	0.405	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.6	176.8	-176.9	0	0	0	0	111.1	G404	T392-G404 PolarHBondContact N-O 3.2Å; T392-G404 VanDerWaalsContact N-O 3.08Å; T392-G404 PolarHBondContact O-N 3.2Å
393	L	92.8	Very high	90.9	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.026	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122.2	178.5	-67.7	176.7	0	0	0	109.4	G348 V357 I365 P390 L401 V403	G348-L393 WeakPolarHBondContact CA-O 3.28Å; V357-L393 HydrophobicContact CG1-CB 4Å; V357-L393 HydrophobicContact CG1-CD1 3.92Å; I365-L393 HydrophobicContact CD1-CD1 3.89Å; I365-L393 HydrophobicContact CD1-CD2 3.98Å; P390-L393 HydrophobicContact CB-CD2 3.78Å; P390-L393 HydrophobicContact CB-CG 4.08Å; L393-L401 HydrophobicContact CB-CD1 4.41Å; L393-L401 HydrophobicContact CD2-CD2 4.11Å; L393-L401 HydrophobicContact CD2-CG 4.42Å; L393-V403 HydrophobicContact CD2-CB 4.27Å; L393-V403 HydrophobicContact CD2-CG1 4.11Å; L393-V403 HydrophobicContact CD2-CG2 3.87Å
394	T	93.9	Very high	91.2	Very high	64 Å²	64	39 Å²	39	39%	0.393	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	117.1	178.4	-57.3	0	0	0	0	110.2	L396 F402	T394-L396 HydrophobicContact CG2-CD2 3.98Å; T394-F402 PolarHBondContact N-O 3.25Å; T394-F402 PolarHBondContact O-N 2.98Å
395	Y	92.4	Very high	91.3	Very high	55 Å²	55	38.1 Å²	38.1	22%	0.216	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	130	175.7	-176.9	-112.4	0	0	0	110.1	I350 D398 G399 I400 L418	I350-Y395 HydrophobicContact CB-CD1 4.33Å; I350-Y395 HydrophobicContact CG1-CD1 4.47Å; I350-Y395 HydrophobicContact CG1-CD2 4.49Å; I350-Y395 HydrophobicContact CG1-CG 4.22Å; I350-Y395 HydrophobicContact CG2-CD1 4Å; I350-Y395 HydrophobicContact CG2-CE1 3.83Å; Y395-D398 PolarHBondContact OH-N 3.08Å; Y395-G399 PolarHBondContact OH-N 3.35Å; Y395-G399 VanDerWaalsContact OH-N 3.09Å; Y395-I400 WeakPolarHBondContact CD2-O 3.47Å; Y395-L418 HydrophobicContact CD2-CD1 4.2Å; Y395-L418 HydrophobicContact CE2-CD1 4.05Å
396	L	92.7	Very high	91.3	Very high	109 Å²	109	43.6 Å²	43.6	57%	0.571	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.8	-9.5	-175.6	-58.5	-178.2	0	0	0	113.7	T394 I400 F402 L412	T394-L396 HydrophobicContact CG2-CD2 3.98Å; L396-I400 HydrophobicContact CB-CB 4.41Å; L396-I400 HydrophobicContact CB-CG2 4.33Å; L396-I400 HydrophobicContact CD1-CG2 4.18Å; L396-I400 PolarHBondContact N-O 3.39Å; L396-F402 HydrophobicContact CD1-CB 4.35Å; L396-L412 HydrophobicContact CD1-CD1 3.66Å
397	G	89.2	Confident	91.3	Very high	22 Å²	22	41.3 Å²	41.3	23%	0.227	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	110.2	162.8	-172.7	0	0	0	0	0	112.8	G399 I400	G397-G399 PolarHBondContact O-N 3.19Å; G397-I400 WeakPolarHBondContact O-CA 3.17Å; G397-I400 VanDerWaalsContact O-CB 3.24Å; G397-I400 WeakPolarHBondContact O-CB 3.39Å; G397-I400 WeakPolarHBondContact O-CG1 3.29Å; G397-I400 PolarHBondContact O-N 3.47Å
398	D	86.9	Confident	91.1	Very high	125 Å²	125	41 Å²	41	67%	0.668	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.8	32.8	176.3	-60.5	-24.6	0	0	0	116.2	Y395 I400	Y395-D398 PolarHBondContact OH-N 3.08Å; D398-I400 PolarHBondContact O-N 2.96Å
399	G	87.8	Confident	91.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	6.9	-177.7	0	0	0	0	0	113.7	Y395 G397 R414 V415 C419	Y395-G399 PolarHBondContact OH-N 3.35Å; Y395-G399 VanDerWaalsContact OH-N 3.09Å; G397-G399 PolarHBondContact O-N 3.19Å; G399-R414 CarbonylContact O-C 3.55Å; G399-R414 WeakPolarHBondContact O-CA 3.39Å; G399-V415 PolarHBondContact O-N 3.07Å; G399-C419 WeakPolarHBondContact CA-SG 3.18Å; G399-C419 PolarHBondContact N-SG 2.9Å
400	I	93.4	Very high	91.4	Very high	45 Å²	45	38.6 Å²	38.6	23%	0.231	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	127.3	178.7	-55.2	176.3	0	0	0	109.6	Y395 L396 G397 D398 L412 V413 R414 L429	Y395-I400 WeakPolarHBondContact CD2-O 3.47Å; L396-I400 HydrophobicContact CB-CB 4.41Å; L396-I400 HydrophobicContact CB-CG2 4.33Å; L396-I400 HydrophobicContact CD1-CG2 4.18Å; L396-I400 PolarHBondContact N-O 3.39Å; G397-I400 WeakPolarHBondContact O-CA 3.17Å; G397-I400 VanDerWaalsContact O-CB 3.24Å; G397-I400 WeakPolarHBondContact O-CB 3.39Å; G397-I400 WeakPolarHBondContact O-CG1 3.29Å; G397-I400 PolarHBondContact O-N 3.47Å; D398-I400 PolarHBondContact O-N 2.96Å; I400-L412 HydrophobicContact CG2-CD1 3.61Å; I400-L412 HydrophobicContact CG2-CD2 4.37Å; I400-L412 HydrophobicContact CG2-CG 3.89Å; I400-V413 CarbonylContact C-O 3.55Å; I400-V413 WeakPolarHBondContact CA-O 3.46Å; I400-R414 HydrophobicContact CG1-CG 4.45Å; I400-L429 HydrophobicContact CD1-CD1 4.09Å; I400-L429 HydrophobicContact CG1-CD1 4.04Å; I400-L429 HydrophobicContact CG2-CD1 4.13Å
401	L	93.5	Very high	91.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	124.7	-179.9	-174.8	69.3	0	0	0	108.8	V357 I365 L393 V403 V413	V357-L401 HydrophobicContact CG1-CD1 3.97Å; V357-L401 HydrophobicContact CG2-CD2 4.41Å; I365-L401 HydrophobicContact CG2-CD2 4.31Å; L393-L401 HydrophobicContact CB-CD1 4.41Å; L393-L401 HydrophobicContact CD2-CD2 4.11Å; L393-L401 HydrophobicContact CD2-CG 4.42Å; L401-V403 HydrophobicContact CD2-CG2 4.23Å; L401-V403 HydrophobicContact CG-CG2 4.26Å; L401-V413 HydrophobicContact CB-CG2 3.99Å; L401-V413 PolarHBondContact N-O 3.12Å; L401-V413 WeakPolarHBondContact O-CG2 3.44Å; L401-V413 PolarHBondContact O-N 2.77Å
402	F	95.7	Very high	91.8	Very high	60 Å²	60	38.6 Å²	38.6	26%	0.263	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	126.4	166.1	177.3	-103.1	0	0	0	109.4	T394 L396 L412 Y432	T394-F402 PolarHBondContact N-O 3.25Å; T394-F402 PolarHBondContact O-N 2.98Å; L396-F402 HydrophobicContact CD1-CB 4.35Å; F402-L412 HydrophobicContact CB-CD1 4.16Å; F402-L412 HydrophobicContact CD2-CD1 4.44Å; F402-Y432 HydrophobicContact CD2-CE2 4.48Å; F402-Y432 HydrophobicContact CE2-CD2 4.2Å; F402-Y432 HydrophobicContact CE2-CE2 4.04Å
403	V	94.8	Very high	91.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	101.4	179.5	-178	0	0	0	0	107.6	V387 P390 L393 L401 S410 M411 V413	V387-V403 HydrophobicContact CG2-CG1 4.07Å; V387-V403 HydrophobicContact CG2-CG2 4.31Å; P390-V403 HydrophobicContact CB-CG1 3.91Å; L393-V403 HydrophobicContact CD2-CB 4.27Å; L393-V403 HydrophobicContact CD2-CG1 4.11Å; L393-V403 HydrophobicContact CD2-CG2 3.87Å; L401-V403 HydrophobicContact CD2-CG2 4.23Å; L401-V403 HydrophobicContact CG-CG2 4.26Å; V403-S410 WeakPolarHBondContact O-CA 3.3Å; V403-S410 WeakPolarHBondContact O-CB 3.48Å; V403-M411 HydrophobicContact CB-CG 3.64Å; V403-M411 HydrophobicContact CG1-CG 4.21Å; V403-M411 HydrophobicContact CG2-CG 4.12Å; V403-M411 PolarHBondContact N-O 3.21Å; V403-M411 PolarHBondContact O-N 3.35Å; V403-V413 HydrophobicContact CG2-CG2 3.96Å
404	G	94.2	Very high	91.9	Very high	7 Å²	7	41 Å²	41	7%	0.072	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	119.9	174.9	0	0	0	0	0	110.1	Q391 T392	Q391-G404 PolarHBondContact N-O 3Å; T392-G404 PolarHBondContact N-O 3.2Å; T392-G404 VanDerWaalsContact N-O 3.08Å; T392-G404 PolarHBondContact O-N 3.2Å
405	S	91.9	Very high	91.7	Very high	12 Å²	12	38 Å²	38	8%	0.084	19%	0.188	C	C	.	.			trans	-112	138.3	177.6	177.5	0	0	0	0	110.8	R389 V407 S408 S410	R389-S405 WeakPolarHBondContact O-CB 3.31Å; R389-S405 PolarHBondContact O-OG 3.03Å; R389-S405 VanDerWaalsContact O-OG 3.04Å; S405-V407 PolarHBondContact OG-N 3.09Å; S405-S408 WeakPolarHBondContact CB-O 3.36Å; S405-S408 WeakPolarHBondContact CB-OG 3.5Å; S405-S408 PolarHBondContact OG-N 2.74Å; S405-S408 PolarHBondContact OG-O 3.08Å; S405-S408 PolarHBondContact OG-OG 3.34Å; S405-S410 PolarHBondContact N-OG 3.26Å; S405-S410 VanDerWaalsContact N-OG 3.07Å
406	R	87.6	Confident	91.4	Very high	127 Å²	127	36.2 Å²	36.2	48%	0.479	18%	0.182	S	C	.	.	S	Bend	trans	-89	-20.7	171.8	-172.2	176.3	179.5	-171.8	0.1	112.7	Q391 A436 E1127	Q391-R406 HydrophobicContact CB-CB 4.36Å; Q391-R406 HydrophobicContact CG-CB 4.5Å; R406-A436 VanDerWaalsContact O-CB 3.27Å; R406-A436 WeakPolarHBondContact O-CB 3.39Å; R406-E1127 IonicContact NH2-OE1 3.38Å; R406-E1127 PolarHBondContact NH2-OE1 3.01Å
407	V	88.8	Confident	91	Very high	27 Å²	27	32.7 Å²	32.7	16%	0.164	17%	0.169	C	C	.	.	S	Bend	trans	-117.2	6.3	-172	-60	0	0	0	0	113.4	R389 S405 A436 G460 H461	R389-V407 HydrophobicContact CB-CG2 3.93Å; R389-V407 HydrophobicContact CG-CG2 4.24Å; S405-V407 PolarHBondContact OG-N 3.09Å; V407-A436 CarbonylContact C-O 3.52Å; V407-G460 WeakPolarHBondContact O-CA 3.42Å; V407-H461 HydrophobicContact CB-CB 4.35Å; V407-H461 HydrophobicContact CG2-CB 4.49Å
408	S	87.2	Confident	90.7	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.014	17%	0.167	C	C	.	.	S	Bend	trans	-162.4	-179.2	-178.8	51.8	0	0	0	0	110	S388 S405 S410 S434 D464	S388-S408 WeakPolarHBondContact CB-OG 3.22Å; S405-S408 WeakPolarHBondContact CB-O 3.36Å; S405-S408 WeakPolarHBondContact CB-OG 3.5Å; S405-S408 PolarHBondContact OG-N 2.74Å; S405-S408 PolarHBondContact OG-O 3.08Å; S405-S408 PolarHBondContact OG-OG 3.34Å; S408-S410 PolarHBondContact O-N 3.16Å; S408-S434 WeakPolarHBondContact O-CB 3.48Å; S408-D464 PolarHBondContact OG-OD2 3.47Å
409	D	91.9	Very high	90.4	Very high	7 Å²	7	30.8 Å²	30.8	4%	0.037	16%	0.159	C	C	.	.			trans	-60.9	132.5	177.3	-60.6	-29.7	0	0	0	110	S431 Y432 P433 S434 R468 K796	D409-S431 WeakPolarHBondContact CB-OG 3.37Å; D409-Y432 VanDerWaalsContact CA-O 3.31Å; D409-Y432 WeakPolarHBondContact CA-O 3.47Å; D409-Y432 WeakPolarHBondContact CB-O 3.11Å; D409-P433 VanDerWaalsContact OD1-CA 3.25Å; D409-P433 WeakPolarHBondContact OD1-CA 3.13Å; D409-S434 PolarHBondContact OD1-N 3.24Å; D409-R468 VanDerWaalsContact CG-NH2 3.26Å; D409-R468 IonicContact OD1-CZ 2.72Å; D409-R468 VanDerWaalsContact OD1-CZ 3.31Å; D409-R468 IonicContact OD1-NH1 3.01Å; D409-R468 PolarHBondContact OD1-NH1 2.67Å; D409-R468 VanDerWaalsContact OD1-NH1 3.14Å; D409-R468 IonicContact OD1-NH2 3.26Å; D409-R468 PolarHBondContact OD1-NH2 2.96Å; D409-R468 IonicContact OD2-CZ 3.8Å; D409-R468 IonicContact OD2-NH1 2.61Å; D409-R468 IonicContact OD2-NH2 2.98Å; D409-R468 PolarHBondContact OD2-NH2 3.49Å; D409-K796 WeakPolarHBondContact OD2-CD 3.49Å; D409-K796 IonicContact OD2-NZ 3.56Å; D409-K796 PolarHBondContact OD2-NZ 3.01Å
410	S	93.2	Very high	89.9	Confident	23 Å²	23	33.9 Å²	33.9	16%	0.161	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	150.9	169.1	-66.5	0	0	0	0	108.9	V403 S405 S408 S431 Y432	V403-S410 WeakPolarHBondContact O-CA 3.3Å; V403-S410 WeakPolarHBondContact O-CB 3.48Å; S405-S410 PolarHBondContact N-OG 3.26Å; S405-S410 VanDerWaalsContact N-OG 3.07Å; S408-S410 PolarHBondContact O-N 3.16Å; S410-S431 CarbonylContact O-C 3.57Å; S410-Y432 PolarHBondContact N-O 3.28Å; S410-Y432 VanDerWaalsContact N-O 3.12Å; S410-Y432 PolarHBondContact O-N 2.91Å
411	M	93.4	Very high	89.1	Confident	19 Å²	19	34.4 Å²	34.4	9%	0.094	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.5	-173.9	59.9	-178.7	62.4	0	0	112.8	V387 S388 V403 V413 G430	V387-M411 HydrophobicContact CB-SD 3.76Å; V387-M411 HydrophobicContact CG1-SD 4.16Å; S388-M411 VanDerWaalsContact CB-CE 3.43Å; S388-M411 WeakPolarHBondContact OG-CE 3.37Å; V403-M411 HydrophobicContact CB-CG 3.64Å; V403-M411 HydrophobicContact CG1-CG 4.21Å; V403-M411 HydrophobicContact CG2-CG 4.12Å; V403-M411 PolarHBondContact N-O 3.21Å; V403-M411 PolarHBondContact O-N 3.35Å; M411-V413 HydrophobicContact CB-CG1 4.21Å; M411-V413 HydrophobicContact CG-CG1 3.78Å; M411-V413 HydrophobicContact SD-CG1 3.6Å; M411-G430 WeakPolarHBondContact CA-O 3.39Å
412	L	95.1	Very high	88.1	Confident	35 Å²	35	39 Å²	39	18%	0.183	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	116.6	167.7	-168.2	69.6	0	0	0	107.5	L396 I400 F402 L429 G430 Y432	L396-L412 HydrophobicContact CD1-CD1 3.66Å; I400-L412 HydrophobicContact CG2-CD1 3.61Å; I400-L412 HydrophobicContact CG2-CD2 4.37Å; I400-L412 HydrophobicContact CG2-CG 3.89Å; F402-L412 HydrophobicContact CB-CD1 4.16Å; F402-L412 HydrophobicContact CD2-CD1 4.44Å; L412-L429 HydrophobicContact CB-CB 4.39Å; L412-L429 HydrophobicContact CD2-CB 4.21Å; L412-L429 HydrophobicContact CD2-CD1 4.36Å; L412-L429 HydrophobicContact CG-CB 4.28Å; L412-L429 HydrophobicContact CG-CD1 4.37Å; L412-L429 WeakPolarHBondContact O-CA 3.11Å; L412-L429 WeakPolarHBondContact O-CB 3.25Å; L412-L429 PolarHBondContact O-N 3Å; L412-G430 PolarHBondContact N-O 3.36Å; L412-G430 PolarHBondContact O-N 3.29Å; L412-Y432 HydrophobicContact CB-CE2 4.41Å
413	V	93.8	Very high	87.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	145.8	-175.9	-61.3	0	0	0	0	110.9	V387 I400 L401 V403 M411 V415 L426 V428	V387-V413 HydrophobicContact CG1-CG1 4.45Å; V387-V413 HydrophobicContact CG1-CG2 4.43Å; I400-V413 CarbonylContact C-O 3.55Å; I400-V413 WeakPolarHBondContact CA-O 3.46Å; L401-V413 HydrophobicContact CB-CG2 3.99Å; L401-V413 PolarHBondContact N-O 3.12Å; L401-V413 WeakPolarHBondContact O-CG2 3.44Å; L401-V413 PolarHBondContact O-N 2.77Å; V403-V413 HydrophobicContact CG2-CG2 3.96Å; M411-V413 HydrophobicContact CB-CG1 4.21Å; M411-V413 HydrophobicContact CG-CG1 3.78Å; M411-V413 HydrophobicContact SD-CG1 3.6Å; V413-V415 HydrophobicContact CG2-CG2 4.04Å; V413-L426 HydrophobicContact CB-CD1 3.88Å; V413-L426 HydrophobicContact CG1-CD1 4.34Å; V413-L426 HydrophobicContact CG2-CD1 4.18Å; V413-V428 HydrophobicContact CG1-CG2 4.24Å
414	R	92.9	Very high	86.2	Confident	121 Å²	121	44.8 Å²	44.8	46%	0.457	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.2	165.1	-161.8	179.8	-173.5	-176.3	0	108.4	G399 I400 P416 S427 L429	G399-R414 CarbonylContact O-C 3.55Å; G399-R414 WeakPolarHBondContact O-CA 3.39Å; I400-R414 HydrophobicContact CG1-CG 4.45Å; R414-P416 WeakPolarHBondContact O-CD 3.49Å; R414-S427 WeakPolarHBondContact CB-OG 3.35Å; R414-S427 PolarHBondContact N-O 2.98Å; R414-S427 PolarHBondContact O-N 2.63Å; R414-S427 VanDerWaalsContact O-N 3.14Å; R414-L429 HydrophobicContact CB-CD1 4.16Å; R414-L429 HydrophobicContact CB-CD2 4.38Å; R414-L429 HydrophobicContact CB-CG 4.25Å
415	V	90.5	Very high	85.4	Confident	3 Å²	3	53 Å²	53	2%	0.018	30%	0.301	C	S	.	.			trans	-112	94.8	177.2	-174.5	0	0	0	0	107.6	L384 G399 V413 A417 L418 L426	L384-V415 HydrophobicContact CB-CG1 4.25Å; L384-V415 HydrophobicContact CD1-CG1 4.34Å; G399-V415 PolarHBondContact O-N 3.07Å; V413-V415 HydrophobicContact CG2-CG2 4.04Å; V415-A417 HydrophobicContact CG1-CB 4.31Å; V415-A417 PolarHBondContact O-N 2.75Å; V415-A417 VanDerWaalsContact O-N 3.11Å; V415-L418 HydrophobicContact CB-CD1 3.83Å; V415-L418 HydrophobicContact CB-CG 3.97Å; V415-L418 HydrophobicContact CG1-CD1 4.31Å; V415-L418 HydrophobicContact CG1-CG 3.99Å; V415-L418 HydrophobicContact CG2-CD1 4.4Å; V415-L418 WeakPolarHBondContact O-CB 3.29Å; V415-L418 PolarHBondContact O-N 2.9Å; V415-L426 HydrophobicContact CG2-CD1 3.85Å
416	P	85.9	Confident	85.2	Confident	16 Å²	16	55.2 Å²	55.2	10%	0.104	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-57.4	-30.3	-175.3	-26.5	36.2	0	0	0	113.7	R414 L418 C419 G420 D421	R414-P416 WeakPolarHBondContact O-CD 3.49Å; P416-L418 PolarHBondContact O-N 2.96Å; P416-L418 VanDerWaalsContact O-N 3.16Å; P416-C419 CarbonylContact O-C 3.53Å; P416-C419 WeakPolarHBondContact O-CA 3.32Å; P416-C419 WeakPolarHBondContact O-CB 3.33Å; P416-C419 PolarHBondContact O-N 3.11Å; P416-G420 PolarHBondContact O-N 3.01Å; P416-D421 CarbonylContact C-O 3.6Å; P416-D421 HydrophobicContact CB-CB 4.05Å; P416-D421 WeakPolarHBondContact CB-O 3.46Å; P416-D421 PolarHBondContact O-N 3.12Å; P416-D421 VanDerWaalsContact O-N 3.15Å
417	A	83.3	Confident	85.3	Confident	36 Å²	36	51.4 Å²	51.4	30%	0.298	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-60.3	-25.3	177.6	0	0	0	0	0	113.3	L384 V415 C419 G420 D421	L384-A417 HydrophobicContact CD2-CB 4.01Å; V415-A417 HydrophobicContact CG1-CB 4.31Å; V415-A417 PolarHBondContact O-N 2.75Å; V415-A417 VanDerWaalsContact O-N 3.11Å; A417-C419 VanDerWaalsContact C-N 3.27Å; A417-G420 PolarHBondContact O-N 3.43Å; A417-D421 VanDerWaalsContact CA-O 3.27Å; A417-D421 WeakPolarHBondContact CA-O 3.28Å; A417-D421 PolarHBondContact N-O 2.81Å
418	L	83.2	Confident	85.3	Confident	33 Å²	33	54.3 Å²	54.3	17%	0.173	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-70.5	-24.8	173.2	-65.6	176.9	0	0	0	112.4	I350 L384 Y395 V415 P416 G420	I350-L418 HydrophobicContact CD1-CD2 3.66Å; L384-L418 HydrophobicContact CD1-CD2 3.55Å; L384-L418 HydrophobicContact CD1-CG 4.16Å; Y395-L418 HydrophobicContact CD2-CD1 4.2Å; Y395-L418 HydrophobicContact CE2-CD1 4.05Å; V415-L418 HydrophobicContact CB-CD1 3.83Å; V415-L418 HydrophobicContact CB-CG 3.97Å; V415-L418 HydrophobicContact CG1-CD1 4.31Å; V415-L418 HydrophobicContact CG1-CG 3.99Å; V415-L418 HydrophobicContact CG2-CD1 4.4Å; V415-L418 WeakPolarHBondContact O-CB 3.29Å; V415-L418 PolarHBondContact O-N 2.9Å; P416-L418 PolarHBondContact O-N 2.96Å; P416-L418 VanDerWaalsContact O-N 3.16Å; L418-G420 VanDerWaalsContact C-N 3.35Å
419	C	80.2	Confident	85.5	Confident	74 Å²	74	58.5 Å²	58.5	50%	0.5	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-91.9	5.2	174.5	-60.2	0	0	0	0	113	G399 P416 A417 D421	G399-C419 WeakPolarHBondContact CA-SG 3.18Å; G399-C419 PolarHBondContact N-SG 2.9Å; P416-C419 CarbonylContact O-C 3.53Å; P416-C419 WeakPolarHBondContact O-CA 3.32Å; P416-C419 WeakPolarHBondContact O-CB 3.33Å; P416-C419 PolarHBondContact O-N 3.11Å; A417-C419 VanDerWaalsContact C-N 3.27Å; C419-D421 VanDerWaalsContact C-N 3.34Å
420	G	77.1	Confident	85.2	Confident	64 Å²	64	59.3 Å²	59.3	66%	0.66	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	1.7	-176.1	0	0	0	0	0	115.1	P416 A417 L418	P416-G420 PolarHBondContact O-N 3.01Å; A417-G420 PolarHBondContact O-N 3.43Å; L418-G420 VanDerWaalsContact C-N 3.35Å
421	D	77	Confident	85	Confident	56 Å²	56	61.5 Å²	61.5	30%	0.299	37%	0.369	S	S	.	.			trans	-89.9	105.6	172.6	-179.5	6.6	0	0	0	110.2	P416 A417 C419 T423 S424	P416-D421 CarbonylContact C-O 3.6Å; P416-D421 HydrophobicContact CB-CB 4.05Å; P416-D421 WeakPolarHBondContact CB-O 3.46Å; P416-D421 PolarHBondContact O-N 3.12Å; P416-D421 VanDerWaalsContact O-N 3.15Å; A417-D421 VanDerWaalsContact CA-O 3.27Å; A417-D421 WeakPolarHBondContact CA-O 3.28Å; A417-D421 PolarHBondContact N-O 2.81Å; C419-D421 VanDerWaalsContact C-N 3.34Å; D421-T423 WeakPolarHBondContact OD1-CB 3.38Å; D421-T423 PolarHBondContact OD1-N 3.45Å; D421-T423 PolarHBondContact OD1-OG1 2.72Å; D421-S424 PolarHBondContact OD1-N 3.41Å; D421-S424 WeakPolarHBondContact OD2-CB 3.5Å; D421-S424 PolarHBondContact OD2-OG 3.16Å
422	T	73.2	Confident	84.8	Confident	97 Å²	97	64.9 Å²	64.9	60%	0.595	38%	0.381	S	S	*	.			trans	-91.3	-1.6	177.6	54.1	0	0	0	0	113.6
423	T	74.7	Confident	84.4	Confident	121 Å²	121	66.9 Å²	66.9	74%	0.742	40%	0.397	S	S	*	.	S	Bend	trans	-90	-35.8	-177.1	66.3	0	0	0	0	112	D421	D421-T423 WeakPolarHBondContact OD1-CB 3.38Å; D421-T423 PolarHBondContact OD1-N 3.45Å; D421-T423 PolarHBondContact OD1-OG1 2.72Å
424	S	74.3	Confident	84.2	Confident	61 Å²	61	67.8 Å²	67.8	43%	0.427	40%	0.403	S	S	.	.	S	Bend	trans	-80.1	134.9	-178.1	-62.2	0	0	0	0	112	D421	D421-S424 PolarHBondContact OD1-N 3.41Å; D421-S424 WeakPolarHBondContact OD2-CB 3.5Å; D421-S424 PolarHBondContact OD2-OG 3.16Å
425	Q	79.2	Confident	84.1	Confident	178 Å²	178	62.2 Å²	62.2	83%	0.832	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-75.8	161.9	176.2	-66.5	-171.5	-7.4	0	0	111.8	S427	Q425-S427 PolarHBondContact O-N 3.48Å
426	L	86.6	Confident	84.1	Confident	60 Å²	60	62.2 Å²	62.2	31%	0.314	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-50.4	131.9	170.3	177.2	84.3	0	0	0	110.5	C385 V387 V413 V415	C385-L426 HydrophobicContact CB-CD1 4.25Å; V387-L426 HydrophobicContact CG1-CD1 4.25Å; V387-L426 HydrophobicContact CG1-CD2 4.24Å; V413-L426 HydrophobicContact CB-CD1 3.88Å; V413-L426 HydrophobicContact CG1-CD1 4.34Å; V413-L426 HydrophobicContact CG2-CD1 4.18Å; V415-L426 HydrophobicContact CG2-CD1 3.85Å
427	S	89.1	Confident	84.6	Confident	46 Å²	46	62.7 Å²	62.7	32%	0.322	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.8	169.6	67.9	0	0	0	0	110.7	R414 Q425 L429	R414-S427 WeakPolarHBondContact CB-OG 3.35Å; R414-S427 PolarHBondContact N-O 2.98Å; R414-S427 PolarHBondContact O-N 2.63Å; R414-S427 VanDerWaalsContact O-N 3.14Å; Q425-S427 PolarHBondContact O-N 3.48Å; S427-L429 PolarHBondContact O-N 3.04Å
428	V	89.1	Confident	85.1	Confident	88 Å²	88	61 Å²	61	53%	0.533	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	116.3	172.5	-176	0	0	0	0	108.3	V413	V413-V428 HydrophobicContact CG1-CG2 4.24Å
429	L	91	Very high	85.7	Confident	91 Å²	91	61.4 Å²	61.4	48%	0.476	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-32.6	179.9	-59.7	178.7	0	0	0	112	I400 L412 R414 S427	I400-L429 HydrophobicContact CD1-CD1 4.09Å; I400-L429 HydrophobicContact CG1-CD1 4.04Å; I400-L429 HydrophobicContact CG2-CD1 4.13Å; L412-L429 HydrophobicContact CB-CB 4.39Å; L412-L429 HydrophobicContact CD2-CB 4.21Å; L412-L429 HydrophobicContact CD2-CD1 4.36Å; L412-L429 HydrophobicContact CG-CB 4.28Å; L412-L429 HydrophobicContact CG-CD1 4.37Å; L412-L429 WeakPolarHBondContact O-CA 3.11Å; L412-L429 WeakPolarHBondContact O-CB 3.25Å; L412-L429 PolarHBondContact O-N 3Å; R414-L429 HydrophobicContact CB-CD1 4.16Å; R414-L429 HydrophobicContact CB-CD2 4.38Å; R414-L429 HydrophobicContact CB-CG 4.25Å; S427-L429 PolarHBondContact O-N 3.04Å
430	G	87.1	Confident	86.4	Confident	23 Å²	23	59 Å²	59	24%	0.237	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	153.1	179.8	0	0	0	0	0	111.9	M411 L412	M411-G430 WeakPolarHBondContact CA-O 3.39Å; L412-G430 PolarHBondContact N-O 3.36Å; L412-G430 PolarHBondContact O-N 3.29Å
431	S	87.5	Confident	87.2	Confident	69 Å²	69	56.3 Å²	56.3	48%	0.483	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136	175.9	-175.5	0	0	0	0	108.9	D409 S410	D409-S431 WeakPolarHBondContact CB-OG 3.37Å; S410-S431 CarbonylContact O-C 3.57Å
432	Y	89.9	Confident	87.9	Confident	90 Å²	90	54.7 Å²	54.7	35%	0.353	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	107.7	-179.1	-58.8	-82.5	0	0	0	108	A166 F402 D409 S410 L412 S434	A166-Y432 HydrophobicContact CB-CD1 4.31Å; F402-Y432 HydrophobicContact CD2-CE2 4.48Å; F402-Y432 HydrophobicContact CE2-CD2 4.2Å; F402-Y432 HydrophobicContact CE2-CE2 4.04Å; D409-Y432 VanDerWaalsContact CA-O 3.31Å; D409-Y432 WeakPolarHBondContact CA-O 3.47Å; D409-Y432 WeakPolarHBondContact CB-O 3.11Å; S410-Y432 PolarHBondContact N-O 3.28Å; S410-Y432 VanDerWaalsContact N-O 3.12Å; S410-Y432 PolarHBondContact O-N 2.91Å; L412-Y432 HydrophobicContact CB-CE2 4.41Å; Y432-S434 PolarHBondContact O-N 3.04Å
433	P	86.7	Confident	88.7	Confident	78 Å²	78	53.2 Å²	53.2	51%	0.506	31%	0.305	S	S	.	.			trans	-57.7	134	-175.4	-26.1	34.7	0	0	0	112.6	D409	D409-P433 VanDerWaalsContact OD1-CA 3.25Å; D409-P433 WeakPolarHBondContact OD1-CA 3.13Å
434	S	89.7	Confident	89.3	Confident	18 Å²	18	48.1 Å²	48.1	13%	0.126	27%	0.273	C	S	.	.			trans	-128.9	136.7	170.6	-179.9	0	0	0	0	110.3	S408 D409 Y432 A436 R468	S408-S434 WeakPolarHBondContact O-CB 3.48Å; D409-S434 PolarHBondContact OD1-N 3.24Å; Y432-S434 PolarHBondContact O-N 3.04Å; S434-A436 VanDerWaalsContact C-N 3.31Å; S434-A436 WeakPolarHBondContact OG-CB 3.4Å; S434-A436 PolarHBondContact OG-N 2.73Å; S434-A436 VanDerWaalsContact OG-N 3.13Å; S434-R468 VanDerWaalsContact O-CZ 3.24Å; S434-R468 PolarHBondContact O-NH2 3.36Å; S434-R468 VanDerWaalsContact O-NH2 3.08Å
435	L	91.8	Very high	89.7	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.021	27%	0.268	C	S	.	.			trans	-84.8	-9.9	171.1	-60.8	-178.6	0	0	0	112.3	Y164 P437 I438 S459 R468 I470 C794 V1130	Y164-L435 HydrophobicContact CD2-CD1 4.02Å; Y164-L435 HydrophobicContact CG-CD1 3.85Å; Y164-L435 HydrophobicContact CG-CG 4.48Å; L435-P437 CarbonylContact O-C 3.59Å; L435-I438 HydrophobicContact CB-CD1 3.92Å; L435-I438 HydrophobicContact CB-CG1 3.94Å; L435-I438 HydrophobicContact CD1-CD1 4.22Å; L435-I438 VanDerWaalsContact O-CG1 3.31Å; L435-I438 WeakPolarHBondContact O-CG1 3.36Å; L435-I438 PolarHBondContact O-N 2.68Å; L435-S459 VanDerWaalsContact O-CB 3.28Å; L435-S459 WeakPolarHBondContact O-CB 3.39Å; L435-S459 PolarHBondContact O-OG 3.36Å; L435-R468 HydrophobicContact CD2-CB 3.63Å; L435-R468 HydrophobicContact CD2-CG 3.66Å; L435-I470 HydrophobicContact CD1-CD1 3.75Å; L435-I470 HydrophobicContact CD1-CG1 4.47Å; L435-I470 HydrophobicContact CD2-CD1 4.06Å; L435-I470 HydrophobicContact CD2-CG1 4.21Å; L435-C794 WeakPolarHBondContact CD2-SG 3.47Å; L435-V1130 HydrophobicContact CD1-CG2 4.33Å
436	A	90.5	Very high	89.5	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.033	24%	0.236	C	C	.	.			trans	-75.6	141.2	-170.9	0	0	0	0	0	113	R406 V407 S434 E1127	R406-A436 VanDerWaalsContact O-CB 3.27Å; R406-A436 WeakPolarHBondContact O-CB 3.39Å; V407-A436 CarbonylContact C-O 3.52Å; S434-A436 VanDerWaalsContact C-N 3.31Å; S434-A436 WeakPolarHBondContact OG-CB 3.4Å; S434-A436 PolarHBondContact OG-N 2.73Å; S434-A436 VanDerWaalsContact OG-N 3.13Å; A436-E1127 WeakPolarHBondContact CB-O 3.44Å
437	P	94.7	Very high	88.6	Confident	26 Å²	26	39.9 Å²	39.9	17%	0.169	24%	0.235	C	C	.	.	S	Bend	cis	-79.9	137.2	-17.3	31.9	-34.4	0	0	0	112.1	L435 V439 S459 A1126	L435-P437 CarbonylContact O-C 3.59Å; P437-V439 HydrophobicContact CB-CG2 4.47Å; P437-V439 HydrophobicContact CG-CG2 4.25Å; P437-V439 PolarHBondContact O-N 2.9Å; P437-S459 VanDerWaalsContact O-CA 3.32Å; P437-S459 WeakPolarHBondContact O-CA 3.16Å; P437-A1126 WeakPolarHBondContact CA-O 3.44Å; P437-A1126 HydrophobicContact CB-CB 4.41Å; P437-A1126 WeakPolarHBondContact CB-O 3.41Å
438	I	95.5	Very high	87.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	105	168.8	-58.2	169.3	0	0	0	107.6	L435 L441 A457 N1100 A1124 T1125 V1130	L435-I438 HydrophobicContact CB-CD1 3.92Å; L435-I438 HydrophobicContact CB-CG1 3.94Å; L435-I438 HydrophobicContact CD1-CD1 4.22Å; L435-I438 VanDerWaalsContact O-CG1 3.31Å; L435-I438 WeakPolarHBondContact O-CG1 3.36Å; L435-I438 PolarHBondContact O-N 2.68Å; I438-L441 HydrophobicContact CG2-CB 4.29Å; I438-A457 HydrophobicContact CG2-CB 4.11Å; I438-N1100 WeakPolarHBondContact O-CB 3.38Å; I438-N1100 PolarHBondContact O-ND2 3.23Å; I438-A1124 HydrophobicContact CB-CB 4.1Å; I438-A1124 HydrophobicContact CD1-CB 3.86Å; I438-A1124 HydrophobicContact CG2-CB 3.64Å; I438-T1125 WeakPolarHBondContact CB-O 3.42Å; I438-T1125 PolarHBondContact N-O 3.48Å; I438-V1130 HydrophobicContact CD1-CG2 3.82Å
439	V	94	Very high	86	Confident	41 Å²	41	45.5 Å²	45.5	25%	0.248	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-36.6	-177.6	-179.2	0	0	0	0	111.6	P437 C458 V1101	P437-V439 HydrophobicContact CB-CG2 4.47Å; P437-V439 HydrophobicContact CG-CG2 4.25Å; P437-V439 PolarHBondContact O-N 2.9Å; V439-C458 HydrophobicContact CB-CB 4.39Å; V439-C458 PolarHBondContact N-O 3.07Å; V439-V1101 WeakPolarHBondContact O-CG2 3.45Å
440	D	95	Very high	84.6	Confident	23 Å²	23	43.1 Å²	43.1	12%	0.123	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	152	178.6	-154.7	-4.4	0	0	0	109.4	A457 C458 R805 L806	D440-A457 WeakPolarHBondContact O-CA 3.46Å; D440-C458 HydrophobicContact CB-CB 4.06Å; D440-C458 PolarHBondContact O-N 2.96Å; D440-R805 VanDerWaalsContact OD2-CA 3.26Å; D440-R805 WeakPolarHBondContact OD2-CA 3.41Å; D440-L806 HydrophobicContact CB-CB 4.39Å; D440-L806 PolarHBondContact OD2-N 3.08Å
441	L	94.2	Very high	83.4	Confident	9 Å²	9	48.3 Å²	48.3	5%	0.047	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	132.6	-176.9	-173.1	79.6	0	0	0	110.2	I438 Y455 L456 A457 V1101 C1103 L1122 A1124	I438-L441 HydrophobicContact CG2-CB 4.29Å; L441-Y455 HydrophobicContact CD2-CD1 4.2Å; L441-Y455 HydrophobicContact CG-CD1 4.45Å; L441-L456 WeakPolarHBondContact CA-O 3.48Å; L441-A457 HydrophobicContact CD1-CB 3.54Å; L441-V1101 HydrophobicContact CB-CB 4.32Å; L441-V1101 HydrophobicContact CB-CG1 3.98Å; L441-C1103 HydrophobicContact CD2-CB 4.38Å; L441-L1122 HydrophobicContact CD2-CD2 3.28Å; L441-A1124 HydrophobicContact CD2-CB 4.1Å
442	I	92.8	Very high	82.5	Confident	22 Å²	22	45.8 Å²	45.8	11%	0.113	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	151.8	171.2	64.2	166.5	0	0	0	110.8	Y455 L456 L806 H808 F815	I442-Y455 VanDerWaalsContact O-CA 3.25Å; I442-Y455 WeakPolarHBondContact O-CA 3.41Å; I442-L456 HydrophobicContact CD1-CB 4.23Å; I442-L456 HydrophobicContact CD1-CD2 4.47Å; I442-L456 HydrophobicContact CG1-CB 3.88Å; I442-L456 PolarHBondContact N-O 2.93Å; I442-L456 PolarHBondContact O-N 2.85Å; I442-L806 HydrophobicContact CB-CD2 4.4Å; I442-L806 HydrophobicContact CD1-CD1 4.25Å; I442-L806 HydrophobicContact CD1-CD2 3.92Å; I442-L806 HydrophobicContact CD1-CG 3.78Å; I442-L806 HydrophobicContact CG1-CD2 3.57Å; I442-L806 HydrophobicContact CG1-CG 3.87Å; I442-L806 HydrophobicContact CG2-CB 4.28Å; I442-L806 HydrophobicContact CG2-CD2 4.15Å; I442-L806 HydrophobicContact CG2-CG 3.91Å; I442-H808 HydrophobicContact CD1-CB 3.61Å; I442-F815 HydrophobicContact CD1-CD1 3.74Å; I442-F815 HydrophobicContact CD1-CE1 3.78Å
443	Q	90.1	Very high	81.9	Confident	66 Å²	66	43.7 Å²	43.7	31%	0.308	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	139.4	166.5	-176.7	-171.4	-1	0	0	109.3	P453 A454 Y455 P1104	Q443-P453 HydrophobicContact CG-CB 4.13Å; Q443-A454 CarbonylContact C-O 3.53Å; Q443-A454 WeakPolarHBondContact CA-O 3.18Å; Q443-Y455 HydrophobicContact CB-CD1 3.94Å; Q443-Y455 HydrophobicContact CB-CE1 3.75Å; Q443-Y455 HydrophobicContact CG-CD1 4.28Å; Q443-Y455 HydrophobicContact CG-CE1 3.82Å; Q443-P1104 PolarHBondContact OE1-O 3.01Å
444	F	87.5	Confident	81.8	Confident	13 Å²	13	40 Å²	40	6%	0.057	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	164	172.3	71.5	-77.6	0	0	0	110.8	P446 A454 L456 L469 F815 Q879	F444-P446 HydrophobicContact CE2-CB 4.01Å; F444-A454 HydrophobicContact CD1-CB 4.25Å; F444-A454 HydrophobicContact CE1-CB 3.78Å; F444-A454 HydrophobicContact CE2-CB 4.18Å; F444-A454 HydrophobicContact CZ-CB 3.76Å; F444-A454 PolarHBondContact N-O 2.82Å; F444-A454 PolarHBondContact O-N 2.69Å; F444-A454 VanDerWaalsContact O-O 3.1Å; F444-L456 HydrophobicContact CD1-CB 4.4Å; F444-L456 HydrophobicContact CE1-CB 3.93Å; F444-L469 HydrophobicContact CE1-CD1 3.79Å; F444-L469 HydrophobicContact CZ-CD1 3.51Å; F444-F815 AromaticContact CD1-CE1 3.98Å; F444-F815 HydrophobicContact CD1-CE1 3.98Å; F444-F815 AromaticContact CD1-CZ 3.96Å; F444-F815 HydrophobicContact CD1-CZ 3.96Å; F444-F815 HydrophobicContact CD2-CE1 4.2Å; F444-F815 AromaticContact CD2-CZ 3.76Å; F444-F815 HydrophobicContact CD2-CZ 3.76Å; F444-F815 HydrophobicContact CE1-CE1 4.22Å; F444-F815 AromaticContact CE1-CZ 3.79Å; F444-F815 HydrophobicContact CE1-CZ 3.79Å; F444-F815 HydrophobicContact CE2-CE1 4.42Å; F444-F815 HydrophobicContact CE2-CE2 4.47Å; F444-F815 AromaticContact CE2-CZ 3.58Å; F444-F815 HydrophobicContact CE2-CZ 3.58Å; F444-F815 AromaticContact CG-CE1 3.97Å; F444-F815 HydrophobicContact CG-CE1 3.97Å; F444-F815 AromaticContact CG-CZ 3.94Å; F444-F815 HydrophobicContact CG-CZ 3.94Å; F444-F815 HydrophobicContact CZ-CE1 4.41Å; F444-F815 HydrophobicContact CZ-CE2 4.35Å; F444-F815 AromaticContact CZ-CZ 3.58Å; F444-F815 HydrophobicContact CZ-CZ 3.58Å; F444-Q879 HydrophobicContact CE2-CG 4.31Å
445	S	82.1	Confident	81.9	Confident	46 Å²	46	40.2 Å²	40.2	32%	0.322	22%	0.224	S	C	.	.			trans	-103.4	120.1	168.5	-160	0	0	0	0	109.6	D447 I450	S445-D447 VanDerWaalsContact C-N 3.29Å; S445-D447 PolarHBondContact O-N 2.81Å; S445-D447 PolarHBondContact OG-O 2.9Å; S445-I450 PolarHBondContact OG-O 2.92Å
446	P	74.2	Confident	82	Confident	25 Å²	25	40.1 Å²	40.1	16%	0.162	22%	0.224	C	C	.	.	S	Bend	trans	-66.8	-33.9	178.9	22.4	-27.6	0	0	0	112.1	F444 A454 R813 Q879	F444-P446 HydrophobicContact CE2-CB 4.01Å; P446-A454 HydrophobicContact CG-CB 4.22Å; P446-R813 PolarHBondContact O-NH2 2.79Å; P446-Q879 PolarHBondContact O-NE2 2.84Å; P446-Q879 VanDerWaalsContact O-NE2 3.16Å
447	D	69.4	Low	82.2	Confident	56 Å²	56	40 Å²	40	30%	0.299	22%	0.222	S	C	.	.	B	Isolated β-bridge	trans	-127.4	123.9	174.2	-169.2	-20.9	0	0	0	108.7	S445 L449 I450	S445-D447 VanDerWaalsContact C-N 3.29Å; S445-D447 PolarHBondContact O-N 2.81Å; S445-D447 PolarHBondContact OG-O 2.9Å; D447-L449 PolarHBondContact O-N 2.89Å; D447-L449 WeakPolarHBondContact OD1-CB 3.28Å; D447-L449 PolarHBondContact OD1-N 2.97Å; D447-I450 HydrophobicContact CB-CB 4.16Å; D447-I450 HydrophobicContact CB-CD1 4.3Å; D447-I450 HydrophobicContact CB-CG1 4.23Å; D447-I450 CarbonylContact O-C 3.49Å; D447-I450 PolarHBondContact O-N 3.34Å
448	P	63.8	Low	82.3	Confident	103 Å²	103	38.7 Å²	38.7	67%	0.669	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-20	175.4	25	-33.8	0	0	0	113.7
449	L	59.6	Low	82.3	Confident	149 Å²	149	38.8 Å²	38.8	78%	0.78	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-29.4	177.1	-69.8	154.6	0	0	0	112.6	D447	D447-L449 PolarHBondContact O-N 2.89Å; D447-L449 WeakPolarHBondContact OD1-CB 3.28Å; D447-L449 PolarHBondContact OD1-N 2.97Å
450	I	60.6	Low	82.2	Confident	40 Å²	40	36.9 Å²	36.9	21%	0.205	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-104.7	95.3	-178.7	-54.8	174.6	0	0	0	105.8	S445 D447 A452	S445-I450 PolarHBondContact OG-O 2.92Å; D447-I450 HydrophobicContact CB-CB 4.16Å; D447-I450 HydrophobicContact CB-CD1 4.3Å; D447-I450 HydrophobicContact CB-CG1 4.23Å; D447-I450 CarbonylContact O-C 3.49Å; D447-I450 PolarHBondContact O-N 3.34Å; I450-A452 HydrophobicContact CG2-CB 3.96Å; I450-A452 PolarHBondContact O-N 2.73Å
451	E	62.3	Low	82	Confident	132 Å²	132	39.4 Å²	39.4	62%	0.617	21%	0.214	S	C	*	.			trans	-68	57.1	177.7	-66	-171.9	165.8	0	0	112.1	F1109	E451-F1109 VanDerWaalsContact OE2-CE2 3.29Å; E451-F1109 WeakPolarHBondContact OE2-CE2 3.43Å
452	A	68.1	Low	81.7	Confident	17 Å²	17	39.7 Å²	39.7	14%	0.14	22%	0.219	C	C	.	.			trans	-111.1	112.3	175.9	0	0	0	0	0	108.7	I450 A454	I450-A452 HydrophobicContact CG2-CB 3.96Å; I450-A452 PolarHBondContact O-N 2.73Å; A452-A454 PolarHBondContact O-N 3.23Å
453	P	76.9	Confident	81.4	Confident	46 Å²	46	41.2 Å²	41.2	30%	0.299	23%	0.225	S	C	.	.			trans	-65.3	129.9	179.2	28.6	-34.3	0	0	0	110.3	Q443 Y455	Q443-P453 HydrophobicContact CG-CB 4.13Å; P453-Y455 HydrophobicContact CB-CE2 4.43Å
454	A	85.9	Confident	81.4	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.008	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	152.1	167.4	0	0	0	0	0	109.2	Q443 F444 P446 A452 L469 R471	Q443-A454 CarbonylContact C-O 3.53Å; Q443-A454 WeakPolarHBondContact CA-O 3.18Å; F444-A454 HydrophobicContact CD1-CB 4.25Å; F444-A454 HydrophobicContact CE1-CB 3.78Å; F444-A454 HydrophobicContact CE2-CB 4.18Å; F444-A454 HydrophobicContact CZ-CB 3.76Å; F444-A454 PolarHBondContact N-O 2.82Å; F444-A454 PolarHBondContact O-N 2.69Å; F444-A454 VanDerWaalsContact O-O 3.1Å; P446-A454 HydrophobicContact CG-CB 4.22Å; A452-A454 PolarHBondContact O-N 3.23Å; A454-L469 HydrophobicContact CB-CD1 4.31Å; A454-R471 HydrophobicContact CB-CG 3.9Å
455	Y	91	Very high	81.7	Confident	22 Å²	22	38.5 Å²	38.5	9%	0.086	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.7	176.5	-57.5	-89.5	0	0	0	110.3	L441 I442 Q443 P453 L469 I470 L1122	L441-Y455 HydrophobicContact CD2-CD1 4.2Å; L441-Y455 HydrophobicContact CG-CD1 4.45Å; I442-Y455 VanDerWaalsContact O-CA 3.25Å; I442-Y455 WeakPolarHBondContact O-CA 3.41Å; Q443-Y455 HydrophobicContact CB-CD1 3.94Å; Q443-Y455 HydrophobicContact CB-CE1 3.75Å; Q443-Y455 HydrophobicContact CG-CD1 4.28Å; Q443-Y455 HydrophobicContact CG-CE1 3.82Å; P453-Y455 HydrophobicContact CB-CE2 4.43Å; Y455-L469 CarbonylContact O-C 3.48Å; Y455-L469 WeakPolarHBondContact O-CA 3.48Å; Y455-I470 PolarHBondContact N-O 2.8Å; Y455-I470 PolarHBondContact O-N 3.43Å; Y455-L1122 HydrophobicContact CD1-CD1 4.48Å; Y455-L1122 HydrophobicContact CE1-CD1 3.84Å; Y455-L1122 HydrophobicContact CE2-CD1 4.19Å
456	L	94	Very high	82.3	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120.2	171.7	-172.9	65.2	0	0	0	107.9	L441 I442 F444 L467 R468 L469 I797 L806 F815	L441-L456 WeakPolarHBondContact CA-O 3.48Å; I442-L456 HydrophobicContact CD1-CB 4.23Å; I442-L456 HydrophobicContact CD1-CD2 4.47Å; I442-L456 HydrophobicContact CG1-CB 3.88Å; I442-L456 PolarHBondContact N-O 2.93Å; I442-L456 PolarHBondContact O-N 2.85Å; F444-L456 HydrophobicContact CD1-CB 4.4Å; F444-L456 HydrophobicContact CE1-CB 3.93Å; L456-L467 HydrophobicContact CD1-CB 3.89Å; L456-R468 WeakPolarHBondContact CA-O 3.48Å; L456-L469 HydrophobicContact CD1-CB 4.11Å; L456-I797 HydrophobicContact CD1-CD1 4.49Å; L456-L806 HydrophobicContact CB-CD2 3.96Å; L456-L806 HydrophobicContact CD2-CD1 3.9Å; L456-L806 HydrophobicContact CD2-CD2 4.01Å; L456-L806 HydrophobicContact CG-CD2 3.79Å; L456-L806 WeakPolarHBondContact O-CD2 3.22Å; L456-F815 HydrophobicContact CD2-CB 4.32Å; L456-F815 HydrophobicContact CD2-CD1 3.82Å; L456-F815 HydrophobicContact CD2-CD2 3.79Å; L456-F815 HydrophobicContact CD2-CE1 4.03Å; L456-F815 HydrophobicContact CD2-CE2 3.97Å; L456-F815 HydrophobicContact CD2-CG 3.71Å; L456-F815 HydrophobicContact CD2-CZ 4.11Å
457	A	95.5	Very high	83.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140.8	-178.6	0	0	0	0	0	111.2	I438 D440 L441 L467 R468 I470	I438-A457 HydrophobicContact CG2-CB 4.11Å; D440-A457 WeakPolarHBondContact O-CA 3.46Å; L441-A457 HydrophobicContact CD1-CB 3.54Å; A457-L467 CarbonylContact O-C 3.59Å; A457-L467 VanDerWaalsContact O-CA 3.3Å; A457-L467 WeakPolarHBondContact O-CA 3.5Å; A457-R468 HydrophobicContact CB-CB 4.24Å; A457-R468 PolarHBondContact N-O 2.77Å; A457-R468 PolarHBondContact O-N 3.23Å; A457-I470 HydrophobicContact CB-CD1 4.32Å
458	C	96	Very high	84.4	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	110.7	164	-73.9	0	0	0	0	108.6	V439 D440 P803	V439-C458 HydrophobicContact CB-CB 4.39Å; V439-C458 PolarHBondContact N-O 3.07Å; D440-C458 HydrophobicContact CB-CB 4.06Å; D440-C458 PolarHBondContact O-N 2.96Å; C458-P803 HydrophobicContact CB-CB 3.76Å; C458-P803 HydrophobicContact CB-CG 3.92Å
459	S	95.3	Very high	85.7	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.007	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	151.1	-175.5	-63.6	0	0	0	0	112.9	L435 P437 S466 R468	L435-S459 VanDerWaalsContact O-CB 3.28Å; L435-S459 WeakPolarHBondContact O-CB 3.39Å; L435-S459 PolarHBondContact O-OG 3.36Å; P437-S459 VanDerWaalsContact O-CA 3.32Å; P437-S459 WeakPolarHBondContact O-CA 3.16Å; S459-S466 CarbonylContact C-O 3.54Å; S459-S466 PolarHBondContact N-O 3.1Å; S459-S466 CarbonylContact O-C 3.58Å; S459-S466 PolarHBondContact O-N 3.17Å; S459-R468 WeakPolarHBondContact OG-CG 3.42Å
460	G	92.3	Very high	87.1	Confident	2 Å²	2	22 Å²	22	2%	0.021	12%	0.115	C	C	.	.			trans	80.8	176	172.6	0	0	0	0	0	115.2	V407	V407-G460 WeakPolarHBondContact O-CA 3.42Å
461	H	91	Very high	88	Confident	76 Å²	76	23 Å²	23	35%	0.352	12%	0.116	S	C	.	.			trans	-138.3	144.6	-171.8	-177.2	77.3	0	0	0	112.7	V407 K463 D464	V407-H461 HydrophobicContact CB-CB 4.35Å; V407-H461 HydrophobicContact CG2-CB 4.49Å; H461-K463 PolarHBondContact O-N 3.39Å; H461-D464 PolarHBondContact O-N 2.84Å; H461-D464 VanDerWaalsContact O-N 3.11Å
462	G	88.1	Confident	88.6	Confident	14 Å²	14	17.7 Å²	17.7	14%	0.144	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	57.2	-130.9	176.9	0	0	0	0	0	111.9	D464 G465 G800 E801 T802	G462-D464 PolarHBondContact O-N 3.13Å; G462-G465 PolarHBondContact O-N 3.42Å; G462-G465 VanDerWaalsContact O-N 3.12Å; G462-G800 CarbonylContact O-C 3.54Å; G462-E801 CarbonylContact O-C 3.54Å; G462-E801 WeakPolarHBondContact O-CA 3.17Å; G462-E801 PolarHBondContact O-N 2.94Å; G462-T802 WeakPolarHBondContact CA-OG1 3.36Å; G462-T802 PolarHBondContact N-OG1 2.91Å
463	K	86.6	Confident	88.9	Confident	54 Å²	54	17 Å²	17	24%	0.235	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-62.1	-22.6	178.3	67.6	176.4	-174.9	177.9	0	114.3	R362 E386 V387 H461 G465 G800 P835	R362-K463 WeakPolarHBondContact O-CE 3.45Å; R362-K463 PolarHBondContact O-NZ 2.95Å; E386-K463 VanDerWaalsContact CD-NZ 3.33Å; E386-K463 WeakPolarHBondContact OE1-CD 3.43Å; E386-K463 IonicContact OE1-NZ 3.5Å; E386-K463 PolarHBondContact OE1-NZ 2.79Å; V387-K463 WeakPolarHBondContact O-CE 3.39Å; V387-K463 PolarHBondContact O-NZ 3.06Å; H461-K463 PolarHBondContact O-N 3.39Å; K463-G465 VanDerWaalsContact C-N 3.34Å; K463-G800 WeakPolarHBondContact O-CA 3.32Å; K463-P835 HydrophobicContact CB-CG 4.01Å
464	D	90.1	Very high	89	Confident	22 Å²	22	14.8 Å²	14.8	12%	0.118	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	-93	2.8	-179.7	-63.9	-46.7	0	0	0	112	S388 R389 S408 H461 G462	S388-D464 VanDerWaalsContact CA-OD2 3.24Å; S388-D464 WeakPolarHBondContact CA-OD2 3.28Å; S388-D464 VanDerWaalsContact CB-OD2 3.25Å; S388-D464 WeakPolarHBondContact CB-OD2 3.46Å; S388-D464 PolarHBondContact OG-OD1 3.39Å; S388-D464 PolarHBondContact OG-OD2 3.12Å; R389-D464 PolarHBondContact N-OD2 2.89Å; R389-D464 VanDerWaalsContact N-OD2 3.13Å; S408-D464 PolarHBondContact OG-OD2 3.47Å; H461-D464 PolarHBondContact O-N 2.84Å; H461-D464 VanDerWaalsContact O-N 3.11Å; G462-D464 PolarHBondContact O-N 3.13Å
465	G	93	Very high	88.6	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.01	9%	0.093	C	C	.	.			trans	-59.4	136.9	178	0	0	0	0	0	112.3	G462 K463 L799 G800 E801	G462-G465 PolarHBondContact O-N 3.42Å; G462-G465 VanDerWaalsContact O-N 3.12Å; K463-G465 VanDerWaalsContact C-N 3.34Å; G465-L799 WeakPolarHBondContact O-CB 3.38Å; G465-L799 PolarHBondContact O-N 2.83Å; G465-G800 PolarHBondContact O-N 3.42Å; G465-E801 WeakPolarHBondContact CA-O 3.38Å
466	S	94.6	Very high	88.2	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.007	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	155.4	-172.7	61.5	0	0	0	0	112.1	S459 R468 I797	S459-S466 CarbonylContact C-O 3.54Å; S459-S466 PolarHBondContact N-O 3.1Å; S459-S466 CarbonylContact O-C 3.58Å; S459-S466 PolarHBondContact O-N 3.17Å; S466-R468 PolarHBondContact OG-NE 2.74Å; S466-I797 CarbonylContact C-O 3.59Å; S466-I797 WeakPolarHBondContact CA-O 3.5Å; S466-I797 VanDerWaalsContact CB-O 3.31Å; S466-I797 WeakPolarHBondContact CB-O 3.3Å
467	L	95.2	Very high	87.8	Confident	3 Å²	3	27.4 Å²	27.4	2%	0.016	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	138.8	161.6	-53	171	0	0	0	108.9	L456 A457 I797 L799 P803 V817	L456-L467 HydrophobicContact CD1-CB 3.89Å; A457-L467 CarbonylContact O-C 3.59Å; A457-L467 VanDerWaalsContact O-CA 3.3Å; A457-L467 WeakPolarHBondContact O-CA 3.5Å; L467-I797 HydrophobicContact CB-CB 4.18Å; L467-I797 HydrophobicContact CB-CD1 4.18Å; L467-I797 PolarHBondContact N-O 3.16Å; L467-I797 PolarHBondContact O-N 3.3Å; L467-L799 HydrophobicContact CD1-CD2 4.16Å; L467-L799 HydrophobicContact CD2-CD1 4.03Å; L467-L799 HydrophobicContact CG-CD1 3.94Å; L467-L799 HydrophobicContact CG-CD2 4.07Å; L467-L799 HydrophobicContact CG-CG 4.24Å; L467-P803 HydrophobicContact CD2-CB 4.29Å; L467-V817 HydrophobicContact CD1-CG2 3.92Å; L467-V817 HydrophobicContact CD2-CG1 4.08Å; L467-V817 HydrophobicContact CD2-CG2 4.3Å
468	R	93	Very high	87.3	Confident	7 Å²	7	31 Å²	31	3%	0.026	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	111.6	176.5	-61.6	-70.3	175.7	147.5	10.1	109.1	D409 S434 L435 L456 A457 S459 S466 I470 R795	D409-R468 VanDerWaalsContact CG-NH2 3.26Å; D409-R468 IonicContact OD1-CZ 2.72Å; D409-R468 VanDerWaalsContact OD1-CZ 3.31Å; D409-R468 IonicContact OD1-NH1 3.01Å; D409-R468 PolarHBondContact OD1-NH1 2.67Å; D409-R468 VanDerWaalsContact OD1-NH1 3.14Å; D409-R468 IonicContact OD1-NH2 3.26Å; D409-R468 PolarHBondContact OD1-NH2 2.96Å; D409-R468 IonicContact OD2-CZ 3.8Å; D409-R468 IonicContact OD2-NH1 2.61Å; D409-R468 IonicContact OD2-NH2 2.98Å; D409-R468 PolarHBondContact OD2-NH2 3.49Å; S434-R468 VanDerWaalsContact O-CZ 3.24Å; S434-R468 PolarHBondContact O-NH2 3.36Å; S434-R468 VanDerWaalsContact O-NH2 3.08Å; L435-R468 HydrophobicContact CD2-CB 3.63Å; L435-R468 HydrophobicContact CD2-CG 3.66Å; L456-R468 WeakPolarHBondContact CA-O 3.48Å; A457-R468 HydrophobicContact CB-CB 4.24Å; A457-R468 PolarHBondContact N-O 2.77Å; A457-R468 PolarHBondContact O-N 3.23Å; S459-R468 WeakPolarHBondContact OG-CG 3.42Å; S466-R468 PolarHBondContact OG-NE 2.74Å; R468-I470 HydrophobicContact CB-CG1 4.48Å; R468-R795 WeakPolarHBondContact CA-O 3.47Å
469	L	90.6	Very high	86.9	Confident	5 Å²	5	33.4 Å²	33.4	3%	0.026	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	110.8	173.2	171.1	62.1	0	0	0	108.4	F444 A454 Y455 L456 R471 C794 R795	F444-L469 HydrophobicContact CE1-CD1 3.79Å; F444-L469 HydrophobicContact CZ-CD1 3.51Å; A454-L469 HydrophobicContact CB-CD1 4.31Å; Y455-L469 CarbonylContact O-C 3.48Å; Y455-L469 WeakPolarHBondContact O-CA 3.48Å; L456-L469 HydrophobicContact CD1-CB 4.11Å; L469-R471 HydrophobicContact CD1-CG 4.17Å; L469-R471 HydrophobicContact CG-CG 4.26Å; L469-C794 CarbonylContact O-C 3.57Å; L469-C794 WeakPolarHBondContact O-CA 3.32Å; L469-R795 HydrophobicContact CB-CB 4.22Å; L469-R795 PolarHBondContact N-O 2.75Å; L469-R795 PolarHBondContact O-N 3.43Å
470	I	88.1	Confident	86.6	Confident	16 Å²	16	34.8 Å²	34.8	8%	0.082	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.7	-175.5	-53.7	162.9	0	0	0	107.8	L435 Y455 A457 R468 V792 H793	L435-I470 HydrophobicContact CD1-CD1 3.75Å; L435-I470 HydrophobicContact CD1-CG1 4.47Å; L435-I470 HydrophobicContact CD2-CD1 4.06Å; L435-I470 HydrophobicContact CD2-CG1 4.21Å; Y455-I470 PolarHBondContact N-O 2.8Å; Y455-I470 PolarHBondContact O-N 3.43Å; A457-I470 HydrophobicContact CB-CD1 4.32Å; R468-I470 HydrophobicContact CB-CG1 4.48Å; I470-V792 HydrophobicContact CG2-CG1 3.61Å; I470-H793 WeakPolarHBondContact CA-O 3.11Å
471	R	80.1	Confident	86.4	Confident	60 Å²	60	42 Å²	42	23%	0.226	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	134.8	179.4	-61.4	-173.2	179.4	169.9	-3.9	110.2	A454 L469 S473 L754 V792 H793	A454-R471 HydrophobicContact CB-CG 3.9Å; L469-R471 HydrophobicContact CD1-CG 4.17Å; L469-R471 HydrophobicContact CG-CG 4.26Å; R471-S473 PolarHBondContact O-N 3.08Å; R471-L754 HydrophobicContact CB-CD1 4.13Å; R471-L754 HydrophobicContact CG-CD1 4.37Å; R471-V792 CarbonylContact O-C 3.43Å; R471-V792 WeakPolarHBondContact O-CA 3.39Å; R471-V792 WeakPolarHBondContact O-CG1 3.39Å; R471-H793 PolarHBondContact N-O 3.23Å; R471-H793 PolarHBondContact O-N 3.3Å
472	G	74.5	Confident	86.4	Confident	22 Å²	22	39.5 Å²	39.5	23%	0.227	19%	0.191	C	C	.	.	S	Bend	trans	-70.3	69.9	172.1	0	0	0	0	0	112.2	S791 N1242	G472-S791 CarbonylContact C-O 3.51Å; G472-N1242 WeakPolarHBondContact CA-O 3.25Å
473	S	75.2	Confident	86.5	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.007	22%	0.219	C	C	.	.	S	Bend	trans	-156.2	165	-178.3	71.3	0	0	0	0	112.4	R471 R752 L754 S791 V792 H793	R471-S473 PolarHBondContact O-N 3.08Å; S473-R752 VanDerWaalsContact CA-O 3.3Å; S473-R752 WeakPolarHBondContact CA-O 3.45Å; S473-R752 WeakPolarHBondContact CB-O 3.11Å; S473-L754 VanDerWaalsContact CB-CG 3.49Å; S473-L754 WeakPolarHBondContact OG-CD1 3.43Å; S473-L754 WeakPolarHBondContact OG-CG 3.35Å; S473-S791 PolarHBondContact N-O 3.26Å; S473-V792 CarbonylContact O-C 3.56Å; S473-H793 VanDerWaalsContact O-CB 3.29Å; S473-H793 WeakPolarHBondContact O-CB 3.23Å; S473-H793 PolarHBondContact O-N 2.84Å
474	I	79.6	Confident	86.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-70.2	146.4	168.3	-72	170.3	0	0	0	110.1	N476 I740 T751 R752 I786 L789 S790	I474-N476 PolarHBondContact O-N 3.22Å; I474-N476 PolarHBondContact O-OD1 2.66Å; I474-I740 HydrophobicContact CD1-CB 3.77Å; I474-I740 HydrophobicContact CD1-CD1 3.55Å; I474-I740 HydrophobicContact CD1-CG1 3.67Å; I474-T751 HydrophobicContact CD1-CG2 4.22Å; I474-T751 HydrophobicContact CG1-CG2 3.64Å; I474-R752 PolarHBondContact N-O 3.22Å; I474-I786 HydrophobicContact CG2-CG2 3.6Å; I474-L789 HydrophobicContact CD1-CD2 3.89Å; I474-S790 WeakPolarHBondContact CG1-O 3.17Å
475	E	77.7	Confident	86.7	Confident	77 Å²	77	45.9 Å²	45.9	36%	0.36	24%	0.237	S	C	.	.			trans	-74.5	114.2	169.7	-176.2	162.2	177.1	0	0	110.9	V787 H793	E475-V787 HydrophobicContact CG-CB 4.32Å; E475-V787 HydrophobicContact CG-CG2 4.25Å; E475-V787 PolarHBondContact O-N 3.19Å; E475-H793 HydrophobicContact CB-CB 4.46Å; E475-H793 VanDerWaalsContact CB-ND1 3.32Å; E475-H793 WeakPolarHBondContact CB-ND1 3.42Å; E475-H793 VanDerWaalsContact CG-CE1 3.42Å; E475-H793 WeakPolarHBondContact CG-CE1 3.45Å; E475-H793 WeakPolarHBondContact CG-ND1 3.34Å; E475-H793 IonicContact OE1-CE1 2.94Å; E475-H793 IonicContact OE2-CE1 2.8Å; E475-H793 PolarHBondContact OE2-CE1 3.25Å; E475-H793 IonicContact OE2-ND1 3.42Å; E475-H793 PolarHBondContact OE2-ND1 3.14Å; E475-H793 VanDerWaalsContact OE2-ND1 3.16Å
476	N	82.5	Confident	86.5	Confident	39 Å²	39	48 Å²	48	21%	0.209	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.4	177.4	66	-56.6	0	0	0	110.9	I474 V753 L754 I784 S785	I474-N476 PolarHBondContact O-N 3.22Å; I474-N476 PolarHBondContact O-OD1 2.66Å; N476-V753 HydrophobicContact CB-CG1 4.1Å; N476-L754 PolarHBondContact ND2-O 3.11Å; N476-I784 HydrophobicContact CB-CG2 3.69Å; N476-S785 WeakPolarHBondContact CA-O 3.43Å
477	R	83.9	Confident	86.4	Confident	174 Å²	174	48.3 Å²	48.3	66%	0.657	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	113.9	176.5	177.8	-178.1	177.6	-179.8	-1.9	110.1	S479 I784 S785	R477-S479 PolarHBondContact O-N 3.35Å; R477-I784 WeakPolarHBondContact O-CA 3.31Å; R477-S785 PolarHBondContact N-O 3.5Å; R477-S785 PolarHBondContact O-N 2.77Å; R477-S785 PolarHBondContact O-OG 3.12Å
478	E	85.5	Confident	86.2	Confident	76 Å²	76	50 Å²	50	36%	0.355	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	118.8	171.2	-170.9	174.6	-170.5	0	0	109.7	R481 S782 I784	E478-R481 VanDerWaalsContact CD-NH2 3.29Å; E478-R481 WeakPolarHBondContact OE1-CB 3.46Å; E478-R481 IonicContact OE1-CZ 3.43Å; E478-R481 VanDerWaalsContact OE1-CZ 3.26Å; E478-R481 IonicContact OE1-NE 3.19Å; E478-R481 PolarHBondContact OE1-NE 3.41Å; E478-R481 IonicContact OE1-NH2 2.77Å; E478-R481 PolarHBondContact OE1-NH2 2.79Å; E478-R481 IonicContact OE2-CZ 3.59Å; E478-R481 IonicContact OE2-NE 2.82Å; E478-R481 IonicContact OE2-NH2 3.2Å; E478-R481 PolarHBondContact OE2-NH2 2.9Å; E478-S782 WeakPolarHBondContact OE1-CB 3.29Å; E478-S782 PolarHBondContact OE1-OG 3.24Å; E478-S782 VanDerWaalsContact OE1-OG 3.1Å; E478-I784 HydrophobicContact CB-CG1 4.42Å; E478-I784 HydrophobicContact CG-CG1 4.41Å
479	S	87.8	Confident	86.2	Confident	51 Å²	51	52.1 Å²	52.1	36%	0.357	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-34.2	-175.7	-55.6	0	0	0	0	111.9	R477 V783	R477-S479 PolarHBondContact O-N 3.35Å; S479-V783 PolarHBondContact N-O 3.12Å
480	A	88.4	Confident	86.4	Confident	30 Å²	30	51.9 Å²	51.9	25%	0.248	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	149.5	176.2	0	0	0	0	0	110.8	F769 S782 V783	A480-F769 HydrophobicContact CB-CE1 4.22Å; A480-F769 HydrophobicContact CB-CZ 4.07Å; A480-S782 CarbonylContact O-C 3.58Å; A480-S782 WeakPolarHBondContact O-CA 3.38Å; A480-V783 HydrophobicContact CB-CB 4.13Å; A480-V783 HydrophobicContact CB-CG2 4.21Å; A480-V783 PolarHBondContact N-O 2.93Å; A480-V783 PolarHBondContact O-N 3.43Å
481	R	89.8	Confident	86.7	Confident	153 Å²	153	52.1 Å²	52.1	58%	0.577	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.1	173.8	-173.3	178.1	-70.9	-172.7	1.1	110.1	E478	E478-R481 VanDerWaalsContact CD-NH2 3.29Å; E478-R481 WeakPolarHBondContact OE1-CB 3.46Å; E478-R481 IonicContact OE1-CZ 3.43Å; E478-R481 VanDerWaalsContact OE1-CZ 3.26Å; E478-R481 IonicContact OE1-NE 3.19Å; E478-R481 PolarHBondContact OE1-NE 3.41Å; E478-R481 IonicContact OE1-NH2 2.77Å; E478-R481 PolarHBondContact OE1-NH2 2.79Å; E478-R481 IonicContact OE2-CZ 3.59Å; E478-R481 IonicContact OE2-NE 2.82Å; E478-R481 IonicContact OE2-NH2 3.2Å; E478-R481 PolarHBondContact OE2-NH2 2.9Å
482	I	91	Very high	87.3	Confident	24 Å²	24	50 Å²	50	12%	0.123	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	112.4	178.1	-51.4	169.4	0	0	0	107.3	L484 L505 V523 S780 L781	I482-L484 HydrophobicContact CB-CD1 4.43Å; I482-L484 HydrophobicContact CG2-CD1 3.63Å; I482-L484 HydrophobicContact CG2-CG 3.95Å; I482-L484 PolarHBondContact O-N 2.86Å; I482-L505 HydrophobicContact CD1-CD2 4.38Å; I482-V523 HydrophobicContact CD1-CG1 4.2Å; I482-V523 HydrophobicContact CD1-CG2 3.78Å; I482-V523 HydrophobicContact CG1-CG2 4.16Å; I482-S780 CarbonylContact O-C 3.57Å; I482-S780 VanDerWaalsContact O-CA 3.26Å; I482-S780 WeakPolarHBondContact O-CA 3.41Å; I482-S780 VanDerWaalsContact O-CB 3.27Å; I482-S780 WeakPolarHBondContact O-CB 3.32Å; I482-L781 HydrophobicContact CB-CB 4.17Å; I482-L781 PolarHBondContact N-O 3.31Å; I482-L781 PolarHBondContact O-N 2.99Å
483	P	89.7	Confident	88	Confident	113 Å²	113	49.1 Å²	49.1	73%	0.734	26%	0.263	S	S	*	.			trans	-71.5	103	-178.8	28.7	-32.7	0	0	0	110.4
484	L	89.4	Confident	88.4	Confident	24 Å²	24	53.8 Å²	53.8	13%	0.126	29%	0.285	C	S	.	.			trans	-143.3	112	-176.8	-79.2	169.6	0	0	0	108.7	I482 Y516 D779 S780 L781	I482-L484 HydrophobicContact CB-CD1 4.43Å; I482-L484 HydrophobicContact CG2-CD1 3.63Å; I482-L484 HydrophobicContact CG2-CG 3.95Å; I482-L484 PolarHBondContact O-N 2.86Å; L484-Y516 HydrophobicContact CD1-CE2 4.03Å; L484-Y516 WeakPolarHBondContact CD2-OH 3.25Å; L484-D779 CarbonylContact C-O 3.52Å; L484-D779 PolarHBondContact N-O 2.91Å; L484-D779 CarbonylContact O-C 3.6Å; L484-S780 WeakPolarHBondContact O-CA 3.46Å; L484-S780 PolarHBondContact O-N 2.85Å; L484-S780 VanDerWaalsContact O-N 3.1Å; L484-L781 HydrophobicContact CB-CD1 4.43Å; L484-L781 HydrophobicContact CD1-CD1 3.65Å
485	S	90	Very high	88.2	Confident	87 Å²	87	54.9 Å²	54.9	61%	0.608	29%	0.289	S	S	*	.	S	Bend	trans	-94.9	144.6	-177.6	58.7	0	0	0	0	112.7	A487	S485-A487 PolarHBondContact O-N 2.89Å
486	G	89.3	Confident	87.6	Confident	46 Å²	46	53.8 Å²	53.8	47%	0.474	29%	0.294	S	S	.	.	S	Bend	trans	74.6	9.6	175.3	0	0	0	0	0	115	V488 F509 K778	G486-V488 PolarHBondContact O-N 2.79Å; G486-F509 WeakPolarHBondContact O-CD1 3.49Å; G486-K778 PolarHBondContact N-O 2.89Å; G486-K778 VanDerWaalsContact N-O 3.11Å
487	A	92.1	Very high	86.3	Confident	7 Å²	7	56.2 Å²	56.2	6%	0.058	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	130.3	169.5	0	0	0	0	0	109.3	S485 V507 F509 C776 L781	S485-A487 PolarHBondContact O-N 2.89Å; A487-V507 HydrophobicContact CB-CG1 3.66Å; A487-F509 HydrophobicContact CB-CE1 4.11Å; A487-F509 HydrophobicContact CB-CZ 4.45Å; A487-C776 VanDerWaalsContact CB-SG 3.51Å; A487-C776 PolarHBondContact O-SG 3.36Å; A487-C776 VanDerWaalsContact O-SG 3.35Å; A487-L781 HydrophobicContact CB-CD1 4.46Å
488	V	92.1	Very high	84.8	Confident	39 Å²	39	48.6 Å²	48.6	24%	0.236	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-44	178.4	-176.9	0	0	0	0	109.4	G486 S508 V510 S759 S760	G486-V488 PolarHBondContact O-N 2.79Å; V488-S508 PolarHBondContact N-O 2.91Å; V488-V510 HydrophobicContact CG2-CG2 3.7Å; V488-S759 VanDerWaalsContact O-CB 3.28Å; V488-S759 WeakPolarHBondContact O-CB 3.39Å; V488-S759 PolarHBondContact O-OG 2.72Å; V488-S760 PolarHBondContact O-OG 2.86Å
489	Q	93.7	Very high	83.3	Confident	50 Å²	50	52.4 Å²	52.4	23%	0.234	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	150.5	-177.5	-160	162.4	4.7	0	0	112.1	W491 S508 S760	Q489-W491 HydrophobicContact CB-CH2 3.63Å; Q489-W491 HydrophobicContact CB-CZ2 4.03Å; Q489-W491 HydrophobicContact CB-CZ3 4.09Å; Q489-W491 HydrophobicContact CG-CD2 4.44Å; Q489-W491 HydrophobicContact CG-CH2 3.5Å; Q489-W491 HydrophobicContact CG-CZ2 3.34Å; Q489-W491 HydrophobicContact CG-CZ3 4.14Å; Q489-S508 PolarHBondContact N-O 3.27Å; Q489-S508 PolarHBondContact O-N 3.32Å; Q489-S760 VanDerWaalsContact CA-OG 3.29Å; Q489-S760 WeakPolarHBondContact CA-OG 2.87Å
490	A	94.3	Very high	81.9	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	143.1	176.7	0	0	0	0	0	111.7	I506 V507 S762 L774 L781	A490-I506 CarbonylContact C-O 3.43Å; A490-I506 VanDerWaalsContact CA-O 3.28Å; A490-I506 WeakPolarHBondContact CA-O 3.25Å; A490-V507 HydrophobicContact CB-CG2 4.24Å; A490-S762 VanDerWaalsContact O-CB 3.25Å; A490-S762 WeakPolarHBondContact O-CB 3.49Å; A490-S762 PolarHBondContact O-OG 3.02Å; A490-L774 HydrophobicContact CB-CD2 3.77Å; A490-L781 HydrophobicContact CB-CD1 4.07Å; A490-L781 HydrophobicContact CB-CD2 3.47Å; A490-L781 VanDerWaalsContact CB-CD2 3.47Å; A490-L781 HydrophobicContact CB-CG 4.37Å
491	W	94	Very high	80.7	Confident	20 Å²	20	58.2 Å²	58.2	8%	0.076	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140	177	-57.5	-97.2	0	0	0	110.1	Q489 L505 I506 T537 W538 A540	Q489-W491 HydrophobicContact CB-CH2 3.63Å; Q489-W491 HydrophobicContact CB-CZ2 4.03Å; Q489-W491 HydrophobicContact CB-CZ3 4.09Å; Q489-W491 HydrophobicContact CG-CD2 4.44Å; Q489-W491 HydrophobicContact CG-CH2 3.5Å; Q489-W491 HydrophobicContact CG-CZ2 3.34Å; Q489-W491 HydrophobicContact CG-CZ3 4.14Å; W491-L505 CarbonylContact O-C 3.58Å; W491-L505 WeakPolarHBondContact O-CA 3.36Å; W491-I506 HydrophobicContact CE3-CB 4.47Å; W491-I506 HydrophobicContact CE3-CG2 4.29Å; W491-I506 PolarHBondContact N-O 2.76Å; W491-I506 PolarHBondContact O-N 2.8Å; W491-T537 HydrophobicContact CE3-CG2 4.22Å; W491-T537 HydrophobicContact CH2-CG2 3.84Å; W491-T537 WeakPolarHBondContact CH2-O 2.91Å; W491-T537 HydrophobicContact CZ3-CG2 3.61Å; W491-W538 VanDerWaalsContact CZ2-O 3.25Å; W491-W538 WeakPolarHBondContact CZ2-O 3.15Å; W491-A540 HydrophobicContact CB-CB 4.01Å; W491-A540 HydrophobicContact CD2-CB 3.97Å; W491-A540 HydrophobicContact CE3-CB 4.16Å; W491-A540 HydrophobicContact CG-CB 3.91Å
492	F	91.9	Very high	79.9	Confident	17 Å²	17	51.2 Å²	51.2	8%	0.075	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127	165.8	177.8	-97.6	0	0	0	108.8	L505 L518 I764 T766	F492-L505 HydrophobicContact CD2-CD1 4.23Å; F492-L518 HydrophobicContact CD2-CD2 4.41Å; F492-L518 HydrophobicContact CE2-CB 4.42Å; F492-L518 HydrophobicContact CE2-CD2 3.99Å; F492-I764 HydrophobicContact CB-CB 4.19Å; F492-I764 HydrophobicContact CB-CG1 4.3Å; F492-I764 HydrophobicContact CD1-CB 4.38Å; F492-I764 HydrophobicContact CD1-CG1 4.01Å; F492-I764 HydrophobicContact CD2-CD1 3.97Å; F492-I764 HydrophobicContact CD2-CG1 3.97Å; F492-I764 HydrophobicContact CE1-CG1 4.34Å; F492-I764 HydrophobicContact CE2-CD1 4.33Å; F492-I764 HydrophobicContact CE2-CG1 4.3Å; F492-I764 HydrophobicContact CG-CB 4.19Å; F492-I764 HydrophobicContact CG-CD1 4.25Å; F492-I764 HydrophobicContact CG-CG1 3.82Å; F492-I764 HydrophobicContact CZ-CG1 4.47Å; F492-T766 HydrophobicContact CE1-CG2 4.05Å; F492-T766 HydrophobicContact CE2-CG2 3.98Å; F492-T766 HydrophobicContact CZ-CG2 3.4Å
493	V	89.2	Confident	79.7	Confident	2 Å²	2	50 Å²	50	1%	0.012	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139.9	178.3	-63.2	0	0	0	0	110.3	Y495 L504 I506 N542 L551	V493-Y495 PolarHBondContact O-N 3.35Å; V493-L504 HydrophobicContact CG2-CB 3.92Å; V493-L504 HydrophobicContact CG2-CD2 4.11Å; V493-L504 HydrophobicContact CG2-CG 4.41Å; V493-L504 PolarHBondContact N-O 3.47Å; V493-L504 PolarHBondContact O-N 2.86Å; V493-I506 HydrophobicContact CG2-CD1 3.82Å; V493-I506 HydrophobicContact CG2-CG1 4.34Å; V493-N542 WeakPolarHBondContact CA-OD1 3.32Å; V493-N542 VanDerWaalsContact CB-OD1 3.31Å; V493-N542 WeakPolarHBondContact CB-OD1 3.34Å; V493-L551 HydrophobicContact CB-CD1 3.99Å; V493-L551 HydrophobicContact CG1-CD1 3.71Å; V493-L551 HydrophobicContact CG2-CD1 3.98Å; V493-L551 HydrophobicContact CG2-CD2 4.48Å
494	H	84	Confident	79.7	Confident	99 Å²	99	44.8 Å²	44.8	46%	0.458	26%	0.262	S	S	.	.			trans	-69.4	131.2	174.4	-66	84.6	0	0	0	108.6	N542 V564	H494-N542 PolarHBondContact N-OD1 3.18Å; H494-N542 PolarHBondContact O-ND2 3.26Å; H494-V564 WeakPolarHBondContact O-CG1 3.38Å
495	Y	75.9	Confident	79.8	Confident	23 Å²	23	43.8 Å²	43.8	9%	0.09	26%	0.257	C	S	.	.			trans	-135.1	122.4	-174.7	-163	-99.9	0	0	0	111.2	V493 N497 T498 L504 I528 V564 D567 G568	V493-Y495 PolarHBondContact O-N 3.35Å; Y495-N497 HydrophobicContact CD1-CB 4.15Å; Y495-N497 HydrophobicContact CE1-CB 4.14Å; Y495-N497 PolarHBondContact O-N 2.84Å; Y495-T498 PolarHBondContact O-N 2.82Å; Y495-T498 PolarHBondContact O-OG1 2.83Å; Y495-L504 HydrophobicContact CD2-CD2 4.16Å; Y495-L504 HydrophobicContact CE2-CD2 4.5Å; Y495-L504 HydrophobicContact CG-CB 4.24Å; Y495-L504 HydrophobicContact CG-CD2 4.44Å; Y495-I528 HydrophobicContact CE1-CD1 4.37Å; Y495-I528 HydrophobicContact CE2-CD1 4.27Å; Y495-V564 HydrophobicContact CD2-CG1 4.19Å; Y495-D567 WeakPolarHBondContact OH-CA 3.47Å; Y495-D567 PolarHBondContact OH-O 2.7Å; Y495-G568 WeakPolarHBondContact OH-CA 3.33Å; Y495-G568 PolarHBondContact OH-N 3.43Å; Y495-G568 VanDerWaalsContact OH-N 3.1Å
496	A	65.2	Low	80	Confident	55 Å²	55	39.7 Å²	39.7	46%	0.455	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-17.4	-161.2	0	0	0	0	0	114.7	T498 V564	A496-T498 PolarHBondContact O-N 3.24Å; A496-T498 VanDerWaalsContact O-N 3.16Å; A496-V564 HydrophobicContact CB-CG1 4.14Å; A496-V564 WeakPolarHBondContact CB-O 3.43Å; A496-V564 VanDerWaalsContact N-CG1 3.32Å; A496-V564 PolarHBondContact N-O 2.87Å
497	N	55.4	Low	80.3	Confident	90 Å²	90	37.5 Å²	37.5	48%	0.481	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	7.8	174.3	-140.6	-8	0	0	0	113.5	Y495 R519 D567	Y495-N497 HydrophobicContact CD1-CB 4.15Å; Y495-N497 HydrophobicContact CE1-CB 4.14Å; Y495-N497 PolarHBondContact O-N 2.84Å; N497-R519 PolarHBondContact O-NH2 2.9Å; N497-D567 VanDerWaalsContact CB-OD1 3.23Å; N497-D567 WeakPolarHBondContact CB-OD1 3.3Å; N497-D567 VanDerWaalsContact ND2-CG 3.32Å; N497-D567 PolarHBondContact ND2-OD1 3.34Å; N497-D567 PolarHBondContact ND2-OD2 3.04Å
498	T	53.1	Low	80.4	Confident	14 Å²	14	37.1 Å²	37.1	9%	0.086	20%	0.202	C	C	.	.	S	Bend	trans	-113.5	135.2	170.3	56.2	0	0	0	0	108.9	Y495 A496 G502 G503 T517 R519	Y495-T498 PolarHBondContact O-N 2.82Å; Y495-T498 PolarHBondContact O-OG1 2.83Å; A496-T498 PolarHBondContact O-N 3.24Å; A496-T498 VanDerWaalsContact O-N 3.16Å; T498-G502 PolarHBondContact OG1-O 2.67Å; T498-G503 PolarHBondContact OG1-N 2.66Å; T498-T517 HydrophobicContact CG2-CG2 3.4Å; T498-T517 VanDerWaalsContact CG2-CG2 3.4Å; T498-R519 HydrophobicContact CG2-CG 4.4Å
499	Q	53	Low	80.5	Confident	156 Å²	156	37.2 Å²	37.2	73%	0.729	20%	0.199	S	C	*	.			trans	-42.8	161.3	169	-75.3	-105.5	-20.3	0	0	111.1	D501 G502	Q499-D501 PolarHBondContact O-N 2.58Å; Q499-G502 PolarHBondContact O-N 2.76Å
500	P	58.5	Low	80.4	Confident	118 Å²	118	38.6 Å²	38.6	77%	0.766	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-17.4	-174.1	17.1	-31.5	0	0	0	116.2
501	D	63.1	Low	80.2	Confident	84 Å²	84	47.6 Å²	47.6	45%	0.449	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	1.2	179.3	-69.4	-40.5	0	0	0	115.8	Q499 T766	Q499-D501 PolarHBondContact O-N 2.58Å; D501-T766 WeakPolarHBondContact O-CB 3.34Å
502	G	72.8	Confident	80.1	Confident	6 Å²	6	46.9 Å²	46.9	6%	0.062	25%	0.25	C	C	.	.			trans	-111.1	172.6	-178	0	0	0	0	0	114.6	T498 Q499 L518	T498-G502 PolarHBondContact OG1-O 2.67Å; Q499-G502 PolarHBondContact O-N 2.76Å; G502-L518 VanDerWaalsContact CA-O 3.26Å; G502-L518 WeakPolarHBondContact CA-O 3.39Å
503	G	86.6	Confident	80.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	-175.2	174.5	0	0	0	0	0	113.8	T498 L518	T498-G503 PolarHBondContact OG1-N 2.66Å; G503-L518 PolarHBondContact N-O 2.87Å; G503-L518 PolarHBondContact O-N 2.7Å
504	L	89.6	Confident	80.5	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.016	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.7	-179.1	-176.3	77.5	0	0	0	109.9	V493 Y495 I506 T515 Y516 I528 I531	V493-L504 HydrophobicContact CG2-CB 3.92Å; V493-L504 HydrophobicContact CG2-CD2 4.11Å; V493-L504 HydrophobicContact CG2-CG 4.41Å; V493-L504 PolarHBondContact N-O 3.47Å; V493-L504 PolarHBondContact O-N 2.86Å; Y495-L504 HydrophobicContact CD2-CD2 4.16Å; Y495-L504 HydrophobicContact CE2-CD2 4.5Å; Y495-L504 HydrophobicContact CG-CB 4.24Å; Y495-L504 HydrophobicContact CG-CD2 4.44Å; L504-I506 HydrophobicContact CD2-CD1 4.13Å; L504-I506 HydrophobicContact CD2-CG1 3.89Å; L504-I506 HydrophobicContact CG-CG1 4.24Å; L504-T515 HydrophobicContact CD1-CG2 4.4Å; L504-T515 HydrophobicContact CD2-CG2 4.31Å; L504-T515 HydrophobicContact CG-CG2 4.49Å; L504-Y516 CarbonylContact C-O 3.57Å; L504-Y516 WeakPolarHBondContact CA-O 3.37Å; L504-I528 HydrophobicContact CD1-CD1 3.64Å; L504-I528 HydrophobicContact CD2-CD1 3.39Å; L504-I528 HydrophobicContact CG-CD1 4.17Å; L504-I531 HydrophobicContact CD2-CD1 4.21Å
505	L	91.9	Very high	80.9	Confident	3 Å²	3	46 Å²	46	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	115.6	170.3	-141.1	95	0	0	0	108.6	I482 W491 F492 V507 T515 Y516 L774 L781	I482-L505 HydrophobicContact CD1-CD2 4.38Å; W491-L505 CarbonylContact O-C 3.58Å; W491-L505 WeakPolarHBondContact O-CA 3.36Å; F492-L505 HydrophobicContact CD2-CD1 4.23Å; L505-V507 HydrophobicContact CD2-CG2 3.73Å; L505-V507 HydrophobicContact CG-CG2 4.41Å; L505-T515 CarbonylContact O-C 3.53Å; L505-T515 WeakPolarHBondContact O-CA 3.44Å; L505-Y516 PolarHBondContact N-O 2.79Å; L505-Y516 PolarHBondContact O-N 3.24Å; L505-L774 HydrophobicContact CD1-CD1 4.36Å; L505-L774 HydrophobicContact CD1-CD2 3.68Å; L505-L774 HydrophobicContact CD2-CD2 4.29Å; L505-L774 HydrophobicContact CG-CD2 4.05Å; L505-L781 HydrophobicContact CD2-CD1 4.23Å
506	I	94.2	Very high	81.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	119.3	173	-60.4	168.7	0	0	0	107.2	A490 W491 V493 L504 T513 T515 I531 T537 A540 L551	A490-I506 CarbonylContact C-O 3.43Å; A490-I506 VanDerWaalsContact CA-O 3.28Å; A490-I506 WeakPolarHBondContact CA-O 3.25Å; W491-I506 HydrophobicContact CE3-CB 4.47Å; W491-I506 HydrophobicContact CE3-CG2 4.29Å; W491-I506 PolarHBondContact N-O 2.76Å; W491-I506 PolarHBondContact O-N 2.8Å; V493-I506 HydrophobicContact CG2-CD1 3.82Å; V493-I506 HydrophobicContact CG2-CG1 4.34Å; L504-I506 HydrophobicContact CD2-CD1 4.13Å; L504-I506 HydrophobicContact CD2-CG1 3.89Å; L504-I506 HydrophobicContact CG-CG1 4.24Å; I506-T513 HydrophobicContact CG2-CG2 3.63Å; I506-T515 HydrophobicContact CG1-CG2 3.95Å; I506-I531 HydrophobicContact CD1-CD1 4.13Å; I506-I531 HydrophobicContact CG1-CD1 4.45Å; I506-T537 HydrophobicContact CG2-CG2 4.42Å; I506-A540 HydrophobicContact CB-CB 4.5Å; I506-A540 HydrophobicContact CD1-CB 3.76Å; I506-A540 HydrophobicContact CG2-CB 4.49Å; I506-L551 HydrophobicContact CD1-CD1 4.41Å; I506-L551 HydrophobicContact CD1-CD2 4.05Å
507	V	95.3	Very high	82.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.1	-176.5	-173.5	0	0	0	0	109.7	A487 A490 L505 F509 T513 K514 Y516 L781	A487-V507 HydrophobicContact CB-CG1 3.66Å; A490-V507 HydrophobicContact CB-CG2 4.24Å; L505-V507 HydrophobicContact CD2-CG2 3.73Å; L505-V507 HydrophobicContact CG-CG2 4.41Å; V507-F509 HydrophobicContact CB-CE2 4.11Å; V507-F509 HydrophobicContact CG1-CD2 4.46Å; V507-F509 HydrophobicContact CG1-CE2 3.7Å; V507-F509 HydrophobicContact CG1-CZ 3.78Å; V507-T513 CarbonylContact O-C 3.21Å; V507-T513 WeakPolarHBondContact O-CA 3.17Å; V507-K514 PolarHBondContact N-O 2.78Å; V507-K514 PolarHBondContact O-N 3.3Å; V507-Y516 HydrophobicContact CB-CE2 4.12Å; V507-Y516 HydrophobicContact CG2-CD2 3.78Å; V507-Y516 HydrophobicContact CG2-CE2 3.7Å; V507-L781 HydrophobicContact CB-CD1 4.48Å; V507-L781 HydrophobicContact CG1-CD1 3.86Å; V507-L781 HydrophobicContact CG2-CD1 3.7Å
508	S	95.5	Very high	84.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.4	-179.7	178.9	0	0	0	0	111.3	V488 Q489 R536 T537	V488-S508 PolarHBondContact N-O 2.91Å; Q489-S508 PolarHBondContact N-O 3.27Å; Q489-S508 PolarHBondContact O-N 3.32Å; S508-R536 VanDerWaalsContact OG-CG 3.3Å; S508-R536 WeakPolarHBondContact OG-CG 3.35Å; S508-T537 WeakPolarHBondContact CB-O 3.24Å; S508-T537 PolarHBondContact OG-N 2.97Å; S508-T537 PolarHBondContact OG-O 2.78Å
509	F	94.2	Very high	85.6	Confident	40 Å²	40	45.9 Å²	45.9	18%	0.175	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	167.5	175	-61.3	-92.9	0	0	0	109	G486 A487 V507 F511 G512 K514 R536	G486-F509 WeakPolarHBondContact O-CD1 3.49Å; A487-F509 HydrophobicContact CB-CE1 4.11Å; A487-F509 HydrophobicContact CB-CZ 4.45Å; V507-F509 HydrophobicContact CB-CE2 4.11Å; V507-F509 HydrophobicContact CG1-CD2 4.46Å; V507-F509 HydrophobicContact CG1-CE2 3.7Å; V507-F509 HydrophobicContact CG1-CZ 3.78Å; F509-F511 PolarHBondContact O-N 2.97Å; F509-F511 VanDerWaalsContact O-N 3.15Å; F509-G512 WeakPolarHBondContact CA-O 3.39Å; F509-G512 PolarHBondContact N-O 3.19Å; F509-G512 PolarHBondContact O-N 2.92Å; F509-K514 HydrophobicContact CD2-CG 4.35Å; F509-K514 HydrophobicContact CE2-CB 3.93Å; F509-K514 HydrophobicContact CE2-CD 3.86Å; F509-K514 HydrophobicContact CE2-CG 3.82Å; F509-K514 HydrophobicContact CZ-CD 4.25Å; F509-R536 WeakPolarHBondContact O-CG 3.46Å
510	V	90.9	Very high	86.8	Confident	80 Å²	80	42.9 Å²	42.9	49%	0.485	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-35.2	179.1	-179.2	0	0	0	0	112.3	V488	V488-V510 HydrophobicContact CG2-CG2 3.7Å
511	F	89	Confident	87.7	Confident	189 Å²	189	44.6 Å²	44.6	83%	0.829	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.6	28	-174.8	-54.5	-66.1	0	0	0	113.6	F509	F509-F511 PolarHBondContact O-N 2.97Å; F509-F511 VanDerWaalsContact O-N 3.15Å
512	G	92.9	Very high	88.6	Confident	6 Å²	6	47 Å²	47	6%	0.062	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.5	-177.6	178.1	0	0	0	0	0	115.2	F509 S533 E535	F509-G512 WeakPolarHBondContact CA-O 3.39Å; F509-G512 PolarHBondContact N-O 3.19Å; F509-G512 PolarHBondContact O-N 2.92Å; G512-S533 CarbonylContact C-O 3.18Å; G512-S533 WeakPolarHBondContact CA-O 3.38Å; G512-E535 CarbonylContact C-O 3.55Å
513	T	95.1	Very high	89.3	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.037	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.7	179	-59.5	0	0	0	0	109.8	I506 V507 I531 S533 E535 T537	I506-T513 HydrophobicContact CG2-CG2 3.63Å; V507-T513 CarbonylContact O-C 3.21Å; V507-T513 WeakPolarHBondContact O-CA 3.17Å; T513-I531 HydrophobicContact CG2-CG2 4.03Å; T513-S533 PolarHBondContact N-O 3.38Å; T513-S533 VanDerWaalsContact O-CA 3.31Å; T513-S533 WeakPolarHBondContact O-CA 3.42Å; T513-E535 PolarHBondContact N-O 3.15Å; T513-E535 PolarHBondContact OG1-O 3.15Å; T513-T537 WeakPolarHBondContact CG2-OG1 3.12Å; T513-T537 PolarHBondContact OG1-N 3.43Å; T513-T537 VanDerWaalsContact OG1-N 3.11Å; T513-T537 PolarHBondContact OG1-OG1 2.92Å
514	K	94.2	Very high	89.4	Confident	83 Å²	83	55.1 Å²	55.1	36%	0.361	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	153.5	170	-66.4	-174.9	160.6	-131.7	0	110.7	V507 F509 Y516 E525	V507-K514 PolarHBondContact N-O 2.78Å; V507-K514 PolarHBondContact O-N 3.3Å; F509-K514 HydrophobicContact CD2-CG 4.35Å; F509-K514 HydrophobicContact CE2-CB 3.93Å; F509-K514 HydrophobicContact CE2-CD 3.86Å; F509-K514 HydrophobicContact CE2-CG 3.82Å; F509-K514 HydrophobicContact CZ-CD 4.25Å; K514-Y516 HydrophobicContact CB-CE2 3.93Å; K514-Y516 WeakPolarHBondContact CD-OH 3.43Å; K514-E525 WeakPolarHBondContact CD-OE1 3.43Å; K514-E525 WeakPolarHBondContact CE-OE1 3.45Å; K514-E525 IonicContact NZ-OE1 3.39Å; K514-E525 PolarHBondContact NZ-OE1 3.31Å; K514-E525 IonicContact NZ-OE2 3.38Å
515	T	93	Very high	89.5	Confident	9 Å²	9	60.1 Å²	60.1	6%	0.055	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.4	-177.2	31.9	0	0	0	0	111	L504 L505 I506 V526 I531	L504-T515 HydrophobicContact CD1-CG2 4.4Å; L504-T515 HydrophobicContact CD2-CG2 4.31Å; L504-T515 HydrophobicContact CG-CG2 4.49Å; L505-T515 CarbonylContact O-C 3.53Å; L505-T515 WeakPolarHBondContact O-CA 3.44Å; I506-T515 HydrophobicContact CG1-CG2 3.95Å; T515-V526 VanDerWaalsContact CB-O 3.28Å; T515-V526 WeakPolarHBondContact CB-O 3.44Å; T515-V526 PolarHBondContact O-N 3.43Å; T515-V526 VanDerWaalsContact O-O 3.05Å; T515-V526 PolarHBondContact OG1-O 2.93Å; T515-I531 HydrophobicContact CG2-CD1 3.97Å; T515-I531 HydrophobicContact CG2-CG2 4.24Å
516	Y	91.7	Very high	89.4	Confident	18 Å²	18	62.6 Å²	62.6	7%	0.071	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.3	178.7	-54.1	-94.4	0	0	0	110.1	L484 L504 L505 V507 K514 V523 E524 E525	L484-Y516 HydrophobicContact CD1-CE2 4.03Å; L484-Y516 WeakPolarHBondContact CD2-OH 3.25Å; L504-Y516 CarbonylContact C-O 3.57Å; L504-Y516 WeakPolarHBondContact CA-O 3.37Å; L505-Y516 PolarHBondContact N-O 2.79Å; L505-Y516 PolarHBondContact O-N 3.24Å; V507-Y516 HydrophobicContact CB-CE2 4.12Å; V507-Y516 HydrophobicContact CG2-CD2 3.78Å; V507-Y516 HydrophobicContact CG2-CE2 3.7Å; K514-Y516 HydrophobicContact CB-CE2 3.93Å; K514-Y516 WeakPolarHBondContact CD-OH 3.43Å; Y516-V523 HydrophobicContact CD1-CG1 4.07Å; Y516-V523 HydrophobicContact CG-CG1 4.21Å; Y516-E524 CarbonylContact C-O 3.57Å; Y516-E524 WeakPolarHBondContact CA-O 3.44Å; Y516-E525 HydrophobicContact CD1-CB 3.83Å; Y516-E525 HydrophobicContact CD1-CG 4.27Å; Y516-E525 HydrophobicContact CE1-CB 3.79Å; Y516-E525 HydrophobicContact CE1-CG 3.96Å
517	T	88.8	Confident	89	Confident	22 Å²	22	70.6 Å²	70.6	14%	0.135	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	128.6	172.5	-32	0	0	0	0	108.6	T498 V523 E524 V526	T498-T517 HydrophobicContact CG2-CG2 3.4Å; T498-T517 VanDerWaalsContact CG2-CG2 3.4Å; T517-V523 WeakPolarHBondContact O-CA 3.31Å; T517-E524 PolarHBondContact N-O 3.37Å; T517-E524 PolarHBondContact O-N 2.7Å; T517-V526 WeakPolarHBondContact OG1-CG2 3.41Å
518	L	86.1	Confident	88.6	Confident	9 Å²	9	71.2 Å²	71.2	5%	0.047	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.8	173.8	-176.5	73.4	0	0	0	109.2	F492 G502 G503 V523 I764 T766 F769	F492-L518 HydrophobicContact CD2-CD2 4.41Å; F492-L518 HydrophobicContact CE2-CB 4.42Å; F492-L518 HydrophobicContact CE2-CD2 3.99Å; G502-L518 VanDerWaalsContact CA-O 3.26Å; G502-L518 WeakPolarHBondContact CA-O 3.39Å; G503-L518 PolarHBondContact N-O 2.87Å; G503-L518 PolarHBondContact O-N 2.7Å; L518-V523 HydrophobicContact CD1-CG2 3.63Å; L518-I764 HydrophobicContact CD2-CD1 3.54Å; L518-T766 HydrophobicContact CD2-CG2 4.37Å; L518-F769 HydrophobicContact CD1-CE2 4.36Å; L518-F769 HydrophobicContact CD2-CD2 4.22Å; L518-F769 HydrophobicContact CD2-CE2 4.16Å
519	R	81.1	Confident	88	Confident	131 Å²	131	77.6 Å²	77.6	49%	0.494	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	114.1	172.2	-68.7	-176.4	-175.3	-169.6	-0.4	109	N497 T498 E521 Q522	N497-R519 PolarHBondContact O-NH2 2.9Å; T498-R519 HydrophobicContact CG2-CG 4.4Å; R519-E521 PolarHBondContact O-N 2.85Å; R519-Q522 PolarHBondContact N-O 3.44Å; R519-Q522 PolarHBondContact O-N 3.1Å
520	N	78	Confident	87.6	Confident	94 Å²	94	77.2 Å²	77.2	50%	0.503	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	-105.7	-172.9	-57.4	-27.6	0	0	0	111.7	T768 F769	N520-T768 HydrophobicContact CB-CG2 3.94Å; N520-T768 PolarHBondContact O-OG1 3.44Å; N520-T768 VanDerWaalsContact O-OG1 3.12Å; N520-F769 VanDerWaalsContact O-CE2 3.25Å; N520-F769 WeakPolarHBondContact O-CE2 3.36Å
521	E	78.6	Confident	87.5	Confident	153 Å²	153	74 Å²	74	72%	0.715	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	1.8	175	-61.3	-161.7	164.2	0	0	113.1	R519 F769	R519-E521 PolarHBondContact O-N 2.85Å; E521-F769 HydrophobicContact CG-CZ 4.33Å
522	Q	82.1	Confident	87.4	Confident	136 Å²	136	66.1 Å²	66.1	64%	0.636	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.6	178.4	-66.6	-167.4	-25.2	0	0	111.2	R519	R519-Q522 PolarHBondContact N-O 3.44Å; R519-Q522 PolarHBondContact O-N 3.1Å
523	V	86.1	Confident	87.3	Confident	54 Å²	54	69.7 Å²	69.7	33%	0.327	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.3	178.4	-178	0	0	0	0	108.1	I482 Y516 T517 L518	I482-V523 HydrophobicContact CD1-CG1 4.2Å; I482-V523 HydrophobicContact CD1-CG2 3.78Å; I482-V523 HydrophobicContact CG1-CG2 4.16Å; Y516-V523 HydrophobicContact CD1-CG1 4.07Å; Y516-V523 HydrophobicContact CG-CG1 4.21Å; T517-V523 WeakPolarHBondContact O-CA 3.31Å; L518-V523 HydrophobicContact CD1-CG2 3.63Å
524	E	89.5	Confident	87	Confident	122 Å²	122	74.2 Å²	74.2	57%	0.57	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.1	131	178.9	-67.1	-175.4	164.2	0	0	110.7	Y516 T517	Y516-E524 CarbonylContact C-O 3.57Å; Y516-E524 WeakPolarHBondContact CA-O 3.44Å; T517-E524 PolarHBondContact N-O 3.37Å; T517-E524 PolarHBondContact O-N 2.7Å
525	E	90.8	Very high	86.8	Confident	107 Å²	107	71.5 Å²	71.5	50%	0.5	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	130	174.3	-170.8	170.1	-177.7	0	0	109.9	K514 Y516	K514-E525 WeakPolarHBondContact CD-OE1 3.43Å; K514-E525 WeakPolarHBondContact CE-OE1 3.45Å; K514-E525 IonicContact NZ-OE1 3.39Å; K514-E525 PolarHBondContact NZ-OE1 3.31Å; K514-E525 IonicContact NZ-OE2 3.38Å; Y516-E525 HydrophobicContact CD1-CB 3.83Å; Y516-E525 HydrophobicContact CD1-CG 4.27Å; Y516-E525 HydrophobicContact CE1-CB 3.79Å; Y516-E525 HydrophobicContact CE1-CG 3.96Å
526	V	89.9	Confident	86.9	Confident	56 Å²	56	73.8 Å²	73.8	34%	0.339	38%	0.384	S	S	.	.			trans	-135.5	134.6	-179.2	170.8	0	0	0	0	108.6	T515 T517 I528	T515-V526 VanDerWaalsContact CB-O 3.28Å; T515-V526 WeakPolarHBondContact CB-O 3.44Å; T515-V526 PolarHBondContact O-N 3.43Å; T515-V526 VanDerWaalsContact O-O 3.05Å; T515-V526 PolarHBondContact OG1-O 2.93Å; T517-V526 WeakPolarHBondContact OG1-CG2 3.41Å; V526-I528 HydrophobicContact CG1-CG1 4.44Å
527	E	87.2	Confident	87	Confident	168 Å²	168	72.9 Å²	72.9	79%	0.785	38%	0.38	S	S	*	.			trans	-90.3	126.6	172.6	-70.9	-175.4	165.2	0	0	110.5
528	I	85.5	Confident	87.1	Confident	13 Å²	13	75.3 Å²	75.3	7%	0.067	39%	0.387	C	S	.	.			trans	-108.2	118.9	174.8	-64.2	174.4	0	0	0	108.1	Y495 L504 V526 T530 I531	Y495-I528 HydrophobicContact CE1-CD1 4.37Å; Y495-I528 HydrophobicContact CE2-CD1 4.27Å; L504-I528 HydrophobicContact CD1-CD1 3.64Å; L504-I528 HydrophobicContact CD2-CD1 3.39Å; L504-I528 HydrophobicContact CG-CD1 4.17Å; V526-I528 HydrophobicContact CG1-CG1 4.44Å; I528-T530 WeakPolarHBondContact CG2-OG1 3.27Å; I528-T530 PolarHBondContact O-N 3.13Å; I528-T530 VanDerWaalsContact O-N 3.1Å; I528-I531 HydrophobicContact CB-CB 4.32Å; I528-I531 HydrophobicContact CB-CD1 4.16Å; I528-I531 HydrophobicContact CB-CG1 4.16Å; I528-I531 HydrophobicContact CD1-CD1 4.05Å; I528-I531 HydrophobicContact CG2-CD1 4.16Å; I528-I531 HydrophobicContact CG2-CG1 3.96Å; I528-I531 PolarHBondContact O-N 3.47Å; I528-I531 VanDerWaalsContact O-O 3.13Å
529	P	83.7	Confident	87.5	Confident	133 Å²	133	75.9 Å²	75.9	86%	0.864	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-30.1	-172.9	-26	33	0	0	0	115.1	I531	P529-I531 VanDerWaalsContact C-N 3.32Å
530	T	86.3	Confident	88.1	Confident	33 Å²	33	69.7 Å²	69.7	20%	0.202	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-8.7	-179.4	47.2	0	0	0	0	113.6	I528 P532 M562 G568 L570	I528-T530 WeakPolarHBondContact CG2-OG1 3.27Å; I528-T530 PolarHBondContact O-N 3.13Å; I528-T530 VanDerWaalsContact O-N 3.1Å; T530-P532 WeakPolarHBondContact O-CD 3.29Å; T530-M562 PolarHBondContact OG1-SD 3.47Å; T530-G568 WeakPolarHBondContact CB-O 3.28Å; T530-G568 WeakPolarHBondContact CG2-O 3.46Å; T530-G568 PolarHBondContact OG1-O 3.26Å; T530-L570 HydrophobicContact CG2-CB 3.9Å
531	I	88.7	Confident	88.7	Confident	12 Å²	12	67.9 Å²	67.9	6%	0.062	36%	0.356	C	S	.	.	S	Bend	trans	-108.2	101.4	176.1	-55.3	-176.9	0	0	0	108.2	L504 I506 T513 T515 I528 P529 S533 L551 L553 M562	L504-I531 HydrophobicContact CD2-CD1 4.21Å; I506-I531 HydrophobicContact CD1-CD1 4.13Å; I506-I531 HydrophobicContact CG1-CD1 4.45Å; T513-I531 HydrophobicContact CG2-CG2 4.03Å; T515-I531 HydrophobicContact CG2-CD1 3.97Å; T515-I531 HydrophobicContact CG2-CG2 4.24Å; I528-I531 HydrophobicContact CB-CB 4.32Å; I528-I531 HydrophobicContact CB-CD1 4.16Å; I528-I531 HydrophobicContact CB-CG1 4.16Å; I528-I531 HydrophobicContact CD1-CD1 4.05Å; I528-I531 HydrophobicContact CG2-CD1 4.16Å; I528-I531 HydrophobicContact CG2-CG1 3.96Å; I528-I531 PolarHBondContact O-N 3.47Å; I528-I531 VanDerWaalsContact O-O 3.13Å; P529-I531 VanDerWaalsContact C-N 3.32Å; I531-S533 PolarHBondContact O-N 2.88Å; I531-L551 HydrophobicContact CD1-CD2 4.39Å; I531-L553 HydrophobicContact CB-CD2 4.41Å; I531-L553 HydrophobicContact CG1-CD2 4.15Å; I531-L553 HydrophobicContact CG2-CD2 4.05Å; I531-M562 HydrophobicContact CG1-CE 4.23Å; I531-M562 HydrophobicContact CG1-SD 4.07Å
532	P	87	Confident	89.2	Confident	24 Å²	24	62.8 Å²	62.8	16%	0.156	33%	0.334	C	S	.	.			trans	-68.2	129.3	-176.7	24.1	-31	0	0	0	111.7	T530 C534 E535 T555 R560	T530-P532 WeakPolarHBondContact O-CD 3.29Å; P532-C534 VanDerWaalsContact C-N 3.33Å; P532-C534 PolarHBondContact O-N 3.43Å; P532-E535 HydrophobicContact CB-CB 4.29Å; P532-E535 HydrophobicContact CB-CG 3.98Å; P532-E535 HydrophobicContact CG-CB 3.94Å; P532-E535 HydrophobicContact CG-CG 3.84Å; P532-E535 VanDerWaalsContact CG-OE2 3.22Å; P532-E535 WeakPolarHBondContact CG-OE2 3.26Å; P532-T555 HydrophobicContact CG-CG2 4.33Å; P532-R560 VanDerWaalsContact CG-NH1 3.26Å
533	S	89.1	Confident	89.4	Confident	81 Å²	81	57.3 Å²	57.3	57%	0.566	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-21.5	-179.7	57	0	0	0	0	113.7	G512 T513 I531	G512-S533 CarbonylContact C-O 3.18Å; G512-S533 WeakPolarHBondContact CA-O 3.38Å; T513-S533 PolarHBondContact N-O 3.38Å; T513-S533 VanDerWaalsContact O-CA 3.31Å; T513-S533 WeakPolarHBondContact O-CA 3.42Å; I531-S533 PolarHBondContact O-N 2.88Å
534	C	90	Very high	89.3	Confident	101 Å²	101	60.9 Å²	60.9	68%	0.682	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-14.3	-179.6	53.1	0	0	0	0	114.3	P532	P532-C534 VanDerWaalsContact C-N 3.33Å; P532-C534 PolarHBondContact O-N 3.43Å
535	E	90.7	Very high	88.6	Confident	26 Å²	26	56.7 Å²	56.7	12%	0.121	30%	0.304	C	S	.	.	S	Bend	trans	-96.6	140.2	178.2	-58.9	173	-160.5	0	0	109.4	G512 T513 P532 T555 R560	G512-E535 CarbonylContact C-O 3.55Å; T513-E535 PolarHBondContact N-O 3.15Å; T513-E535 PolarHBondContact OG1-O 3.15Å; P532-E535 HydrophobicContact CB-CB 4.29Å; P532-E535 HydrophobicContact CB-CG 3.98Å; P532-E535 HydrophobicContact CG-CB 3.94Å; P532-E535 HydrophobicContact CG-CG 3.84Å; P532-E535 VanDerWaalsContact CG-OE2 3.22Å; P532-E535 WeakPolarHBondContact CG-OE2 3.26Å; E535-T555 HydrophobicContact CB-CG2 4.24Å; E535-T555 WeakPolarHBondContact OE2-CB 3.48Å; E535-T555 WeakPolarHBondContact OE2-CG2 3.44Å; E535-T555 PolarHBondContact OE2-OG1 3.24Å; E535-R560 IonicContact OE1-CZ 3.04Å; E535-R560 IonicContact OE1-NH2 3.55Å; E535-R560 PolarHBondContact OE1-NH2 3.08Å; E535-R560 IonicContact OE2-CZ 3.91Å; E535-R560 IonicContact OE2-NH1 3.55Å; E535-R560 PolarHBondContact OE2-NH1 3.47Å; E535-R560 IonicContact OE2-NH2 3.91Å; E535-R560 PolarHBondContact OE2-NH2 2.79Å; E535-R560 VanDerWaalsContact OE2-NH2 3.16Å
536	R	93.1	Very high	87.5	Confident	56 Å²	56	58.3 Å²	58.3	21%	0.211	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-76.4	130.9	172.5	172	-177.8	176.7	-176	-4.9	108.8	S508 F509 T555 T556	S508-R536 VanDerWaalsContact OG-CG 3.3Å; S508-R536 WeakPolarHBondContact OG-CG 3.35Å; F509-R536 WeakPolarHBondContact O-CG 3.46Å; R536-T555 CarbonylContact O-C 3.53Å; R536-T555 VanDerWaalsContact O-CA 3.26Å; R536-T555 WeakPolarHBondContact O-CA 3.5Å; R536-T556 HydrophobicContact CB-CG2 3.75Å; R536-T556 HydrophobicContact CG-CG2 4.49Å; R536-T556 PolarHBondContact O-N 3.41Å
537	T	94.6	Very high	86.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	131	172.5	-61.8	0	0	0	0	110.2	W491 I506 S508 T513 A540 L553	W491-T537 HydrophobicContact CE3-CG2 4.22Å; W491-T537 HydrophobicContact CH2-CG2 3.84Å; W491-T537 WeakPolarHBondContact CH2-O 2.91Å; W491-T537 HydrophobicContact CZ3-CG2 3.61Å; I506-T537 HydrophobicContact CG2-CG2 4.42Å; S508-T537 WeakPolarHBondContact CB-O 3.24Å; S508-T537 PolarHBondContact OG-N 2.97Å; S508-T537 PolarHBondContact OG-O 2.78Å; T513-T537 WeakPolarHBondContact CG2-OG1 3.12Å; T513-T537 PolarHBondContact OG1-N 3.43Å; T513-T537 VanDerWaalsContact OG1-N 3.11Å; T513-T537 PolarHBondContact OG1-OG1 2.92Å; T537-A540 HydrophobicContact CG2-CB 4.29Å; T537-L553 HydrophobicContact CG2-CD1 3.43Å; T537-L553 VanDerWaalsContact CG2-CD1 3.43Å; T537-L553 HydrophobicContact CG2-CG 4.48Å
538	W	92	Very high	86	Confident	72 Å²	72	56.5 Å²	56.5	27%	0.273	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-35.2	173.7	-79.3	118.2	0	0	0	112.8	W491 V554 I582 T585	W491-W538 VanDerWaalsContact CZ2-O 3.25Å; W491-W538 WeakPolarHBondContact CZ2-O 3.15Å; W538-V554 HydrophobicContact CB-CG1 4.48Å; W538-V554 PolarHBondContact N-O 3.21Å; W538-I582 PolarHBondContact NE1-O 3.4Å; W538-T585 HydrophobicContact CB-CG2 3.68Å
539	L	93.7	Very high	85.7	Confident	21 Å²	21	57.7 Å²	57.7	11%	0.11	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	134.9	-179.6	-177.5	128.3	0	0	0	110.3	M541 I552 L553 V554 T585 F587	L539-M541 HydrophobicContact CD2-CB 4.46Å; L539-I552 HydrophobicContact CD2-CG2 4.26Å; L539-L553 CarbonylContact O-C 3.54Å; L539-L553 WeakPolarHBondContact O-CA 3.41Å; L539-V554 HydrophobicContact CB-CB 4.08Å; L539-V554 HydrophobicContact CB-CG2 4.16Å; L539-V554 HydrophobicContact CD2-CG2 4.11Å; L539-V554 PolarHBondContact N-O 2.93Å; L539-V554 PolarHBondContact O-N 3.41Å; L539-T585 HydrophobicContact CB-CG2 4Å; L539-F587 HydrophobicContact CD1-CB 3.79Å; L539-F587 HydrophobicContact CD2-CB 3.76Å; L539-F587 HydrophobicContact CD2-CD1 4.39Å; L539-F587 HydrophobicContact CD2-CG 4.25Å; L539-F587 HydrophobicContact CG-CB 4.45Å
540	A	93.6	Very high	85.8	Confident	2 Å²	2	51.4 Å²	51.4	2%	0.017	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	124.9	168.5	0	0	0	0	0	109.4	W491 I506 T537 I552 L553	W491-A540 HydrophobicContact CB-CB 4.01Å; W491-A540 HydrophobicContact CD2-CB 3.97Å; W491-A540 HydrophobicContact CE3-CB 4.16Å; W491-A540 HydrophobicContact CG-CB 3.91Å; I506-A540 HydrophobicContact CB-CB 4.5Å; I506-A540 HydrophobicContact CD1-CB 3.76Å; I506-A540 HydrophobicContact CG2-CB 4.49Å; T537-A540 HydrophobicContact CG2-CB 4.29Å; A540-I552 WeakPolarHBondContact CA-O 3.38Å; A540-L553 HydrophobicContact CB-CD1 3.95Å
541	M	90.6	Very high	86	Confident	56 Å²	56	49.9 Å²	49.9	28%	0.276	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	140.3	-177.6	-160.2	102.8	77	0	0	111.4	L539 I552 F587	L539-M541 HydrophobicContact CD2-CB 4.46Å; M541-I552 PolarHBondContact N-O 3.23Å; M541-I552 PolarHBondContact O-N 3.06Å; M541-F587 HydrophobicContact CB-CD1 3.98Å; M541-F587 HydrophobicContact CB-CE1 4.1Å; M541-F587 HydrophobicContact CE-CD1 3.87Å; M541-F587 HydrophobicContact CG-CD1 4.12Å; M541-F587 HydrophobicContact CG-CE1 4.1Å
542	N	88.2	Confident	86.2	Confident	46 Å²	46	49.3 Å²	49.3	25%	0.246	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	138.8	164.7	-67.6	103.4	0	0	0	110	V493 H494 G550	V493-N542 WeakPolarHBondContact CA-OD1 3.32Å; V493-N542 VanDerWaalsContact CB-OD1 3.31Å; V493-N542 WeakPolarHBondContact CB-OD1 3.34Å; H494-N542 PolarHBondContact N-OD1 3.18Å; H494-N542 PolarHBondContact O-ND2 3.26Å; N542-G550 CarbonylContact C-O 3.43Å; N542-G550 VanDerWaalsContact CA-O 3.29Å; N542-G550 WeakPolarHBondContact CA-O 3.38Å
543	Y	87.5	Confident	86.6	Confident	20 Å²	20	48.1 Å²	48.1	8%	0.078	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.8	172.6	175.2	-124	0	0	0	108.7	C545 W548 S549 G550 F587 C607	Y543-C545 HydrophobicContact CD1-CB 4.45Å; Y543-C545 HydrophobicContact CE1-CB 3.67Å; Y543-C545 HydrophobicContact CE2-CB 4.37Å; Y543-W548 HydrophobicContact CD1-CZ3 4Å; Y543-S549 WeakPolarHBondContact O-CA 3.44Å; Y543-G550 PolarHBondContact N-O 3.39Å; Y543-G550 PolarHBondContact O-N 3.32Å; Y543-F587 AromaticContact CD2-CZ 3.77Å; Y543-F587 HydrophobicContact CD2-CZ 3.77Å; Y543-F587 HydrophobicContact CG-CZ 4.03Å; Y543-C607 HydrophobicContact CD1-CB 3.93Å; Y543-C607 HydrophobicContact CE1-CB 3.38Å; Y543-C607 PolarHBondContact OH-O 2.87Å
544	H	82.8	Confident	86.9	Confident	130 Å²	130	44.3 Å²	44.3	60%	0.602	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	117.7	-179	-157.5	-1.5	0	0	0	109.4	W548 S549	H544-W548 WeakPolarHBondContact CA-O 3.22Å; H544-W548 VanDerWaalsContact ND1-C 3.32Å; H544-W548 PolarHBondContact ND1-O 2.93Å; H544-S549 PolarHBondContact CE1-OG 3.4Å; H544-S549 PolarHBondContact ND1-OG 3.38Å; H544-S549 PolarHBondContact NE2-OG 3.02Å
545	C	75.5	Confident	87.1	Confident	33 Å²	33	39.5 Å²	39.5	22%	0.223	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	132	179.5	176.3	0	0	0	0	109.6	Y543 D547 W548	Y543-C545 HydrophobicContact CD1-CB 4.45Å; Y543-C545 HydrophobicContact CE1-CB 3.67Å; Y543-C545 HydrophobicContact CE2-CB 4.37Å; C545-D547 PolarHBondContact O-N 2.91Å; C545-W548 PolarHBondContact N-O 3.23Å; C545-W548 PolarHBondContact O-N 3.09Å
546	N	67.5	Low	87.1	Confident	141 Å²	141	39.7 Å²	39.7	75%	0.754	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	39.7	63.6	170.5	-63	-27.1	0	0	0	114.1	W548	N546-W548 PolarHBondContact O-N 2.6Å
547	D	70.2	Confident	86.9	Confident	167 Å²	167	39.3 Å²	39.3	89%	0.893	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.4	2.7	-179.3	-55.7	-34.1	0	0	0	116.8	C545	C545-D547 PolarHBondContact O-N 2.91Å
548	W	76.2	Confident	86.8	Confident	19 Å²	19	43.9 Å²	43.9	7%	0.072	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.7	176.9	175.8	75.7	0	0	0	112	Y543 H544 C545 N546 M561 M562 D563 L571 R610	Y543-W548 HydrophobicContact CD1-CZ3 4Å; H544-W548 WeakPolarHBondContact CA-O 3.22Å; H544-W548 VanDerWaalsContact ND1-C 3.32Å; H544-W548 PolarHBondContact ND1-O 2.93Å; C545-W548 PolarHBondContact N-O 3.23Å; C545-W548 PolarHBondContact O-N 3.09Å; N546-W548 PolarHBondContact O-N 2.6Å; W548-M561 HydrophobicContact CH2-CG 3.61Å; W548-M561 HydrophobicContact CH2-SD 3.66Å; W548-M561 HydrophobicContact CZ2-CG 4.45Å; W548-M561 HydrophobicContact CZ3-CG 4.44Å; W548-M561 HydrophobicContact CZ3-SD 3.91Å; W548-M562 WeakPolarHBondContact CZ2-O 3.16Å; W548-D563 VanDerWaalsContact NE1-CG 3.3Å; W548-D563 PolarHBondContact NE1-OD1 2.97Å; W548-D563 PolarHBondContact NE1-OD2 3.03Å; W548-L571 HydrophobicContact CH2-CD1 3.75Å; W548-L571 HydrophobicContact CZ2-CD1 3.09Å; W548-R610 HydrophobicContact CD2-CG 4.42Å
549	S	79.2	Confident	86.9	Confident	39 Å²	39	40.4 Å²	40.4	27%	0.273	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.2	172.9	-53.6	0	0	0	0	110.1	Y543 H544	Y543-S549 WeakPolarHBondContact O-CA 3.44Å; H544-S549 PolarHBondContact CE1-OG 3.4Å; H544-S549 PolarHBondContact ND1-OG 3.38Å; H544-S549 PolarHBondContact NE2-OG 3.02Å
550	G	86	Confident	86.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	174	178.9	0	0	0	0	0	114.2	N542 Y543 M562	N542-G550 CarbonylContact C-O 3.43Å; N542-G550 VanDerWaalsContact CA-O 3.29Å; N542-G550 WeakPolarHBondContact CA-O 3.38Å; Y543-G550 PolarHBondContact N-O 3.39Å; Y543-G550 PolarHBondContact O-N 3.32Å; G550-M562 CarbonylContact C-O 3.53Å; G550-M562 VanDerWaalsContact CA-O 3.24Å; G550-M562 WeakPolarHBondContact CA-O 3.34Å
551	L	89.8	Confident	86.8	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.9	169.1	174.9	66.5	0	0	0	108.2	V493 I506 I531 M562 V564	V493-L551 HydrophobicContact CB-CD1 3.99Å; V493-L551 HydrophobicContact CG1-CD1 3.71Å; V493-L551 HydrophobicContact CG2-CD1 3.98Å; V493-L551 HydrophobicContact CG2-CD2 4.48Å; I506-L551 HydrophobicContact CD1-CD1 4.41Å; I506-L551 HydrophobicContact CD1-CD2 4.05Å; I531-L551 HydrophobicContact CD1-CD2 4.39Å; L551-M562 HydrophobicContact CB-CB 4.32Å; L551-M562 HydrophobicContact CD2-CE 3.71Å; L551-M562 HydrophobicContact CD2-SD 4.43Å; L551-M562 HydrophobicContact CG-CE 4.01Å; L551-M562 PolarHBondContact N-O 3.05Å; L551-M562 PolarHBondContact O-N 3.47Å; L551-V564 HydrophobicContact CB-CG2 3.77Å
552	I	93.5	Very high	86.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.3	168.4	-57.3	-57.7	0	0	0	107.8	L539 A540 M541 M561 F587 I594	L539-I552 HydrophobicContact CD2-CG2 4.26Å; A540-I552 WeakPolarHBondContact CA-O 3.38Å; M541-I552 PolarHBondContact N-O 3.23Å; M541-I552 PolarHBondContact O-N 3.06Å; I552-M561 HydrophobicContact CD1-CB 3.86Å; I552-M561 HydrophobicContact CD1-CG 3.64Å; I552-M561 HydrophobicContact CD1-SD 3.79Å; I552-F587 HydrophobicContact CG1-CE2 4.35Å; I552-F587 HydrophobicContact CG1-CZ 4.08Å; I552-I594 HydrophobicContact CG2-CD1 3.67Å; I552-I594 HydrophobicContact CG2-CG1 4.32Å
553	L	94.3	Very high	86.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	120.3	177.7	-177.3	77.5	0	0	0	109.3	I531 T537 L539 A540 T555 R560 M562	I531-L553 HydrophobicContact CB-CD2 4.41Å; I531-L553 HydrophobicContact CG1-CD2 4.15Å; I531-L553 HydrophobicContact CG2-CD2 4.05Å; T537-L553 HydrophobicContact CG2-CD1 3.43Å; T537-L553 VanDerWaalsContact CG2-CD1 3.43Å; T537-L553 HydrophobicContact CG2-CG 4.48Å; L539-L553 CarbonylContact O-C 3.54Å; L539-L553 WeakPolarHBondContact O-CA 3.41Å; A540-L553 HydrophobicContact CB-CD1 3.95Å; L553-T555 HydrophobicContact CD2-CG2 3.95Å; L553-T555 HydrophobicContact CG-CG2 4.09Å; L553-R560 HydrophobicContact CB-CB 4.42Å; L553-R560 PolarHBondContact N-O 2.99Å; L553-R560 PolarHBondContact O-N 2.89Å; L553-M562 HydrophobicContact CB-CE 3.31Å; L553-M562 HydrophobicContact CD2-CE 3.71Å; L553-M562 HydrophobicContact CG-CE 4.1Å
554	V	95.3	Very high	86.3	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	118.6	171.5	-174	0	0	0	0	107.8	W538 L539 V559 I582 T585 I594	W538-V554 HydrophobicContact CB-CG1 4.48Å; W538-V554 PolarHBondContact N-O 3.21Å; L539-V554 HydrophobicContact CB-CB 4.08Å; L539-V554 HydrophobicContact CB-CG2 4.16Å; L539-V554 HydrophobicContact CD2-CG2 4.11Å; L539-V554 PolarHBondContact N-O 2.93Å; L539-V554 PolarHBondContact O-N 3.41Å; V554-V559 HydrophobicContact CG1-CG2 4.12Å; V554-V559 HydrophobicContact CG2-CG1 4.19Å; V554-V559 HydrophobicContact CG2-CG2 4.19Å; V554-I582 HydrophobicContact CG1-CD1 3.92Å; V554-I582 HydrophobicContact CG1-CG2 4.35Å; V554-T585 HydrophobicContact CB-CG2 4.16Å; V554-T585 HydrophobicContact CG1-CG2 3.91Å; V554-I594 HydrophobicContact CG2-CG2 4.32Å
555	T	94.1	Very high	86	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-178.2	173	66.1	0	0	0	0	110.4	P532 E535 R536 L553 D557 R558 R560	P532-T555 HydrophobicContact CG-CG2 4.33Å; E535-T555 HydrophobicContact CB-CG2 4.24Å; E535-T555 WeakPolarHBondContact OE2-CB 3.48Å; E535-T555 WeakPolarHBondContact OE2-CG2 3.44Å; E535-T555 PolarHBondContact OE2-OG1 3.24Å; R536-T555 CarbonylContact O-C 3.53Å; R536-T555 VanDerWaalsContact O-CA 3.26Å; R536-T555 WeakPolarHBondContact O-CA 3.5Å; L553-T555 HydrophobicContact CD2-CG2 3.95Å; L553-T555 HydrophobicContact CG-CG2 4.09Å; T555-D557 PolarHBondContact O-N 2.82Å; T555-D557 PolarHBondContact OG1-N 3.48Å; T555-R558 PolarHBondContact N-O 2.71Å; T555-R558 PolarHBondContact OG1-N 3.44Å; T555-R558 PolarHBondContact OG1-O 2.91Å; T555-R560 VanDerWaalsContact CG2-NH1 3.31Å; T555-R560 PolarHBondContact OG1-NH1 3.46Å
556	T	91.5	Very high	86.1	Confident	30 Å²	30	38.1 Å²	38.1	18%	0.184	19%	0.194	C	C	.	.	S	Bend	trans	-57.3	-27.3	173.9	47.4	0	0	0	0	112.9	R536 H581 I582	R536-T556 HydrophobicContact CB-CG2 3.75Å; R536-T556 HydrophobicContact CG-CG2 4.49Å; R536-T556 PolarHBondContact O-N 3.41Å; T556-H581 CarbonylContact O-C 3.58Å; T556-H581 VanDerWaalsContact O-CA 3.26Å; T556-H581 WeakPolarHBondContact O-CA 3.38Å; T556-I582 PolarHBondContact O-N 2.89Å
557	D	88.3	Confident	86.4	Confident	49 Å²	49	35.8 Å²	35.8	26%	0.262	18%	0.181	S	C	.	.	S	Bend	trans	-113.8	-31.9	-168.5	-62.2	1.8	0	0	0	112	T555 T580 H581	T555-D557 PolarHBondContact O-N 2.82Å; T555-D557 PolarHBondContact OG1-N 3.48Å; D557-T580 WeakPolarHBondContact CA-O 3.31Å; D557-H581 IonicContact OD1-CE1 3.19Å; D557-H581 PolarHBondContact OD1-CE1 3.5Å; D557-H581 IonicContact OD1-ND1 3.66Å; D557-H581 PolarHBondContact OD1-ND1 3.25Å
558	R	92.1	Very high	86.7	Confident	95 Å²	95	27.9 Å²	27.9	36%	0.358	14%	0.139	S	C	.	.			trans	-144.3	154.1	-168	-49.7	-162.4	179.7	-130.1	-11.4	113.3	T555 E573 W574	T555-R558 PolarHBondContact N-O 2.71Å; T555-R558 PolarHBondContact OG1-N 3.44Å; T555-R558 PolarHBondContact OG1-O 2.91Å; R558-E573 HydrophobicContact CB-CG 4.14Å; R558-E573 WeakPolarHBondContact CD-OE1 3.35Å; R558-E573 VanDerWaalsContact CD-OE2 3.26Å; R558-E573 WeakPolarHBondContact CD-OE2 3.35Å; R558-E573 IonicContact CZ-OE1 2.83Å; R558-E573 IonicContact NE-OE1 2.64Å; R558-E573 IonicContact NH1-OE1 3.57Å; R558-E573 PolarHBondContact NH1-OE1 3.13Å; R558-W574 WeakPolarHBondContact CA-O 3.34Å
559	V	94.7	Very high	87.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	126.9	167	-177.5	0	0	0	0	108.1	V554 E573 W574 I582 I594 V596 L605 L612	V554-V559 HydrophobicContact CG1-CG2 4.12Å; V554-V559 HydrophobicContact CG2-CG1 4.19Å; V554-V559 HydrophobicContact CG2-CG2 4.19Å; V559-E573 CarbonylContact O-C 3.52Å; V559-E573 VanDerWaalsContact O-CA 3.3Å; V559-E573 WeakPolarHBondContact O-CA 3.49Å; V559-W574 HydrophobicContact CB-CB 4.37Å; V559-W574 HydrophobicContact CB-CE3 4.49Å; V559-W574 HydrophobicContact CG2-CE3 4.03Å; V559-W574 PolarHBondContact N-O 2.97Å; V559-W574 PolarHBondContact O-N 2.91Å; V559-I582 HydrophobicContact CG2-CD1 4.21Å; V559-I594 HydrophobicContact CG1-CD1 3.82Å; V559-V596 HydrophobicContact CG2-CG2 3.74Å; V559-L605 HydrophobicContact CB-CD1 4.14Å; V559-L605 HydrophobicContact CG1-CD1 4.11Å; V559-L605 HydrophobicContact CG2-CD1 3.89Å; V559-L612 HydrophobicContact CB-CD1 4.22Å; V559-L612 HydrophobicContact CG1-CD1 3.73Å; V559-L612 HydrophobicContact CG1-CD2 4.29Å; V559-L612 WeakPolarHBondContact O-CD1 3.43Å
560	R	93.8	Very high	87.6	Confident	15 Å²	15	32.7 Å²	32.7	6%	0.057	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.9	-178.4	-65.1	-178.2	-174.5	103.1	-6.6	110.2	P532 E535 L553 T555 M562 L570 E573	P532-R560 VanDerWaalsContact CG-NH1 3.26Å; E535-R560 IonicContact OE1-CZ 3.04Å; E535-R560 IonicContact OE1-NH2 3.55Å; E535-R560 PolarHBondContact OE1-NH2 3.08Å; E535-R560 IonicContact OE2-CZ 3.91Å; E535-R560 IonicContact OE2-NH1 3.55Å; E535-R560 PolarHBondContact OE2-NH1 3.47Å; E535-R560 IonicContact OE2-NH2 3.91Å; E535-R560 PolarHBondContact OE2-NH2 2.79Å; E535-R560 VanDerWaalsContact OE2-NH2 3.16Å; L553-R560 HydrophobicContact CB-CB 4.42Å; L553-R560 PolarHBondContact N-O 2.99Å; L553-R560 PolarHBondContact O-N 2.89Å; T555-R560 VanDerWaalsContact CG2-NH1 3.31Å; T555-R560 PolarHBondContact OG1-NH1 3.46Å; R560-M562 HydrophobicContact CB-CE 4.43Å; R560-L570 HydrophobicContact CB-CD1 3.79Å; R560-L570 HydrophobicContact CG-CD1 3.94Å; R560-E573 HydrophobicContact CG-CG 4.07Å; R560-E573 IonicContact CZ-OE2 2.7Å; R560-E573 IonicContact NE-OE2 2.97Å; R560-E573 PolarHBondContact NE-OE2 3.34Å; R560-E573 IonicContact NH2-OE2 2.6Å
561	M	92.3	Very high	87.8	Confident	1 Å²	1	35 Å²	35	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	125.8	169.4	-178.5	162.7	55.7	0	0	108.7	W548 I552 L571 S572 C607 R610 E611 L612	W548-M561 HydrophobicContact CH2-CG 3.61Å; W548-M561 HydrophobicContact CH2-SD 3.66Å; W548-M561 HydrophobicContact CZ2-CG 4.45Å; W548-M561 HydrophobicContact CZ3-CG 4.44Å; W548-M561 HydrophobicContact CZ3-SD 3.91Å; I552-M561 HydrophobicContact CD1-CB 3.86Å; I552-M561 HydrophobicContact CD1-CG 3.64Å; I552-M561 HydrophobicContact CD1-SD 3.79Å; M561-L571 HydrophobicContact CG-CD1 4.42Å; M561-L571 WeakPolarHBondContact O-CB 3.45Å; M561-L571 PolarHBondContact O-N 2.7Å; M561-S572 PolarHBondContact N-O 3.22Å; M561-S572 PolarHBondContact O-N 2.96Å; M561-C607 HydrophobicContact SD-CB 4.32Å; M561-R610 VanDerWaalsContact CE-CA 3.46Å; M561-R610 WeakPolarHBondContact CE-O 3.37Å; M561-E611 VanDerWaalsContact CE-C 3.45Å; M561-E611 VanDerWaalsContact CE-N 3.26Å; M561-E611 WeakPolarHBondContact CE-O 3.44Å; M561-L612 HydrophobicContact CB-CD1 4.22Å; M561-L612 HydrophobicContact CB-CD2 4.26Å; M561-L612 HydrophobicContact CB-CG 4.14Å; M561-L612 HydrophobicContact CE-CD2 4.42Å; M561-L612 HydrophobicContact CE-CG 4.25Å
562	M	90.4	Very high	87.9	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.8	-173.3	-68.2	172.4	-87.5	0	0	111.3	T530 I531 W548 G550 L551 L553 R560 V564 E569 L570	T530-M562 PolarHBondContact OG1-SD 3.47Å; I531-M562 HydrophobicContact CG1-CE 4.23Å; I531-M562 HydrophobicContact CG1-SD 4.07Å; W548-M562 WeakPolarHBondContact CZ2-O 3.16Å; G550-M562 CarbonylContact C-O 3.53Å; G550-M562 VanDerWaalsContact CA-O 3.24Å; G550-M562 WeakPolarHBondContact CA-O 3.34Å; L551-M562 HydrophobicContact CB-CB 4.32Å; L551-M562 HydrophobicContact CD2-CE 3.71Å; L551-M562 HydrophobicContact CD2-SD 4.43Å; L551-M562 HydrophobicContact CG-CE 4.01Å; L551-M562 PolarHBondContact N-O 3.05Å; L551-M562 PolarHBondContact O-N 3.47Å; L553-M562 HydrophobicContact CB-CE 3.31Å; L553-M562 HydrophobicContact CD2-CE 3.71Å; L553-M562 HydrophobicContact CG-CE 4.1Å; R560-M562 HydrophobicContact CB-CE 4.43Å; M562-V564 PolarHBondContact O-N 2.9Å; M562-E569 CarbonylContact C-O 3.52Å; M562-E569 VanDerWaalsContact CA-O 3.28Å; M562-E569 WeakPolarHBondContact CA-O 3.15Å; M562-L570 HydrophobicContact CG-CD1 4.23Å
563	D	85.9	Confident	87.9	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	114.6	172.3	-163.1	-26.4	0	0	0	110.2	W548 C565 R566 G568 E569 L571	W548-D563 VanDerWaalsContact NE1-CG 3.3Å; W548-D563 PolarHBondContact NE1-OD1 2.97Å; W548-D563 PolarHBondContact NE1-OD2 3.03Å; D563-C565 VanDerWaalsContact C-N 3.29Å; D563-C565 PolarHBondContact O-N 3.38Å; D563-C565 WeakPolarHBondContact OD1-CB 3.3Å; D563-C565 PolarHBondContact OD1-N 3.33Å; D563-R566 HydrophobicContact CB-CB 4.31Å; D563-R566 PolarHBondContact O-N 2.98Å; D563-G568 WeakPolarHBondContact O-CA 3.33Å; D563-G568 PolarHBondContact O-N 2.86Å; D563-E569 HydrophobicContact CB-CB 4.37Å; D563-E569 PolarHBondContact N-O 3.46Å; D563-E569 PolarHBondContact O-N 3.1Å; D563-L571 HydrophobicContact CB-CD1 3.9Å; D563-L571 HydrophobicContact CB-CD2 4.08Å; D563-L571 HydrophobicContact CB-CG 4Å
564	V	79.2	Confident	87.8	Confident	9 Å²	9	41.2 Å²	41.2	6%	0.055	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-70.2	-30.1	-179.6	177.3	0	0	0	0	111.5	H494 Y495 A496 L551 M562 R566	H494-V564 WeakPolarHBondContact O-CG1 3.38Å; Y495-V564 HydrophobicContact CD2-CG1 4.19Å; A496-V564 HydrophobicContact CB-CG1 4.14Å; A496-V564 WeakPolarHBondContact CB-O 3.43Å; A496-V564 VanDerWaalsContact N-CG1 3.32Å; A496-V564 PolarHBondContact N-O 2.87Å; L551-V564 HydrophobicContact CB-CG2 3.77Å; M562-V564 PolarHBondContact O-N 2.9Å; V564-R566 VanDerWaalsContact C-N 3.27Å; V564-R566 PolarHBondContact O-N 3.29Å
565	C	76.9	Confident	87.6	Confident	86 Å²	86	43.3 Å²	43.3	58%	0.581	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-75	-17.3	-177	-63.4	0	0	0	0	113.2	D563	D563-C565 VanDerWaalsContact C-N 3.29Å; D563-C565 PolarHBondContact O-N 3.38Å; D563-C565 WeakPolarHBondContact OD1-CB 3.3Å; D563-C565 PolarHBondContact OD1-N 3.33Å
566	R	76.3	Confident	87.3	Confident	144 Å²	144	44.4 Å²	44.4	54%	0.543	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-120.7	48	-174.3	-62.4	-176.8	175.6	-174.4	0.5	111.8	D563 V564 G568 E569	D563-R566 HydrophobicContact CB-CB 4.31Å; D563-R566 PolarHBondContact O-N 2.98Å; V564-R566 VanDerWaalsContact C-N 3.27Å; V564-R566 PolarHBondContact O-N 3.29Å; R566-G568 PolarHBondContact O-N 2.98Å; R566-G568 VanDerWaalsContact O-N 3.16Å; R566-E569 HydrophobicContact CB-CB 4Å; R566-E569 WeakPolarHBondContact CD-OE2 3.25Å; R566-E569 IonicContact CZ-OE2 2.72Å; R566-E569 IonicContact NE-OE2 3.82Å; R566-E569 IonicContact NH1-OE2 3.87Å; R566-E569 PolarHBondContact NH1-OE2 3.04Å; R566-E569 PolarHBondContact O-N 2.95Å; R566-E569 VanDerWaalsContact O-N 3.12Å
567	D	74.4	Confident	86.7	Confident	91 Å²	91	51.7 Å²	51.7	49%	0.487	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	40.7	178.4	-76.3	-23.4	0	0	0	113.6	Y495 N497 E569	Y495-D567 WeakPolarHBondContact OH-CA 3.47Å; Y495-D567 PolarHBondContact OH-O 2.7Å; N497-D567 VanDerWaalsContact CB-OD1 3.23Å; N497-D567 WeakPolarHBondContact CB-OD1 3.3Å; N497-D567 VanDerWaalsContact ND2-CG 3.32Å; N497-D567 PolarHBondContact ND2-OD1 3.34Å; N497-D567 PolarHBondContact ND2-OD2 3.04Å; D567-E569 VanDerWaalsContact C-N 3.34Å; D567-E569 PolarHBondContact O-N 2.95Å
568	G	75.9	Confident	86.1	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.01	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	28.9	175.7	0	0	0	0	0	113.4	Y495 T530 D563 R566 L570	Y495-G568 WeakPolarHBondContact OH-CA 3.33Å; Y495-G568 PolarHBondContact OH-N 3.43Å; Y495-G568 VanDerWaalsContact OH-N 3.1Å; T530-G568 WeakPolarHBondContact CB-O 3.28Å; T530-G568 WeakPolarHBondContact CG2-O 3.46Å; T530-G568 PolarHBondContact OG1-O 3.26Å; D563-G568 WeakPolarHBondContact O-CA 3.33Å; D563-G568 PolarHBondContact O-N 2.86Å; R566-G568 PolarHBondContact O-N 2.98Å; R566-G568 VanDerWaalsContact O-N 3.16Å; G568-L570 PolarHBondContact O-N 3.11Å
569	E	85.4	Confident	85.1	Confident	88 Å²	88	57 Å²	57	41%	0.411	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.6	126	171.6	-175	179.9	-166.3	0	0	109.9	M562 D563 R566 D567 L571	M562-E569 CarbonylContact C-O 3.52Å; M562-E569 VanDerWaalsContact CA-O 3.28Å; M562-E569 WeakPolarHBondContact CA-O 3.15Å; D563-E569 HydrophobicContact CB-CB 4.37Å; D563-E569 PolarHBondContact N-O 3.46Å; D563-E569 PolarHBondContact O-N 3.1Å; R566-E569 HydrophobicContact CB-CB 4Å; R566-E569 WeakPolarHBondContact CD-OE2 3.25Å; R566-E569 IonicContact CZ-OE2 2.72Å; R566-E569 IonicContact NE-OE2 3.82Å; R566-E569 IonicContact NH1-OE2 3.87Å; R566-E569 PolarHBondContact NH1-OE2 3.04Å; R566-E569 PolarHBondContact O-N 2.95Å; R566-E569 VanDerWaalsContact O-N 3.12Å; D567-E569 VanDerWaalsContact C-N 3.34Å; D567-E569 PolarHBondContact O-N 2.95Å; E569-L571 PolarHBondContact O-N 3.01Å
570	L	89.7	Confident	84.3	Confident	71 Å²	71	61.6 Å²	61.6	37%	0.372	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	117.2	177.8	-178	68.8	0	0	0	109.1	T530 R560 M562 G568 E573	T530-L570 HydrophobicContact CG2-CB 3.9Å; R560-L570 HydrophobicContact CB-CD1 3.79Å; R560-L570 HydrophobicContact CG-CD1 3.94Å; M562-L570 HydrophobicContact CG-CD1 4.23Å; G568-L570 PolarHBondContact O-N 3.11Å; L570-E573 HydrophobicContact CD2-CB 4.35Å
571	L	89.5	Confident	84	Confident	49 Å²	49	66 Å²	66	26%	0.257	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-47.2	179.4	-65.4	173.8	0	0	0	111.7	W548 M561 D563 E569 R610	W548-L571 HydrophobicContact CH2-CD1 3.75Å; W548-L571 HydrophobicContact CZ2-CD1 3.09Å; M561-L571 HydrophobicContact CG-CD1 4.42Å; M561-L571 WeakPolarHBondContact O-CB 3.45Å; M561-L571 PolarHBondContact O-N 2.7Å; D563-L571 HydrophobicContact CB-CD1 3.9Å; D563-L571 HydrophobicContact CB-CD2 4.08Å; D563-L571 HydrophobicContact CB-CG 4Å; E569-L571 PolarHBondContact O-N 3.01Å; L571-R610 HydrophobicContact CD1-CB 4.11Å; L571-R610 HydrophobicContact CD1-CG 4.26Å
572	S	92.3	Very high	83.9	Confident	20 Å²	20	66.1 Å²	66.1	14%	0.14	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	144.3	-177.3	-172.6	0	0	0	0	109.9	M561 L612	M561-S572 PolarHBondContact N-O 3.22Å; M561-S572 PolarHBondContact O-N 2.96Å; S572-L612 PolarHBondContact OG-N 2.79Å
573	E	93	Very high	83.9	Confident	76 Å²	76	69.9 Å²	69.9	36%	0.355	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	138	174.7	-176.7	177.2	86.4	0	0	108.9	R558 V559 R560 L570	R558-E573 HydrophobicContact CB-CG 4.14Å; R558-E573 WeakPolarHBondContact CD-OE1 3.35Å; R558-E573 VanDerWaalsContact CD-OE2 3.26Å; R558-E573 WeakPolarHBondContact CD-OE2 3.35Å; R558-E573 IonicContact CZ-OE1 2.83Å; R558-E573 IonicContact NE-OE1 2.64Å; R558-E573 IonicContact NH1-OE1 3.57Å; R558-E573 PolarHBondContact NH1-OE1 3.13Å; V559-E573 CarbonylContact O-C 3.52Å; V559-E573 VanDerWaalsContact O-CA 3.3Å; V559-E573 WeakPolarHBondContact O-CA 3.49Å; R560-E573 HydrophobicContact CG-CG 4.07Å; R560-E573 IonicContact CZ-OE2 2.7Å; R560-E573 IonicContact NE-OE2 2.97Å; R560-E573 PolarHBondContact NE-OE2 3.34Å; R560-E573 IonicContact NH2-OE2 2.6Å; L570-E573 HydrophobicContact CD2-CB 4.35Å
574	W	93.9	Very high	84.2	Confident	36 Å²	36	70.5 Å²	70.5	14%	0.136	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	140.1	175.3	-177.9	94	0	0	0	110.5	R558 V559 V596 Y598 F603 L605 L612 L614	R558-W574 WeakPolarHBondContact CA-O 3.34Å; V559-W574 HydrophobicContact CB-CB 4.37Å; V559-W574 HydrophobicContact CB-CE3 4.49Å; V559-W574 HydrophobicContact CG2-CE3 4.03Å; V559-W574 PolarHBondContact N-O 2.97Å; V559-W574 PolarHBondContact O-N 2.91Å; W574-V596 HydrophobicContact CZ3-CB 4.27Å; W574-V596 HydrophobicContact CZ3-CG1 4.15Å; W574-V596 HydrophobicContact CZ3-CG2 4.31Å; W574-Y598 HydrophobicContact CH2-CE2 4.01Å; W574-Y598 HydrophobicContact CZ3-CE2 4.09Å; W574-F603 HydrophobicContact CH2-CB 3.87Å; W574-F603 HydrophobicContact CH2-CD1 4.23Å; W574-F603 HydrophobicContact CH2-CD2 4.14Å; W574-F603 AromaticContact CH2-CG 3.82Å; W574-F603 HydrophobicContact CH2-CG 3.82Å; W574-F603 HydrophobicContact CZ2-CB 4.15Å; W574-F603 HydrophobicContact CZ2-CD1 4.05Å; W574-F603 HydrophobicContact CZ2-CG 4.07Å; W574-L605 HydrophobicContact CB-CD1 4.31Å; W574-L605 HydrophobicContact CD2-CD1 3.81Å; W574-L605 HydrophobicContact CD2-CD2 3.67Å; W574-L605 HydrophobicContact CD2-CG 4.34Å; W574-L605 HydrophobicContact CE3-CD1 3.76Å; W574-L605 HydrophobicContact CE3-CD2 4.35Å; W574-L605 HydrophobicContact CG-CD1 4.06Å; W574-L605 HydrophobicContact CG-CD2 3.75Å; W574-L605 HydrophobicContact CZ2-CD2 4.15Å; W574-L605 HydrophobicContact CZ3-CD1 4.36Å; W574-L612 HydrophobicContact CB-CB 4.22Å; W574-L612 HydrophobicContact CB-CD1 4.11Å; W574-L614 HydrophobicContact CZ2-CD1 4.42Å
575	S	91	Very high	84.9	Confident	44 Å²	44	71.1 Å²	71.1	31%	0.308	36%	0.362	S	S	.	.			trans	-152.5	146.4	173.2	60.5	0	0	0	0	109.6
576	S	86.9	Confident	85.7	Confident	22 Å²	22	67.3 Å²	67.3	15%	0.154	34%	0.336	C	S	.	.			trans	-68.7	143.5	171.3	-179.7	0	0	0	0	111.5	E578	S576-E578 PolarHBondContact OG-N 2.76Å
577	L	79	Confident	86.4	Confident	184 Å²	184	61.1 Å²	61.1	96%	0.963	31%	0.313	S	S	*	.	S	Bend	trans	-76	-26.7	175.1	-74.3	163.2	0	0	0	112.4
578	E	76	Confident	87.2	Confident	167 Å²	167	57 Å²	57	78%	0.78	29%	0.292	S	S	*	.	S	Bend	trans	-99.1	-24.7	-171.5	-62.7	-169.4	169	0	0	113.2	S576	S576-E578 PolarHBondContact OG-N 2.76Å
579	R	71.2	Confident	87.6	Confident	89 Å²	89	59.1 Å²	59.1	34%	0.336	31%	0.309	S	S	.	.			trans	-132.2	137.3	-171.9	-61.5	-166.8	-176.1	-141.8	5.9	111.6	Y598	R579-Y598 HydrophobicContact CB-CD1 3.42Å; R579-Y598 VanDerWaalsContact CB-CD1 3.42Å; R579-Y598 HydrophobicContact CB-CE1 3.86Å; R579-Y598 HydrophobicContact CB-CG 3.89Å; R579-Y598 HydrophobicContact CG-CD1 4.46Å; R579-Y598 PolarHBondContact NH1-O 2.92Å
580	T	77.3	Confident	87.5	Confident	95 Å²	95	60.9 Å²	60.9	58%	0.583	32%	0.322	S	S	*	.			trans	-99.9	-20.7	-168.4	57	0	0	0	0	114.5	D557	D557-T580 WeakPolarHBondContact CA-O 3.31Å
581	H	87.2	Confident	87.4	Confident	109 Å²	109	59.4 Å²	59.4	51%	0.505	32%	0.316	S	S	.	.			trans	-129.1	115.8	-172.6	-60.7	-52.9	0	0	0	112.9	T556 D557 Y598	T556-H581 CarbonylContact O-C 3.58Å; T556-H581 VanDerWaalsContact O-CA 3.26Å; T556-H581 WeakPolarHBondContact O-CA 3.38Å; D557-H581 IonicContact OD1-CE1 3.19Å; D557-H581 PolarHBondContact OD1-CE1 3.5Å; D557-H581 IonicContact OD1-ND1 3.66Å; D557-H581 PolarHBondContact OD1-ND1 3.25Å; H581-Y598 VanDerWaalsContact C-CE1 3.47Å; H581-Y598 WeakPolarHBondContact O-CD1 3.42Å
582	I	91.5	Very high	87.3	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.015	30%	0.303	C	S	.	.			trans	-70.3	122.5	173.2	-62.2	171.9	0	0	0	108.6	W538 V554 T556 V559 V596 Y598	W538-I582 PolarHBondContact NE1-O 3.4Å; V554-I582 HydrophobicContact CG1-CD1 3.92Å; V554-I582 HydrophobicContact CG1-CG2 4.35Å; T556-I582 PolarHBondContact O-N 2.89Å; V559-I582 HydrophobicContact CG2-CD1 4.21Å; I582-V596 HydrophobicContact CB-CG1 4.12Å; I582-V596 HydrophobicContact CD1-CG1 3.54Å; I582-V596 HydrophobicContact CG1-CG1 3.53Å; I582-V596 HydrophobicContact CG2-CG1 3.53Å; I582-Y598 HydrophobicContact CG1-CE1 3.78Å; I582-Y598 HydrophobicContact CG1-CE2 4.24Å; I582-Y598 WeakPolarHBondContact CG1-OH 3.24Å
583	D	88.7	Confident	87.4	Confident	79 Å²	79	57.5 Å²	57.5	42%	0.422	30%	0.303	S	S	.	.			trans	-91.5	-42.5	-178.6	-64.2	-50	0	0	0	112	C597 G599	D583-C597 PolarHBondContact N-O 2.9Å; D583-G599 PolarHBondContact OD2-N 2.87Å
584	V	92.3	Very high	87.5	Confident	17 Å²	17	53.9 Å²	53.9	10%	0.103	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	142.2	-175.6	-179.6	0	0	0	0	109.1	C597 I624 A627	V584-C597 HydrophobicContact CB-CB 4.06Å; V584-C597 PolarHBondContact O-N 3.19Å; V584-I624 HydrophobicContact CB-CG2 4.5Å; V584-I624 HydrophobicContact CG1-CG2 4.48Å; V584-I624 HydrophobicContact CG2-CG2 4.4Å; V584-A627 HydrophobicContact CG1-CB 3.68Å
585	T	94.5	Very high	87.5	Confident	23 Å²	23	52.2 Å²	52.2	14%	0.141	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	149	174.1	-175.1	0	0	0	0	111.3	W538 L539 V554 V595	W538-T585 HydrophobicContact CB-CG2 3.68Å; L539-T585 HydrophobicContact CB-CG2 4Å; V554-T585 HydrophobicContact CB-CG2 4.16Å; V554-T585 HydrophobicContact CG1-CG2 3.91Å; T585-V595 CarbonylContact C-O 3.57Å; T585-V595 WeakPolarHBondContact CA-O 3.23Å; T585-V595 WeakPolarHBondContact CB-O 3.26Å; T585-V595 PolarHBondContact OG1-O 3.47Å
586	A	93.5	Very high	87.7	Confident	5 Å²	5	50.1 Å²	50.1	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	152.8	171.4	0	0	0	0	0	109.7	I594 V595 A627 I629	A586-I594 CarbonylContact O-C 3.35Å; A586-I594 WeakPolarHBondContact O-CA 3.46Å; A586-V595 HydrophobicContact CB-CB 4.28Å; A586-V595 PolarHBondContact N-O 3.17Å; A586-V595 PolarHBondContact O-N 3.38Å; A586-A627 HydrophobicContact CB-CB 4.48Å; A586-I629 HydrophobicContact CB-CG1 4.16Å
587	F	92.4	Very high	88.1	Confident	14 Å²	14	49 Å²	49	6%	0.061	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	130.4	-178.9	174.6	-119	0	0	0	110.9	L539 M541 Y543 I552 A589 H593 I594	L539-F587 HydrophobicContact CD1-CB 3.79Å; L539-F587 HydrophobicContact CD2-CB 3.76Å; L539-F587 HydrophobicContact CD2-CD1 4.39Å; L539-F587 HydrophobicContact CD2-CG 4.25Å; L539-F587 HydrophobicContact CG-CB 4.45Å; M541-F587 HydrophobicContact CB-CD1 3.98Å; M541-F587 HydrophobicContact CB-CE1 4.1Å; M541-F587 HydrophobicContact CE-CD1 3.87Å; M541-F587 HydrophobicContact CG-CD1 4.12Å; M541-F587 HydrophobicContact CG-CE1 4.1Å; Y543-F587 AromaticContact CD2-CZ 3.77Å; Y543-F587 HydrophobicContact CD2-CZ 3.77Å; Y543-F587 HydrophobicContact CG-CZ 4.03Å; I552-F587 HydrophobicContact CG1-CE2 4.35Å; I552-F587 HydrophobicContact CG1-CZ 4.08Å; F587-A589 HydrophobicContact CE1-CB 3.91Å; F587-A589 HydrophobicContact CZ-CB 4.47Å; F587-H593 VanDerWaalsContact CD2-O 3.23Å; F587-H593 WeakPolarHBondContact CD2-O 3.49Å; F587-I594 HydrophobicContact CD2-CB 4.36Å; F587-I594 HydrophobicContact CD2-CD1 4.41Å; F587-I594 HydrophobicContact CD2-CG1 3.37Å; F587-I594 HydrophobicContact CE2-CG1 3.84Å; F587-I594 HydrophobicContact CG-CG1 4.35Å
588	S	89.8	Confident	88.7	Confident	6 Å²	6	40.4 Å²	40.4	4%	0.042	21%	0.212	C	C	.	.			trans	-103.3	109.1	172.8	178.9	0	0	0	0	109.5	N590 T591 G592 H593 E637	S588-N590 PolarHBondContact O-N 3.43Å; S588-T591 VanDerWaalsContact CB-OG1 3.26Å; S588-T591 WeakPolarHBondContact CB-OG1 3.3Å; S588-T591 PolarHBondContact OG-OG1 3.42Å; S588-T591 VanDerWaalsContact OG-OG1 3.07Å; S588-G592 WeakPolarHBondContact O-CA 3.16Å; S588-G592 PolarHBondContact O-N 3.03Å; S588-H593 PolarHBondContact N-O 2.9Å; S588-E637 WeakPolarHBondContact CB-OE1 3.21Å; S588-E637 PolarHBondContact OG-OE1 3.49Å
589	A	83.7	Confident	89.4	Confident	45 Å²	45	32.8 Å²	32.8	37%	0.372	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-23.6	-178	0	0	0	0	0	113.1	F587	F587-A589 HydrophobicContact CE1-CB 3.91Å; F587-A589 HydrophobicContact CZ-CB 4.47Å
590	N	84.3	Confident	90.4	Very high	125 Å²	125	29.8 Å²	29.8	67%	0.668	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-40.5	-178.1	-68.3	-15.2	0	0	0	112.1	S588 D631	S588-N590 PolarHBondContact O-N 3.43Å; N590-D631 VanDerWaalsContact CB-OD1 3.27Å; N590-D631 WeakPolarHBondContact CB-OD1 3.37Å; N590-D631 WeakPolarHBondContact CB-OD2 3.36Å; N590-D631 PolarHBondContact ND2-OD1 2.64Å; N590-D631 PolarHBondContact ND2-OD2 2.67Å
591	T	86.7	Confident	91.2	Very high	40 Å²	40	26.7 Å²	26.7	25%	0.245	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-19.5	-180	61.2	0	0	0	0	113	S588 H593 D631 E637	S588-T591 VanDerWaalsContact CB-OG1 3.26Å; S588-T591 WeakPolarHBondContact CB-OG1 3.3Å; S588-T591 PolarHBondContact OG-OG1 3.42Å; S588-T591 VanDerWaalsContact OG-OG1 3.07Å; T591-H593 PolarHBondContact O-N 3.48Å; T591-H593 PolarHBondContact OG1-N 2.83Å; T591-H593 PolarHBondContact OG1-ND1 2.78Å; T591-D631 HydrophobicContact CG2-CB 4.1Å; T591-E637 HydrophobicContact CG2-CG 4.4Å; T591-E637 VanDerWaalsContact CG2-OE1 3.28Å; T591-E637 WeakPolarHBondContact CG2-OE1 3.39Å; T591-E637 PolarHBondContact OG1-OE1 2.72Å
592	G	89	Confident	91.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.126	C	C	.	.			trans	75.3	11.3	-172.6	0	0	0	0	0	113.5	S588 C607	S588-G592 WeakPolarHBondContact O-CA 3.16Å; S588-G592 PolarHBondContact O-N 3.03Å; G592-C607 WeakPolarHBondContact O-CB 3.27Å; G592-C607 PolarHBondContact O-N 2.89Å; G592-C607 PolarHBondContact O-SG 2.8Å
593	H	93.3	Very high	91.6	Very high	28 Å²	28	21.9 Å²	21.9	13%	0.13	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	135.9	178.1	-66.1	155.1	0	0	0	112	F587 S588 T591 L604 L605 I629 E637	F587-H593 VanDerWaalsContact CD2-O 3.23Å; F587-H593 WeakPolarHBondContact CD2-O 3.49Å; S588-H593 PolarHBondContact N-O 2.9Å; T591-H593 PolarHBondContact O-N 3.48Å; T591-H593 PolarHBondContact OG1-N 2.83Å; T591-H593 PolarHBondContact OG1-ND1 2.78Å; H593-L604 HydrophobicContact CB-CD1 4.03Å; H593-L605 CarbonylContact C-O 3.56Å; H593-L605 VanDerWaalsContact CA-O 3.29Å; H593-L605 WeakPolarHBondContact CA-O 3.46Å; H593-I629 HydrophobicContact CB-CD1 3.96Å; H593-I629 VanDerWaalsContact O-CD1 3.3Å; H593-I629 WeakPolarHBondContact O-CD1 2.96Å; H593-E637 IonicContact CE1-OE2 2.82Å; H593-E637 IonicContact CG-OE2 3.61Å; H593-E637 IonicContact ND1-OE2 3.04Å; H593-E637 PolarHBondContact ND1-OE2 3.06Å
594	I	95.1	Very high	92	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.8	174.4	-54.7	160.5	0	0	0	108.2	I552 V554 V559 A586 F587 V596 L604 L605 C607 L612	I552-I594 HydrophobicContact CG2-CD1 3.67Å; I552-I594 HydrophobicContact CG2-CG1 4.32Å; V554-I594 HydrophobicContact CG2-CG2 4.32Å; V559-I594 HydrophobicContact CG1-CD1 3.82Å; A586-I594 CarbonylContact O-C 3.35Å; A586-I594 WeakPolarHBondContact O-CA 3.46Å; F587-I594 HydrophobicContact CD2-CB 4.36Å; F587-I594 HydrophobicContact CD2-CD1 4.41Å; F587-I594 HydrophobicContact CD2-CG1 3.37Å; F587-I594 HydrophobicContact CE2-CG1 3.84Å; F587-I594 HydrophobicContact CG-CG1 4.35Å; I594-V596 HydrophobicContact CG2-CG2 3.9Å; I594-L604 WeakPolarHBondContact O-CA 3.38Å; I594-L605 HydrophobicContact CB-CB 4.22Å; I594-L605 PolarHBondContact N-O 2.86Å; I594-L605 PolarHBondContact O-N 2.88Å; I594-C607 VanDerWaalsContact CD1-SG 3.5Å; I594-L612 HydrophobicContact CD1-CD2 3.82Å
595	V	95	Very high	92.1	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.006	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.5	169.1	168	0	0	0	0	108.9	T585 A586 L602 L604 A627 I629	T585-V595 CarbonylContact C-O 3.57Å; T585-V595 WeakPolarHBondContact CA-O 3.23Å; T585-V595 WeakPolarHBondContact CB-O 3.26Å; T585-V595 PolarHBondContact OG1-O 3.47Å; A586-V595 HydrophobicContact CB-CB 4.28Å; A586-V595 PolarHBondContact N-O 3.17Å; A586-V595 PolarHBondContact O-N 3.38Å; V595-L602 HydrophobicContact CG1-CD1 3.62Å; V595-L602 HydrophobicContact CG1-CD2 4.33Å; V595-L602 HydrophobicContact CG1-CG 3.84Å; V595-L604 HydrophobicContact CG2-CD1 3.67Å; V595-A627 HydrophobicContact CG1-CB 4.38Å; V595-I629 HydrophobicContact CG2-CD1 4.07Å; V595-I629 HydrophobicContact CG2-CG1 4.48Å; V595-I629 HydrophobicContact CG2-CG2 3.75Å
596	V	95.1	Very high	92	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.1	176.3	-164.7	0	0	0	0	108.6	V559 W574 I582 I594 Y598 F603 L605	V559-V596 HydrophobicContact CG2-CG2 3.74Å; W574-V596 HydrophobicContact CZ3-CB 4.27Å; W574-V596 HydrophobicContact CZ3-CG1 4.15Å; W574-V596 HydrophobicContact CZ3-CG2 4.31Å; I582-V596 HydrophobicContact CB-CG1 4.12Å; I582-V596 HydrophobicContact CD1-CG1 3.54Å; I582-V596 HydrophobicContact CG1-CG1 3.53Å; I582-V596 HydrophobicContact CG2-CG1 3.53Å; I594-V596 HydrophobicContact CG2-CG2 3.9Å; V596-Y598 HydrophobicContact CG1-CE2 4.03Å; V596-F603 PolarHBondContact N-O 3.03Å; V596-F603 PolarHBondContact O-N 2.8Å; V596-L605 HydrophobicContact CG2-CD1 3.8Å; V596-L605 HydrophobicContact CG2-CG 4.47Å
597	C	93.9	Very high	91.9	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	140	-177.9	-54.8	0	0	0	0	111.7	D583 V584 Q601 I624	D583-C597 PolarHBondContact N-O 2.9Å; V584-C597 HydrophobicContact CB-CB 4.06Å; V584-C597 PolarHBondContact O-N 3.19Å; C597-Q601 CarbonylContact C-O 3.44Å; C597-Q601 VanDerWaalsContact CA-O 3.24Å; C597-Q601 WeakPolarHBondContact CA-O 3.44Å; C597-I624 HydrophobicContact CB-CB 4.33Å; C597-I624 HydrophobicContact CB-CD1 3.91Å; C597-I624 HydrophobicContact CB-CG2 4.48Å; C597-I624 VanDerWaalsContact SG-CD1 3.54Å
598	Y	92.7	Very high	91.4	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.008	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	100.9	171	-62.7	-95.6	0	0	0	108.9	W574 R579 H581 I582 V596 P600 Q601 F603	W574-Y598 HydrophobicContact CH2-CE2 4.01Å; W574-Y598 HydrophobicContact CZ3-CE2 4.09Å; R579-Y598 HydrophobicContact CB-CD1 3.42Å; R579-Y598 VanDerWaalsContact CB-CD1 3.42Å; R579-Y598 HydrophobicContact CB-CE1 3.86Å; R579-Y598 HydrophobicContact CB-CG 3.89Å; R579-Y598 HydrophobicContact CG-CD1 4.46Å; R579-Y598 PolarHBondContact NH1-O 2.92Å; H581-Y598 VanDerWaalsContact C-CE1 3.47Å; H581-Y598 WeakPolarHBondContact O-CD1 3.42Å; I582-Y598 HydrophobicContact CG1-CE1 3.78Å; I582-Y598 HydrophobicContact CG1-CE2 4.24Å; I582-Y598 WeakPolarHBondContact CG1-OH 3.24Å; V596-Y598 HydrophobicContact CG1-CE2 4.03Å; Y598-P600 WeakPolarHBondContact O-CD 3.35Å; Y598-P600 VanDerWaalsContact O-N 3.16Å; Y598-Q601 PolarHBondContact N-O 2.84Å; Y598-Q601 PolarHBondContact O-N 3.19Å; Y598-Q601 VanDerWaalsContact O-N 3.1Å; Y598-F603 AromaticContact CD2-CD2 3.74Å; Y598-F603 HydrophobicContact CD2-CD2 3.74Å; Y598-F603 AromaticContact CD2-CE2 3.69Å; Y598-F603 HydrophobicContact CD2-CE2 3.69Å; Y598-F603 HydrophobicContact CE2-CD2 4.05Å; Y598-F603 HydrophobicContact CE2-CE2 4.18Å
599	G	90.9	Very high	91	Very high	8 Å²	8	25.9 Å²	25.9	8%	0.082	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	-113.8	-169.3	0	0	0	0	0	111.5	D583 I624	D583-G599 PolarHBondContact OD2-N 2.87Å; G599-I624 PolarHBondContact O-N 3.45Å
600	P	91.9	Very high	91	Very high	25 Å²	25	29.2 Å²	29.2	16%	0.162	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-11.3	-179.8	35.2	-30.4	0	0	0	113.5	Y598 T619 F620 D623	Y598-P600 WeakPolarHBondContact O-CD 3.35Å; Y598-P600 VanDerWaalsContact O-N 3.16Å; P600-T619 HydrophobicContact CB-CG2 4.26Å; P600-T619 HydrophobicContact CG-CG2 4.33Å; P600-F620 WeakPolarHBondContact CB-O 3.38Å; P600-F620 PolarHBondContact O-N 2.79Å; P600-D623 WeakPolarHBondContact CD-OD1 3.32Å
601	Q	92.9	Very high	91.3	Very high	30 Å²	30	28.8 Å²	28.8	14%	0.14	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	130.2	-178	-75.8	178.7	-28	0	0	110.6	C597 Y598 F603 T619	C597-Q601 CarbonylContact C-O 3.44Å; C597-Q601 VanDerWaalsContact CA-O 3.24Å; C597-Q601 WeakPolarHBondContact CA-O 3.44Å; Y598-Q601 PolarHBondContact N-O 2.84Å; Y598-Q601 PolarHBondContact O-N 3.19Å; Y598-Q601 VanDerWaalsContact O-N 3.1Å; Q601-F603 HydrophobicContact CB-CE2 4.03Å; Q601-T619 HydrophobicContact CG-CG2 4.28Å
602	L	94.1	Very high	91.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	128.7	177.1	-175.2	149.7	0	0	0	109.6	V595 E617 N618 F620 I624 V641 F652 M657	V595-L602 HydrophobicContact CG1-CD1 3.62Å; V595-L602 HydrophobicContact CG1-CD2 4.33Å; V595-L602 HydrophobicContact CG1-CG 3.84Å; L602-E617 WeakPolarHBondContact O-CA 3.44Å; L602-N618 PolarHBondContact N-O 2.81Å; L602-N618 PolarHBondContact O-N 2.92Å; L602-F620 HydrophobicContact CB-CD2 4.19Å; L602-F620 HydrophobicContact CB-CE2 3.94Å; L602-F620 HydrophobicContact CD1-CE2 3.85Å; L602-F620 HydrophobicContact CG-CE2 4.43Å; L602-I624 HydrophobicContact CB-CD1 4.1Å; L602-I624 HydrophobicContact CD1-CD1 4.34Å; L602-V641 HydrophobicContact CD1-CG1 3.83Å; L602-F652 HydrophobicContact CD1-CE2 4.39Å; L602-F652 HydrophobicContact CD1-CZ 3.9Å; L602-M657 HydrophobicContact CD2-CE 3.37Å; L602-M657 HydrophobicContact CD2-SD 4Å
603	F	94.6	Very high	91.8	Very high	12 Å²	12	31.2 Å²	31.2	5%	0.053	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.2	173.1	-62.5	-90.5	0	0	0	109.3	W574 V596 Y598 Q601 L614 E617	W574-F603 HydrophobicContact CH2-CB 3.87Å; W574-F603 HydrophobicContact CH2-CD1 4.23Å; W574-F603 HydrophobicContact CH2-CD2 4.14Å; W574-F603 AromaticContact CH2-CG 3.82Å; W574-F603 HydrophobicContact CH2-CG 3.82Å; W574-F603 HydrophobicContact CZ2-CB 4.15Å; W574-F603 HydrophobicContact CZ2-CD1 4.05Å; W574-F603 HydrophobicContact CZ2-CG 4.07Å; V596-F603 PolarHBondContact N-O 3.03Å; V596-F603 PolarHBondContact O-N 2.8Å; Y598-F603 AromaticContact CD2-CD2 3.74Å; Y598-F603 HydrophobicContact CD2-CD2 3.74Å; Y598-F603 AromaticContact CD2-CE2 3.69Å; Y598-F603 HydrophobicContact CD2-CE2 3.69Å; Y598-F603 HydrophobicContact CE2-CD2 4.05Å; Y598-F603 HydrophobicContact CE2-CE2 4.18Å; Q601-F603 HydrophobicContact CB-CE2 4.03Å; F603-L614 HydrophobicContact CB-CD1 3.89Å; F603-L614 HydrophobicContact CD1-CD1 3.86Å; F603-L614 HydrophobicContact CD1-CD2 4.31Å; F603-L614 HydrophobicContact CG-CD1 4.38Å; F603-E617 HydrophobicContact CD1-CB 4.21Å; F603-E617 HydrophobicContact CD1-CG 3.87Å; F603-E617 HydrophobicContact CE1-CB 4.35Å; F603-E617 HydrophobicContact CE1-CG 3.62Å; F603-E617 WeakPolarHBondContact CE1-OE2 3.3Å; F603-E617 HydrophobicContact CZ-CG 4.19Å
604	L	95.3	Very high	91.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	115.6	174.7	-174.8	74.2	0	0	0	109.9	H593 I594 V595 I615 A616 P654 V655 M657	H593-L604 HydrophobicContact CB-CD1 4.03Å; I594-L604 WeakPolarHBondContact O-CA 3.38Å; V595-L604 HydrophobicContact CG2-CD1 3.67Å; L604-I615 PolarHBondContact O-N 3.49Å; L604-A616 HydrophobicContact CB-CB 4.17Å; L604-A616 HydrophobicContact CD2-CB 4.39Å; L604-A616 PolarHBondContact N-O 3Å; L604-A616 PolarHBondContact O-N 3.42Å; L604-P654 HydrophobicContact CD1-CB 4.02Å; L604-P654 HydrophobicContact CD2-CB 3.92Å; L604-P654 WeakPolarHBondContact CD2-O 3.12Å; L604-V655 HydrophobicContact CD2-CG2 4.35Å; L604-M657 HydrophobicContact CB-CE 3.82Å
605	L	94.8	Very high	91.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	149.3	174.1	-51.6	166.2	0	0	0	109.9	V559 W574 H593 I594 V596 L613 L614	V559-L605 HydrophobicContact CB-CD1 4.14Å; V559-L605 HydrophobicContact CG1-CD1 4.11Å; V559-L605 HydrophobicContact CG2-CD1 3.89Å; W574-L605 HydrophobicContact CB-CD1 4.31Å; W574-L605 HydrophobicContact CD2-CD1 3.81Å; W574-L605 HydrophobicContact CD2-CD2 3.67Å; W574-L605 HydrophobicContact CD2-CG 4.34Å; W574-L605 HydrophobicContact CE3-CD1 3.76Å; W574-L605 HydrophobicContact CE3-CD2 4.35Å; W574-L605 HydrophobicContact CG-CD1 4.06Å; W574-L605 HydrophobicContact CG-CD2 3.75Å; W574-L605 HydrophobicContact CZ2-CD2 4.15Å; W574-L605 HydrophobicContact CZ3-CD1 4.36Å; H593-L605 CarbonylContact C-O 3.56Å; H593-L605 VanDerWaalsContact CA-O 3.29Å; H593-L605 WeakPolarHBondContact CA-O 3.46Å; I594-L605 HydrophobicContact CB-CB 4.22Å; I594-L605 PolarHBondContact N-O 2.86Å; I594-L605 PolarHBondContact O-N 2.88Å; V596-L605 HydrophobicContact CG2-CD1 3.8Å; V596-L605 HydrophobicContact CG2-CG 4.47Å; L605-L613 CarbonylContact C-O 3.52Å; L605-L613 WeakPolarHBondContact CA-O 3.5Å; L605-L614 HydrophobicContact CD2-CB 4.05Å; L605-L614 HydrophobicContact CD2-CD1 3.94Å
606	S	93.1	Very high	91.6	Very high	15 Å²	15	38.2 Å²	38.2	11%	0.105	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	141.3	163.7	169.5	0	0	0	0	111.1	D608 L613	S606-D608 PolarHBondContact O-N 2.83Å; S606-L613 PolarHBondContact N-O 3.23Å; S606-L613 PolarHBondContact O-N 2.94Å
607	C	90.2	Very high	91.4	Very high	4 Å²	4	43.3 Å²	43.3	3%	0.027	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	91	169.6	-55.4	0	0	0	0	109	Y543 M561 G592 I594	Y543-C607 HydrophobicContact CD1-CB 3.93Å; Y543-C607 HydrophobicContact CE1-CB 3.38Å; Y543-C607 PolarHBondContact OH-O 2.87Å; M561-C607 HydrophobicContact SD-CB 4.32Å; G592-C607 WeakPolarHBondContact O-CB 3.27Å; G592-C607 PolarHBondContact O-N 2.89Å; G592-C607 PolarHBondContact O-SG 2.8Å; I594-C607 VanDerWaalsContact CD1-SG 3.5Å
608	D	83.3	Confident	91.4	Very high	73 Å²	73	45.8 Å²	45.8	39%	0.39	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.6	-178.4	-154.8	-3.3	0	0	0	110.8	S606 R610 E611 L613	S606-D608 PolarHBondContact O-N 2.83Å; D608-R610 VanDerWaalsContact C-N 3.27Å; D608-R610 PolarHBondContact O-N 2.81Å; D608-E611 PolarHBondContact N-O 2.93Å; D608-E611 VanDerWaalsContact N-O 3.13Å; D608-E611 PolarHBondContact O-N 3.22Å; D608-E611 VanDerWaalsContact O-O 3.09Å; D608-L613 HydrophobicContact CB-CD1 4.05Å
609	N	80.6	Confident	91.5	Very high	136 Å²	136	49.4 Å²	49.4	73%	0.727	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.7	42	178.3	-71.9	-37.5	0	0	0	116.6	E611	N609-E611 PolarHBondContact O-N 2.86Å
610	R	84.7	Confident	91.5	Very high	114 Å²	114	49.7 Å²	49.7	43%	0.43	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	19.5	-178.2	-51.2	178.9	-174.7	-167.4	-1.3	114.7	W548 M561 L571 D608	W548-R610 HydrophobicContact CD2-CG 4.42Å; M561-R610 VanDerWaalsContact CE-CA 3.46Å; M561-R610 WeakPolarHBondContact CE-O 3.37Å; L571-R610 HydrophobicContact CD1-CB 4.11Å; L571-R610 HydrophobicContact CD1-CG 4.26Å; D608-R610 VanDerWaalsContact C-N 3.27Å; D608-R610 PolarHBondContact O-N 2.81Å
611	E	89.9	Confident	91.4	Very high	117 Å²	117	53.1 Å²	53.1	55%	0.547	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	154.6	167.2	-66.3	-172.9	167.2	0	0	111.8	M561 D608 N609	M561-E611 VanDerWaalsContact CE-C 3.45Å; M561-E611 VanDerWaalsContact CE-N 3.26Å; M561-E611 WeakPolarHBondContact CE-O 3.44Å; D608-E611 PolarHBondContact N-O 2.93Å; D608-E611 VanDerWaalsContact N-O 3.13Å; D608-E611 PolarHBondContact O-N 3.22Å; D608-E611 VanDerWaalsContact O-O 3.09Å; N609-E611 PolarHBondContact O-N 2.86Å
612	L	92.3	Very high	91.4	Very high	14 Å²	14	53 Å²	53	7%	0.073	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	110.2	171.2	-67	169.2	0	0	0	108.7	V559 M561 S572 W574 I594	V559-L612 HydrophobicContact CB-CD1 4.22Å; V559-L612 HydrophobicContact CG1-CD1 3.73Å; V559-L612 HydrophobicContact CG1-CD2 4.29Å; V559-L612 WeakPolarHBondContact O-CD1 3.43Å; M561-L612 HydrophobicContact CB-CD1 4.22Å; M561-L612 HydrophobicContact CB-CD2 4.26Å; M561-L612 HydrophobicContact CB-CG 4.14Å; M561-L612 HydrophobicContact CE-CD2 4.42Å; M561-L612 HydrophobicContact CE-CG 4.25Å; S572-L612 PolarHBondContact OG-N 2.79Å; W574-L612 HydrophobicContact CB-CB 4.22Å; W574-L612 HydrophobicContact CB-CD1 4.11Å; I594-L612 HydrophobicContact CD1-CD2 3.82Å
613	L	93.7	Very high	91.3	Very high	77 Å²	77	57 Å²	57	40%	0.403	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.1	-176.8	-62.8	177.2	0	0	0	111	L605 S606 D608 I615	L605-L613 CarbonylContact C-O 3.52Å; L605-L613 WeakPolarHBondContact CA-O 3.5Å; S606-L613 PolarHBondContact N-O 3.23Å; S606-L613 PolarHBondContact O-N 2.94Å; D608-L613 HydrophobicContact CB-CD1 4.05Å; L613-I615 PolarHBondContact O-N 3.44Å
614	L	93.1	Very high	91.3	Very high	81 Å²	81	56.7 Å²	56.7	42%	0.424	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	117.6	170.6	-178.9	69.1	0	0	0	110.2	W574 F603 L605	W574-L614 HydrophobicContact CZ2-CD1 4.42Å; F603-L614 HydrophobicContact CB-CD1 3.89Å; F603-L614 HydrophobicContact CD1-CD1 3.86Å; F603-L614 HydrophobicContact CD1-CD2 4.31Å; F603-L614 HydrophobicContact CG-CD1 4.38Å; L605-L614 HydrophobicContact CD2-CB 4.05Å; L605-L614 HydrophobicContact CD2-CD1 3.94Å
615	I	92.8	Very high	91.3	Very high	78 Å²	78	57.3 Å²	57.3	40%	0.4	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-42.9	-179.7	-56.8	167.9	0	0	0	111.5	L604 L613 V655	L604-I615 PolarHBondContact O-N 3.49Å; L613-I615 PolarHBondContact O-N 3.44Å; I615-V655 HydrophobicContact CG2-CG1 4.48Å
616	A	92.6	Very high	91.3	Very high	17 Å²	17	57.8 Å²	57.8	14%	0.14	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	151.1	-172.5	0	0	0	0	0	111.8	L604 M657	L604-A616 HydrophobicContact CB-CB 4.17Å; L604-A616 HydrophobicContact CD2-CB 4.39Å; L604-A616 PolarHBondContact N-O 3Å; L604-A616 PolarHBondContact O-N 3.42Å; A616-M657 HydrophobicContact CB-CE 3.52Å; A616-M657 HydrophobicContact CB-CG 4.14Å
617	E	92.5	Very high	91.4	Very high	106 Å²	106	57.8 Å²	57.8	50%	0.495	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	138.7	176	-179.1	-178.1	166.3	0	0	108.2	L602 F603	L602-E617 WeakPolarHBondContact O-CA 3.44Å; F603-E617 HydrophobicContact CD1-CB 4.21Å; F603-E617 HydrophobicContact CD1-CG 3.87Å; F603-E617 HydrophobicContact CE1-CB 4.35Å; F603-E617 HydrophobicContact CE1-CG 3.62Å; F603-E617 WeakPolarHBondContact CE1-OE2 3.3Å; F603-E617 HydrophobicContact CZ-CG 4.19Å
618	N	93.7	Very high	91.7	Very high	53 Å²	53	58.5 Å²	58.5	28%	0.283	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.6	174.4	-165.1	17.7	0	0	0	111.1	L602 M657	L602-N618 PolarHBondContact N-O 2.81Å; L602-N618 PolarHBondContact O-N 2.92Å; N618-M657 HydrophobicContact CB-CB 4.21Å; N618-M657 HydrophobicContact CB-CG 3.92Å; N618-M657 HydrophobicContact CB-SD 3.8Å
619	T	93.4	Very high	92.2	Very high	77 Å²	77	55.3 Å²	55.3	47%	0.472	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	120	173.2	-57	0	0	0	0	109.4	P600 Q601	P600-T619 HydrophobicContact CB-CG2 4.26Å; P600-T619 HydrophobicContact CG-CG2 4.33Å; Q601-T619 HydrophobicContact CG-CG2 4.28Å
620	F	91.8	Very high	92.8	Very high	14 Å²	14	50 Å²	50	6%	0.061	27%	0.266	C	S	.	.			trans	-82.5	162	175.5	-75.3	-86	0	0	0	111.6	P600 L602 N622 I624 V641 I650 F652	P600-F620 WeakPolarHBondContact CB-O 3.38Å; P600-F620 PolarHBondContact O-N 2.79Å; L602-F620 HydrophobicContact CB-CD2 4.19Å; L602-F620 HydrophobicContact CB-CE2 3.94Å; L602-F620 HydrophobicContact CD1-CE2 3.85Å; L602-F620 HydrophobicContact CG-CE2 4.43Å; F620-N622 VanDerWaalsContact C-N 3.3Å; F620-N622 PolarHBondContact O-N 2.78Å; F620-I624 HydrophobicContact CD2-CD1 3.86Å; F620-I624 HydrophobicContact CE2-CD1 4.48Å; F620-V641 HydrophobicContact CD1-CG2 4.03Å; F620-V641 HydrophobicContact CE1-CG2 3.63Å; F620-V641 HydrophobicContact CE2-CG2 4.16Å; F620-V641 HydrophobicContact CG-CG2 4.44Å; F620-V641 HydrophobicContact CZ-CG2 3.69Å; F620-I650 HydrophobicContact CD1-CD1 4.11Å; F620-I650 HydrophobicContact CE1-CB 4.38Å; F620-I650 HydrophobicContact CE1-CD1 4.37Å; F620-I650 HydrophobicContact CE1-CG2 4.12Å; F620-F652 HydrophobicContact CZ-CD1 4.32Å; F620-F652 HydrophobicContact CZ-CD2 4.48Å; F620-F652 HydrophobicContact CZ-CG 4.33Å
621	P	89.5	Confident	92.9	Very high	97 Å²	97	46.7 Å²	46.7	63%	0.63	26%	0.256	S	S	*	.	S	Bend	trans	-60.5	-37.3	-178.3	-24	33.1	0	0	0	114.1
622	N	92.5	Very high	92.7	Very high	29 Å²	29	42.2 Å²	42.2	16%	0.155	24%	0.235	C	C	.	.	S	Bend	trans	-128.5	164.5	-175.9	-61.8	-58.7	0	0	0	110.4	F620 Q643 W644	F620-N622 VanDerWaalsContact C-N 3.3Å; F620-N622 PolarHBondContact O-N 2.78Å; N622-Q643 HydrophobicContact CB-CB 4.16Å; N622-Q643 PolarHBondContact ND2-OE1 3.15Å; N622-W644 VanDerWaalsContact CB-O 3.26Å; N622-W644 WeakPolarHBondContact CB-O 3.24Å
623	D	93.1	Very high	91.4	Very high	83 Å²	83	45.5 Å²	45.5	44%	0.444	27%	0.272	S	S	.	.			trans	-58	141.6	174.8	-70.1	-13.9	0	0	0	110.9	P600 W644	P600-D623 WeakPolarHBondContact CD-OD1 3.32Å; D623-W644 HydrophobicContact CB-CB 4.37Å; D623-W644 HydrophobicContact CB-CG 4.35Å; D623-W644 VanDerWaalsContact O-CD1 3.26Å; D623-W644 PolarHBondContact O-N 3.46Å
624	I	95	Very high	89.8	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	128.2	-177.9	-60.8	167.7	0	0	0	109.1	V584 C597 G599 L602 F620 V641 G642	V584-I624 HydrophobicContact CB-CG2 4.5Å; V584-I624 HydrophobicContact CG1-CG2 4.48Å; V584-I624 HydrophobicContact CG2-CG2 4.4Å; C597-I624 HydrophobicContact CB-CB 4.33Å; C597-I624 HydrophobicContact CB-CD1 3.91Å; C597-I624 HydrophobicContact CB-CG2 4.48Å; C597-I624 VanDerWaalsContact SG-CD1 3.54Å; G599-I624 PolarHBondContact O-N 3.45Å; L602-I624 HydrophobicContact CB-CD1 4.1Å; L602-I624 HydrophobicContact CD1-CD1 4.34Å; F620-I624 HydrophobicContact CD2-CD1 3.86Å; F620-I624 HydrophobicContact CE2-CD1 4.48Å; I624-V641 HydrophobicContact CD1-CG1 4.32Å; I624-V641 HydrophobicContact CG2-CB 4.19Å; I624-V641 HydrophobicContact CG2-CG1 4.07Å; I624-G642 CarbonylContact C-O 3.47Å; I624-G642 WeakPolarHBondContact CA-O 3.25Å
625	S	94.8	Very high	88.5	Confident	14 Å²	14	43.3 Å²	43.3	10%	0.098	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-35.4	-179.5	65.9	0	0	0	0	113.3	G642 A669	S625-G642 PolarHBondContact N-O 3.33Å; S625-G642 VanDerWaalsContact OG-C 3.23Å; S625-G642 PolarHBondContact OG-O 3.13Å; S625-A669 VanDerWaalsContact CB-O 3.22Å; S625-A669 WeakPolarHBondContact CB-O 3.43Å; S625-A669 PolarHBondContact OG-O 3.37Å
626	C	94.9	Very high	87.8	Confident	10 Å²	10	44.7 Å²	44.7	7%	0.068	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	156.4	179.3	49.2	0	0	0	0	109.6	V641 G642 A669 L672	C626-V641 WeakPolarHBondContact O-CA 3.3Å; C626-G642 PolarHBondContact O-N 2.89Å; C626-A669 VanDerWaalsContact SG-C 3.58Å; C626-A669 PolarHBondContact SG-O 2.87Å; C626-A669 VanDerWaalsContact SG-O 3.36Å; C626-L672 HydrophobicContact CB-CG 4.42Å
627	A	95.7	Very high	87.7	Confident	14 Å²	14	44.5 Å²	44.5	12%	0.116	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	150.7	-179.3	0	0	0	0	0	110.5	V584 A586 V595 A640 V641	V584-A627 HydrophobicContact CG1-CB 3.68Å; A586-A627 HydrophobicContact CB-CB 4.48Å; V595-A627 HydrophobicContact CG1-CB 4.38Å; A627-A640 VanDerWaalsContact CA-O 3.27Å; A627-A640 WeakPolarHBondContact CA-O 3.12Å; A627-V641 HydrophobicContact CB-CG1 3.93Å
628	D	95.7	Very high	87.7	Confident	19 Å²	19	39.6 Å²	39.6	10%	0.102	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	153.4	167.8	-163	23.4	0	0	0	110.7	G639 A640 L672 Q673 F674	D628-G639 WeakPolarHBondContact O-CA 3.38Å; D628-A640 PolarHBondContact N-O 2.93Å; D628-A640 PolarHBondContact O-N 3.48Å; D628-L672 HydrophobicContact CB-CB 4.12Å; D628-Q673 WeakPolarHBondContact OD2-CA 3.11Å; D628-Q673 PolarHBondContact OD2-NE2 2.84Å; D628-F674 HydrophobicContact CB-CD2 3.99Å; D628-F674 HydrophobicContact CB-CE2 4.39Å; D628-F674 WeakPolarHBondContact O-CE2 3.28Å; D628-F674 PolarHBondContact OD2-N 2.84Å
629	I	94.4	Very high	87.7	Confident	6 Å²	6	37.1 Å²	37.1	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	139.9	177.2	50.8	164.1	0	0	0	109.9	A586 H593 V595 I638 P654	A586-I629 HydrophobicContact CB-CG1 4.16Å; H593-I629 HydrophobicContact CB-CD1 3.96Å; H593-I629 VanDerWaalsContact O-CD1 3.3Å; H593-I629 WeakPolarHBondContact O-CD1 2.96Å; V595-I629 HydrophobicContact CG2-CD1 4.07Å; V595-I629 HydrophobicContact CG2-CG1 4.48Å; V595-I629 HydrophobicContact CG2-CG2 3.75Å; I629-I638 WeakPolarHBondContact CA-O 3.31Å; I629-P654 HydrophobicContact CG2-CG 3.91Å
630	S	92.2	Very high	87.8	Confident	26 Å²	26	33.4 Å²	33.4	18%	0.182	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	148	179.8	-169.1	0	0	0	0	111.9	E637 I638	S630-E637 WeakPolarHBondContact O-CG 3.28Å; S630-I638 PolarHBondContact N-O 2.84Å; S630-I638 PolarHBondContact O-N 3.13Å; S630-I638 VanDerWaalsContact O-N 3.14Å
631	D	88.1	Confident	88	Confident	43 Å²	43	32.8 Å²	32.8	23%	0.23	22%	0.218	C	C	.	.			trans	-103.9	142.2	169.3	69.2	-28.2	0	0	0	111	N590 T591	N590-D631 VanDerWaalsContact CB-OD1 3.27Å; N590-D631 WeakPolarHBondContact CB-OD1 3.37Å; N590-D631 WeakPolarHBondContact CB-OD2 3.36Å; N590-D631 PolarHBondContact ND2-OD1 2.64Å; N590-D631 PolarHBondContact ND2-OD2 2.67Å; T591-D631 HydrophobicContact CG2-CB 4.1Å
632	F	84.2	Confident	88.3	Confident	24 Å²	24	28.1 Å²	28.1	11%	0.105	19%	0.188	C	C	.	.			trans	-119.2	29.5	-178.8	-58.9	-65.4	0	0	0	112.5	G634 F674 L676 P681 L697	F632-G634 VanDerWaalsContact C-N 3.29Å; F632-G634 PolarHBondContact O-N 3.49Å; F632-G634 VanDerWaalsContact O-N 3.16Å; F632-F674 HydrophobicContact CE2-CD1 4.17Å; F632-F674 HydrophobicContact CZ-CB 3.92Å; F632-F674 AromaticContact CZ-CD1 3.82Å; F632-F674 HydrophobicContact CZ-CD1 3.82Å; F632-F674 HydrophobicContact CZ-CG 4.08Å; F632-L676 HydrophobicContact CD1-CB 4Å; F632-L676 HydrophobicContact CD1-CD1 4.01Å; F632-L676 HydrophobicContact CD1-CG 4.42Å; F632-L676 HydrophobicContact CE1-CB 4.14Å; F632-P681 HydrophobicContact CD1-CB 3.82Å; F632-P681 HydrophobicContact CD2-CB 3.67Å; F632-P681 HydrophobicContact CD2-CG 4.45Å; F632-P681 HydrophobicContact CE1-CB 3.75Å; F632-P681 HydrophobicContact CE2-CB 3.6Å; F632-P681 HydrophobicContact CG-CB 3.76Å; F632-P681 HydrophobicContact CZ-CB 3.62Å; F632-L697 HydrophobicContact CE2-CD1 4.25Å
633	G	66.6	Low	88.3	Confident	82 Å²	82	26.8 Å²	26.8	85%	0.845	18%	0.18	S	C	*	.	S	Bend	trans	69.7	8.3	168.1	0	0	0	0	0	117.4
634	G	59.2	Low	88.1	Confident	65 Å²	65	27.7 Å²	27.7	67%	0.67	18%	0.178	S	C	*	.	S	Bend	trans	-140.9	-12.8	-175.3	0	0	0	0	0	117.7	F632	F632-G634 VanDerWaalsContact C-N 3.29Å; F632-G634 PolarHBondContact O-N 3.49Å; F632-G634 VanDerWaalsContact O-N 3.16Å
635	T	65.1	Low	87.6	Confident	48 Å²	48	34.6 Å²	34.6	29%	0.294	21%	0.214	S	C	.	.	S	Bend	trans	-154.4	173.9	-178.2	46.2	0	0	0	0	110.6	Q700 Q701	T635-Q700 PolarHBondContact OG1-OE1 3.03Å; T635-Q700 VanDerWaalsContact OG1-OE1 3.08Å; T635-Q701 HydrophobicContact CG2-CG 3.97Å
636	E	79.6	Confident	87.1	Confident	107 Å²	107	39.6 Å²	39.6	50%	0.5	24%	0.236	S	C	.	.	S	Bend	trans	-45.6	147.8	170.7	-72.2	-177.6	-164.4	0	0	112	R653	E636-R653 IonicContact OE1-NH1 3.52Å; E636-R653 PolarHBondContact OE1-NH1 3.1Å; E636-R653 WeakPolarHBondContact OE2-CD 3.28Å; E636-R653 IonicContact OE2-CZ 3.4Å; E636-R653 IonicContact OE2-NE 2.84Å; E636-R653 IonicContact OE2-NH1 2.97Å; E636-R653 PolarHBondContact OE2-NH1 3.37Å
637	E	89.3	Confident	86.9	Confident	13 Å²	13	41.7 Å²	41.7	6%	0.061	25%	0.246	C	C	.	.			trans	-57.4	145.3	178.7	-165.7	174	-132.4	0	0	111.4	S588 T591 H593 S630 P654	S588-E637 WeakPolarHBondContact CB-OE1 3.21Å; S588-E637 PolarHBondContact OG-OE1 3.49Å; T591-E637 HydrophobicContact CG2-CG 4.4Å; T591-E637 VanDerWaalsContact CG2-OE1 3.28Å; T591-E637 WeakPolarHBondContact CG2-OE1 3.39Å; T591-E637 PolarHBondContact OG1-OE1 2.72Å; H593-E637 IonicContact CE1-OE2 2.82Å; H593-E637 IonicContact CG-OE2 3.61Å; H593-E637 IonicContact ND1-OE2 3.04Å; H593-E637 PolarHBondContact ND1-OE2 3.06Å; S630-E637 WeakPolarHBondContact O-CG 3.28Å; E637-P654 HydrophobicContact CB-CG 4.22Å; E637-P654 HydrophobicContact CG-CG 4.07Å; E637-P654 WeakPolarHBondContact O-CD 3.15Å
638	I	92.4	Very high	86.8	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.015	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	138.1	174.8	-83.8	174.2	0	0	0	108.9	I629 S630 L651 L660 F674 L697 Q700	I629-I638 WeakPolarHBondContact CA-O 3.31Å; S630-I638 PolarHBondContact N-O 2.84Å; S630-I638 PolarHBondContact O-N 3.13Å; S630-I638 VanDerWaalsContact O-N 3.14Å; I638-L651 HydrophobicContact CG2-CD2 4.28Å; I638-L660 HydrophobicContact CG1-CD1 4.21Å; I638-F674 HydrophobicContact CG2-CE1 3.86Å; I638-F674 HydrophobicContact CG2-CE2 4.07Å; I638-F674 HydrophobicContact CG2-CZ 3.4Å; I638-L697 HydrophobicContact CD1-CD1 4.25Å; I638-Q700 HydrophobicContact CD1-CB 4.11Å; I638-Q700 WeakPolarHBondContact CD1-O 3.34Å
639	G	94.3	Very high	86.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	152.5	169.7	0	0	0	0	0	112.2	D628 L651 F652	D628-G639 WeakPolarHBondContact O-CA 3.38Å; G639-L651 WeakPolarHBondContact O-CA 3.32Å; G639-F652 PolarHBondContact N-O 3.46Å; G639-F652 VanDerWaalsContact O-CD1 3.3Å; G639-F652 WeakPolarHBondContact O-CD1 3.48Å; G639-F652 PolarHBondContact O-N 2.89Å
640	A	95.6	Very high	86.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.9	170.1	0	0	0	0	0	110	A627 D628 I649 I650 L651 L672 F674 L683	A627-A640 VanDerWaalsContact CA-O 3.27Å; A627-A640 WeakPolarHBondContact CA-O 3.12Å; D628-A640 PolarHBondContact N-O 2.93Å; D628-A640 PolarHBondContact O-N 3.48Å; A640-I649 HydrophobicContact CB-CG2 4.18Å; A640-I650 CarbonylContact C-O 3.56Å; A640-I650 WeakPolarHBondContact CA-O 3.38Å; A640-L651 HydrophobicContact CB-CD2 3.99Å; A640-L672 HydrophobicContact CB-CD1 3.97Å; A640-F674 HydrophobicContact CB-CE2 3.77Å; A640-F674 HydrophobicContact CB-CZ 3.63Å; A640-L683 HydrophobicContact CB-CD1 4.24Å; A640-L683 HydrophobicContact CB-CD2 3.75Å
641	V	96	Very high	86.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.1	171.3	-76.4	0	0	0	0	110.5	L602 F620 I624 C626 A627 I649 I650 F652	L602-V641 HydrophobicContact CD1-CG1 3.83Å; F620-V641 HydrophobicContact CD1-CG2 4.03Å; F620-V641 HydrophobicContact CE1-CG2 3.63Å; F620-V641 HydrophobicContact CE2-CG2 4.16Å; F620-V641 HydrophobicContact CG-CG2 4.44Å; F620-V641 HydrophobicContact CZ-CG2 3.69Å; I624-V641 HydrophobicContact CD1-CG1 4.32Å; I624-V641 HydrophobicContact CG2-CB 4.19Å; I624-V641 HydrophobicContact CG2-CG1 4.07Å; C626-V641 WeakPolarHBondContact O-CA 3.3Å; A627-V641 HydrophobicContact CB-CG1 3.93Å; V641-I649 CarbonylContact O-C 3.13Å; V641-I649 VanDerWaalsContact O-CA 3.31Å; V641-I649 WeakPolarHBondContact O-CA 3.38Å; V641-I650 HydrophobicContact CG2-CB 3.97Å; V641-I650 PolarHBondContact N-O 3.31Å; V641-I650 PolarHBondContact O-N 3.04Å; V641-F652 HydrophobicContact CB-CE1 4.41Å; V641-F652 HydrophobicContact CG1-CE1 3.81Å; V641-F652 HydrophobicContact CG1-CZ 4.27Å; V641-F652 HydrophobicContact CG2-CD1 4.21Å; V641-F652 HydrophobicContact CG2-CE1 4.08Å
642	G	95.4	Very high	87.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	143	169.7	0	0	0	0	0	110.6	I624 S625 C626	I624-G642 CarbonylContact C-O 3.47Å; I624-G642 WeakPolarHBondContact CA-O 3.25Å; S625-G642 PolarHBondContact N-O 3.33Å; S625-G642 VanDerWaalsContact OG-C 3.23Å; S625-G642 PolarHBondContact OG-O 3.13Å; C626-G642 PolarHBondContact O-N 2.89Å
643	Q	92.7	Very high	87.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	145.2	-178.8	-65.3	-168.5	6	0	0	112.6	N622 S648	N622-Q643 HydrophobicContact CB-CB 4.16Å; N622-Q643 PolarHBondContact ND2-OE1 3.15Å; Q643-S648 PolarHBondContact N-O 3.36Å
644	W	90.1	Very high	88.8	Confident	102 Å²	102	34.4 Å²	34.4	39%	0.386	18%	0.183	S	C	.	.	S	Bend	trans	-73.5	158.2	162.2	-68.9	98.2	0	0	0	110.9	N622 D623 E646 V668	N622-W644 VanDerWaalsContact CB-O 3.26Å; N622-W644 WeakPolarHBondContact CB-O 3.24Å; D623-W644 HydrophobicContact CB-CB 4.37Å; D623-W644 HydrophobicContact CB-CG 4.35Å; D623-W644 VanDerWaalsContact O-CD1 3.26Å; D623-W644 PolarHBondContact O-N 3.46Å; W644-E646 PolarHBondContact O-N 2.94Å; W644-V668 HydrophobicContact CD2-CG1 4.15Å; W644-V668 HydrophobicContact CE3-CG1 3.86Å; W644-V668 HydrophobicContact CE3-CG2 4.24Å; W644-V668 HydrophobicContact CZ3-CG1 4.14Å
645	L	84.3	Confident	90.3	Very high	151 Å²	151	35.1 Å²	35.1	79%	0.791	17%	0.173	S	C	*	.	S	Bend	trans	69.5	-43.7	175.5	-58.1	163.2	0	0	0	116.7
646	E	83.6	Confident	91.6	Very high	119 Å²	119	35.9 Å²	35.9	56%	0.556	18%	0.181	S	C	*	.	S	Bend	trans	-91.7	0.4	-177.7	-90.7	-167.3	169.5	0	0	114.5	W644 S648	W644-E646 PolarHBondContact O-N 2.94Å; E646-S648 PolarHBondContact O-N 2.99Å; E646-S648 VanDerWaalsContact O-N 3.11Å
647	D	90.7	Very high	92.1	Very high	53 Å²	53	32.2 Å²	32.2	28%	0.283	16%	0.164	S	C	.	.			trans	43.4	47.4	-177.3	-61.8	-28.7	0	0	0	111.6	T665 V668	D647-T665 WeakPolarHBondContact O-CA 3.41Å; D647-T665 WeakPolarHBondContact O-CB 3.3Å; D647-T665 PolarHBondContact O-N 2.94Å; D647-T665 PolarHBondContact O-OG1 2.83Å; D647-V668 WeakPolarHBondContact OD1-CA 3.12Å; D647-V668 WeakPolarHBondContact OD1-CG2 3.42Å; D647-V668 PolarHBondContact OD1-N 3.31Å
648	S	94.1	Very high	92.2	Very high	6 Å²	6	36.8 Å²	36.8	4%	0.042	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	157.9	-172.2	74	0	0	0	0	112.5	Q643 E646 Y663	Q643-S648 PolarHBondContact N-O 3.36Å; E646-S648 PolarHBondContact O-N 2.99Å; E646-S648 VanDerWaalsContact O-N 3.11Å; S648-Y663 CarbonylContact C-O 3.59Å; S648-Y663 VanDerWaalsContact CA-O 3.28Å; S648-Y663 WeakPolarHBondContact CA-O 3.48Å
649	I	94.9	Very high	92.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.5	173.4	-54.1	167.1	0	0	0	107.8	A640 V641 T662 Y663 T665 A669 L672 L683 V685	A640-I649 HydrophobicContact CB-CG2 4.18Å; V641-I649 CarbonylContact O-C 3.13Å; V641-I649 VanDerWaalsContact O-CA 3.31Å; V641-I649 WeakPolarHBondContact O-CA 3.38Å; I649-T662 CarbonylContact O-C 3.56Å; I649-T662 VanDerWaalsContact O-CA 3.32Å; I649-T662 WeakPolarHBondContact O-CA 3.36Å; I649-Y663 HydrophobicContact CD1-CD1 3.84Å; I649-Y663 PolarHBondContact N-O 3.38Å; I649-Y663 PolarHBondContact O-N 3Å; I649-T665 HydrophobicContact CD1-CG2 3.63Å; I649-T665 HydrophobicContact CG1-CG2 3.76Å; I649-A669 HydrophobicContact CG1-CB 4.14Å; I649-L672 HydrophobicContact CD1-CD2 3.87Å; I649-L672 HydrophobicContact CG1-CD2 4.36Å; I649-L672 HydrophobicContact CG2-CD1 4.31Å; I649-L672 HydrophobicContact CG2-CD2 4.3Å; I649-L683 HydrophobicContact CG2-CD2 4.3Å; I649-V685 HydrophobicContact CD1-CB 3.89Å; I649-V685 HydrophobicContact CD1-CG1 3.33Å; I649-V685 HydrophobicContact CD1-CG2 3.27Å; I649-V685 HydrophobicContact CG1-CG1 4.38Å
650	I	95	Very high	92.1	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.041	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.7	173.8	-59.7	-166.5	0	0	0	109.4	F620 A640 V641 M659 T662	F620-I650 HydrophobicContact CD1-CD1 4.11Å; F620-I650 HydrophobicContact CE1-CB 4.38Å; F620-I650 HydrophobicContact CE1-CD1 4.37Å; F620-I650 HydrophobicContact CE1-CG2 4.12Å; A640-I650 CarbonylContact C-O 3.56Å; A640-I650 WeakPolarHBondContact CA-O 3.38Å; V641-I650 HydrophobicContact CG2-CB 3.97Å; V641-I650 PolarHBondContact N-O 3.31Å; V641-I650 PolarHBondContact O-N 3.04Å; I650-M659 HydrophobicContact CD1-SD 4.03Å; I650-M659 HydrophobicContact CG2-CB 4.49Å; I650-M659 HydrophobicContact CG2-CG 3.6Å; I650-M659 HydrophobicContact CG2-SD 3.89Å; I650-T662 HydrophobicContact CG1-CG2 4.25Å
651	L	94.8	Very high	91.9	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.3	165.2	-70.2	169.1	0	0	0	108.9	I638 G639 A640 L660 A661 F674 L683 L697 Y705	I638-L651 HydrophobicContact CG2-CD2 4.28Å; G639-L651 WeakPolarHBondContact O-CA 3.32Å; A640-L651 HydrophobicContact CB-CD2 3.99Å; L651-L660 HydrophobicContact CB-CB 4.31Å; L651-L660 PolarHBondContact O-N 2.89Å; L651-A661 HydrophobicContact CD1-CB 4.35Å; L651-A661 PolarHBondContact N-O 3.04Å; L651-A661 PolarHBondContact O-N 2.99Å; L651-F674 HydrophobicContact CD2-CE1 4.36Å; L651-F674 HydrophobicContact CD2-CZ 3.98Å; L651-L683 HydrophobicContact CD2-CD2 3.97Å; L651-L697 HydrophobicContact CD1-CD2 3.83Å; L651-Y705 HydrophobicContact CD1-CD1 3.95Å
652	F	94.4	Very high	91.8	Very high	3 Å²	3	47.8 Å²	47.8	1%	0.013	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	166.9	-177.4	70.7	-74.5	0	0	0	111.4	L602 F620 G639 V641 P654 M657 Q658	L602-F652 HydrophobicContact CD1-CE2 4.39Å; L602-F652 HydrophobicContact CD1-CZ 3.9Å; F620-F652 HydrophobicContact CZ-CD1 4.32Å; F620-F652 HydrophobicContact CZ-CD2 4.48Å; F620-F652 HydrophobicContact CZ-CG 4.33Å; G639-F652 PolarHBondContact N-O 3.46Å; G639-F652 VanDerWaalsContact O-CD1 3.3Å; G639-F652 WeakPolarHBondContact O-CD1 3.48Å; G639-F652 PolarHBondContact O-N 2.89Å; V641-F652 HydrophobicContact CB-CE1 4.41Å; V641-F652 HydrophobicContact CG1-CE1 3.81Å; V641-F652 HydrophobicContact CG1-CZ 4.27Å; V641-F652 HydrophobicContact CG2-CD1 4.21Å; V641-F652 HydrophobicContact CG2-CE1 4.08Å; F652-P654 HydrophobicContact CE2-CB 4.45Å; F652-M657 HydrophobicContact CD2-SD 4.19Å; F652-M657 HydrophobicContact CE2-SD 4.04Å; F652-Q658 CarbonylContact C-O 3.57Å; F652-Q658 WeakPolarHBondContact CA-O 3.35Å; F652-Q658 WeakPolarHBondContact CB-O 3.39Å
653	R	92.5	Very high	91.6	Very high	39 Å²	39	49.3 Å²	49.3	15%	0.147	25%	0.253	C	S	.	.			trans	-94.2	123.8	168.9	-66.5	-149.1	-173	168.3	5.1	110.2	E636 V655 S656 M657 Q658 L660 Q701	E636-R653 IonicContact OE1-NH1 3.52Å; E636-R653 PolarHBondContact OE1-NH1 3.1Å; E636-R653 WeakPolarHBondContact OE2-CD 3.28Å; E636-R653 IonicContact OE2-CZ 3.4Å; E636-R653 IonicContact OE2-NE 2.84Å; E636-R653 IonicContact OE2-NH1 2.97Å; E636-R653 PolarHBondContact OE2-NH1 3.37Å; R653-V655 PolarHBondContact O-N 2.99Å; R653-S656 VanDerWaalsContact CB-OG 3.31Å; R653-S656 WeakPolarHBondContact CB-OG 3.26Å; R653-M657 WeakPolarHBondContact O-CA 3.16Å; R653-M657 PolarHBondContact O-N 2.86Å; R653-Q658 PolarHBondContact N-O 3.37Å; R653-L660 HydrophobicContact CG-CD1 3.92Å; R653-L660 HydrophobicContact CG-CD2 4.09Å; R653-L660 HydrophobicContact CG-CG 4.16Å; R653-Q701 PolarHBondContact NH2-O 3.49Å
654	P	91.7	Very high	91.6	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-49.4	-174.2	-26.2	35.8	0	0	0	113.2	L604 I629 E637 F652 M657	L604-P654 HydrophobicContact CD1-CB 4.02Å; L604-P654 HydrophobicContact CD2-CB 3.92Å; L604-P654 WeakPolarHBondContact CD2-O 3.12Å; I629-P654 HydrophobicContact CG2-CG 3.91Å; E637-P654 HydrophobicContact CB-CG 4.22Å; E637-P654 HydrophobicContact CG-CG 4.07Å; E637-P654 WeakPolarHBondContact O-CD 3.15Å; F652-P654 HydrophobicContact CE2-CB 4.45Å; P654-M657 WeakPolarHBondContact O-CE 3.4Å; P654-M657 VanDerWaalsContact O-SD 3.4Å
655	V	90.6	Very high	91.5	Very high	79 Å²	79	49.1 Å²	49.1	48%	0.479	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-43.9	-172.7	-178.3	0	0	0	0	112.3	L604 I615 R653	L604-V655 HydrophobicContact CD2-CG2 4.35Å; I615-V655 HydrophobicContact CG2-CG1 4.48Å; R653-V655 PolarHBondContact O-N 2.99Å
656	S	91.1	Very high	91.4	Very high	65 Å²	65	48.7 Å²	48.7	46%	0.455	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-11.5	-179	64.3	0	0	0	0	113.7	R653 Q658	R653-S656 VanDerWaalsContact CB-OG 3.31Å; R653-S656 WeakPolarHBondContact CB-OG 3.26Å; S656-Q658 PolarHBondContact O-N 3.04Å; S656-Q658 VanDerWaalsContact O-N 3.08Å; S656-Q658 WeakPolarHBondContact OG-CB 3.45Å; S656-Q658 PolarHBondContact OG-N 2.9Å
657	M	90.6	Very high	91.7	Very high	30 Å²	30	43.1 Å²	43.1	15%	0.148	24%	0.236	C	C	.	.			trans	53.8	21.1	-170.9	-62.8	-66.9	176.3	0	0	113.7	L602 L604 A616 N618 F652 R653 P654 M659	L602-M657 HydrophobicContact CD2-CE 3.37Å; L602-M657 HydrophobicContact CD2-SD 4Å; L604-M657 HydrophobicContact CB-CE 3.82Å; A616-M657 HydrophobicContact CB-CE 3.52Å; A616-M657 HydrophobicContact CB-CG 4.14Å; N618-M657 HydrophobicContact CB-CB 4.21Å; N618-M657 HydrophobicContact CB-CG 3.92Å; N618-M657 HydrophobicContact CB-SD 3.8Å; F652-M657 HydrophobicContact CD2-SD 4.19Å; F652-M657 HydrophobicContact CE2-SD 4.04Å; R653-M657 WeakPolarHBondContact O-CA 3.16Å; R653-M657 PolarHBondContact O-N 2.86Å; P654-M657 WeakPolarHBondContact O-CE 3.4Å; P654-M657 VanDerWaalsContact O-SD 3.4Å; M657-M659 PolarHBondContact O-N 2.82Å
658	Q	91.9	Very high	91.8	Very high	109 Å²	109	41.6 Å²	41.6	51%	0.509	23%	0.228	S	C	.	.			trans	-72.9	122.8	177.9	-178.2	-176.6	1.8	0	0	109.9	F652 R653 S656	F652-Q658 CarbonylContact C-O 3.57Å; F652-Q658 WeakPolarHBondContact CA-O 3.35Å; F652-Q658 WeakPolarHBondContact CB-O 3.39Å; R653-Q658 PolarHBondContact N-O 3.37Å; S656-Q658 PolarHBondContact O-N 3.04Å; S656-Q658 VanDerWaalsContact O-N 3.08Å; S656-Q658 WeakPolarHBondContact OG-CB 3.45Å; S656-Q658 PolarHBondContact OG-N 2.9Å
659	M	91.2	Very high	91.8	Very high	115 Å²	115	41.3 Å²	41.3	57%	0.567	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	128.4	169.7	-174.9	171.5	71.6	0	0	110.3	I650 M657	I650-M659 HydrophobicContact CD1-SD 4.03Å; I650-M659 HydrophobicContact CG2-CB 4.49Å; I650-M659 HydrophobicContact CG2-CG 3.6Å; I650-M659 HydrophobicContact CG2-SD 3.89Å; M657-M659 PolarHBondContact O-N 2.82Å
660	L	92.2	Very high	91.7	Very high	30 Å²	30	45.3 Å²	45.3	16%	0.157	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-55.5	-179.2	-64	178.1	0	0	0	111.1	I638 L651 R653	I638-L660 HydrophobicContact CG1-CD1 4.21Å; L651-L660 HydrophobicContact CB-CB 4.31Å; L651-L660 PolarHBondContact O-N 2.89Å; R653-L660 HydrophobicContact CG-CD1 3.92Å; R653-L660 HydrophobicContact CG-CD2 4.09Å; R653-L660 HydrophobicContact CG-CG 4.16Å
661	A	93	Very high	91.7	Very high	22 Å²	22	45.6 Å²	45.6	18%	0.182	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	159.7	-177.9	0	0	0	0	0	111.5	L651 Y705	L651-A661 HydrophobicContact CD1-CB 4.35Å; L651-A661 PolarHBondContact N-O 3.04Å; L651-A661 PolarHBondContact O-N 2.99Å; A661-Y705 HydrophobicContact CB-CD1 4.15Å; A661-Y705 HydrophobicContact CB-CE1 3.92Å
662	T	93	Very high	91.8	Very high	66 Å²	66	45.9 Å²	45.9	41%	0.405	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	124.4	175.9	-57	0	0	0	0	109.6	I649 I650 Y705	I649-T662 CarbonylContact O-C 3.56Å; I649-T662 VanDerWaalsContact O-CA 3.32Å; I649-T662 WeakPolarHBondContact O-CA 3.36Å; I650-T662 HydrophobicContact CG1-CG2 4.25Å; T662-Y705 PolarHBondContact O-OH 3.26Å
663	Y	91.7	Very high	91.8	Very high	33 Å²	33	47 Å²	47	13%	0.129	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124	174.6	175.8	-115.8	0	0	0	110.5	S648 I649 T665 V693 L695 Y705 V707	S648-Y663 CarbonylContact C-O 3.59Å; S648-Y663 VanDerWaalsContact CA-O 3.28Å; S648-Y663 WeakPolarHBondContact CA-O 3.48Å; I649-Y663 HydrophobicContact CD1-CD1 3.84Å; I649-Y663 PolarHBondContact N-O 3.38Å; I649-Y663 PolarHBondContact O-N 3Å; Y663-T665 HydrophobicContact CD1-CG2 3.67Å; Y663-T665 HydrophobicContact CE1-CG2 3.65Å; Y663-V693 HydrophobicContact CE1-CG1 4.36Å; Y663-L695 HydrophobicContact CD1-CD1 3.7Å; Y663-L695 HydrophobicContact CD1-CD2 4.33Å; Y663-L695 HydrophobicContact CD2-CD2 4.27Å; Y663-L695 HydrophobicContact CE1-CD1 4.13Å; Y663-L695 HydrophobicContact CE1-CD2 4.07Å; Y663-L695 HydrophobicContact CE2-CD2 4.05Å; Y663-L695 HydrophobicContact CG-CD1 3.93Å; Y663-L695 HydrophobicContact CG-CD2 4.41Å; Y663-Y705 WeakPolarHBondContact CA-OH 3.33Å; Y663-Y705 HydrophobicContact CD2-CD2 4.43Å; Y663-Y705 AromaticContact CD2-CE2 3.47Å; Y663-Y705 HydrophobicContact CD2-CE2 3.47Å; Y663-Y705 VanDerWaalsContact CD2-CE2 3.47Å; Y663-Y705 AromaticContact CD2-CZ 3.74Å; Y663-Y705 HydrophobicContact CE2-CE2 4.24Å; Y663-Y705 HydrophobicContact CG-CE2 4.13Å; Y663-V707 HydrophobicContact CE2-CG2 3.85Å
664	S	92	Very high	92	Very high	90 Å²	90	45.3 Å²	45.3	63%	0.629	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	121.9	171.2	-179.7	0	0	0	0	109.6
665	T	88.2	Confident	92.1	Very high	8 Å²	8	45.3 Å²	45.3	5%	0.049	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-94.2	163.5	176.3	64.2	0	0	0	0	110.2	D647 I649 Y663 G667 V685	D647-T665 WeakPolarHBondContact O-CA 3.41Å; D647-T665 WeakPolarHBondContact O-CB 3.3Å; D647-T665 PolarHBondContact O-N 2.94Å; D647-T665 PolarHBondContact O-OG1 2.83Å; I649-T665 HydrophobicContact CD1-CG2 3.63Å; I649-T665 HydrophobicContact CG1-CG2 3.76Å; Y663-T665 HydrophobicContact CD1-CG2 3.67Å; Y663-T665 HydrophobicContact CE1-CG2 3.65Å; T665-G667 VanDerWaalsContact C-N 3.27Å; T665-G667 PolarHBondContact O-N 2.64Å; T665-G667 PolarHBondContact OG1-O 2.99Å; T665-V685 HydrophobicContact CG2-CG1 4.23Å
666	Q	83.1	Confident	92.2	Very high	142 Å²	142	44.7 Å²	44.7	66%	0.664	24%	0.238	S	C	*	.	S	Bend	trans	-74.7	-18	176.1	-69.4	-174.9	-14.4	0	0	113.5	D689	Q666-D689 VanDerWaalsContact C-OD2 3.31Å
667	G	88.4	Confident	92.2	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.021	22%	0.217	C	C	.	.	S	Bend	trans	-168.9	162.4	175.8	0	0	0	0	0	110.7	T665 A669 T687	T665-G667 VanDerWaalsContact C-N 3.27Å; T665-G667 PolarHBondContact O-N 2.64Å; T665-G667 PolarHBondContact OG1-O 2.99Å; G667-A669 PolarHBondContact O-N 2.76Å; G667-T687 WeakPolarHBondContact O-CB 3.3Å; G667-T687 WeakPolarHBondContact O-CG2 3.04Å
668	V	93.4	Very high	91.9	Very high	20 Å²	20	45.1 Å²	45.1	12%	0.121	23%	0.233	C	C	.	.			trans	-41.1	123.8	-172.7	-174.3	0	0	0	0	113.4	W644 D647 R670 T687 S688	W644-V668 HydrophobicContact CD2-CG1 4.15Å; W644-V668 HydrophobicContact CE3-CG1 3.86Å; W644-V668 HydrophobicContact CE3-CG2 4.24Å; W644-V668 HydrophobicContact CZ3-CG1 4.14Å; D647-V668 WeakPolarHBondContact OD1-CA 3.12Å; D647-V668 WeakPolarHBondContact OD1-CG2 3.42Å; D647-V668 PolarHBondContact OD1-N 3.31Å; V668-R670 PolarHBondContact O-N 2.83Å; V668-T687 CarbonylContact O-C 3.52Å; V668-T687 WeakPolarHBondContact O-CA 3.34Å; V668-S688 PolarHBondContact N-OG 2.7Å; V668-S688 PolarHBondContact O-N 3.26Å
669	A	94.7	Very high	91.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	128.8	172.8	0	0	0	0	0	110.7	S625 C626 I649 G667 V685 S686	S625-A669 VanDerWaalsContact CB-O 3.22Å; S625-A669 WeakPolarHBondContact CB-O 3.43Å; S625-A669 PolarHBondContact OG-O 3.37Å; C626-A669 VanDerWaalsContact SG-C 3.58Å; C626-A669 PolarHBondContact SG-O 2.87Å; C626-A669 VanDerWaalsContact SG-O 3.36Å; I649-A669 HydrophobicContact CG1-CB 4.14Å; G667-A669 PolarHBondContact O-N 2.76Å; A669-V685 HydrophobicContact CB-CG1 4.03Å; A669-S686 CarbonylContact C-O 3.43Å; A669-S686 WeakPolarHBondContact CA-O 3.48Å
670	R	93.1	Very high	91.5	Very high	86 Å²	86	42.9 Å²	42.9	33%	0.325	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-26	-179.2	-64.8	-66.4	-70.3	160.7	-2	113.3	V668 S686 Y717	V668-R670 PolarHBondContact O-N 2.83Å; R670-S686 PolarHBondContact N-O 3.32Å; R670-Y717 HydrophobicContact CB-CD2 4.02Å; R670-Y717 HydrophobicContact CG-CD2 4.07Å; R670-Y717 HydrophobicContact CG-CG 4.3Å; R670-Y717 PolarHBondContact NH2-OH 3.19Å
671	S	94.9	Very high	91.6	Very high	13 Å²	13	41.8 Å²	41.8	9%	0.091	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	136.1	178.5	-177.3	0	0	0	0	109.7	S686 L720	S671-S686 PolarHBondContact O-N 3.04Å; S671-L720 PolarHBondContact OG-N 2.78Å
672	L	95.9	Very high	91.7	Very high	10 Å²	10	40.8 Å²	40.8	5%	0.052	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	139.3	175.8	-66.8	173.2	0	0	0	108.7	C626 D628 A640 I649 L683 F684 V685	C626-L672 HydrophobicContact CB-CG 4.42Å; D628-L672 HydrophobicContact CB-CB 4.12Å; A640-L672 HydrophobicContact CB-CD1 3.97Å; I649-L672 HydrophobicContact CD1-CD2 3.87Å; I649-L672 HydrophobicContact CG1-CD2 4.36Å; I649-L672 HydrophobicContact CG2-CD1 4.31Å; I649-L672 HydrophobicContact CG2-CD2 4.3Å; L672-L683 HydrophobicContact CB-CD1 4.24Å; L672-L683 HydrophobicContact CD2-CD1 4.23Å; L672-L683 HydrophobicContact CD2-CD2 4.46Å; L672-F684 WeakPolarHBondContact CA-O 3.44Å; L672-V685 HydrophobicContact CD2-CB 4.19Å; L672-V685 HydrophobicContact CD2-CG1 3.99Å; L672-V685 HydrophobicContact CD2-CG2 3.82Å
673	Q	95.6	Very high	91.8	Very high	26 Å²	26	37.7 Å²	37.7	12%	0.121	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	115.1	174.6	-175.5	66.1	80.1	0	0	111	D628 F684 L720 C722 V731	D628-Q673 WeakPolarHBondContact OD2-CA 3.11Å; D628-Q673 PolarHBondContact OD2-NE2 2.84Å; Q673-F684 PolarHBondContact N-O 2.82Å; Q673-F684 PolarHBondContact O-N 3.04Å; Q673-L720 HydrophobicContact CB-CB 3.78Å; Q673-L720 HydrophobicContact CB-CD1 4.47Å; Q673-C722 VanDerWaalsContact CD-CB 3.48Å; Q673-C722 VanDerWaalsContact CD-N 3.27Å; Q673-C722 HydrophobicContact CG-CB 3.66Å; Q673-V731 HydrophobicContact CG-CG1 4.41Å; Q673-V731 HydrophobicContact CG-CG2 4.41Å
674	F	95.1	Very high	92	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	141	165.4	-77.2	-61.8	0	0	0	110.8	D628 F632 I638 A640 L651 R682 L683 L697	D628-F674 HydrophobicContact CB-CD2 3.99Å; D628-F674 HydrophobicContact CB-CE2 4.39Å; D628-F674 WeakPolarHBondContact O-CE2 3.28Å; D628-F674 PolarHBondContact OD2-N 2.84Å; F632-F674 HydrophobicContact CE2-CD1 4.17Å; F632-F674 HydrophobicContact CZ-CB 3.92Å; F632-F674 AromaticContact CZ-CD1 3.82Å; F632-F674 HydrophobicContact CZ-CD1 3.82Å; F632-F674 HydrophobicContact CZ-CG 4.08Å; I638-F674 HydrophobicContact CG2-CE1 3.86Å; I638-F674 HydrophobicContact CG2-CE2 4.07Å; I638-F674 HydrophobicContact CG2-CZ 3.4Å; A640-F674 HydrophobicContact CB-CE2 3.77Å; A640-F674 HydrophobicContact CB-CZ 3.63Å; L651-F674 HydrophobicContact CD2-CE1 4.36Å; L651-F674 HydrophobicContact CD2-CZ 3.98Å; F674-R682 CarbonylContact C-O 3.44Å; F674-R682 WeakPolarHBondContact CA-O 3.22Å; F674-L683 HydrophobicContact CD1-CB 3.98Å; F674-L683 HydrophobicContact CD1-CD1 3.9Å; F674-L683 HydrophobicContact CD1-CG 4.49Å; F674-L683 HydrophobicContact CD2-CD1 4.39Å; F674-L683 HydrophobicContact CE1-CB 3.75Å; F674-L683 HydrophobicContact CE1-CD1 3.8Å; F674-L683 HydrophobicContact CE1-CD2 4.22Å; F674-L683 HydrophobicContact CE1-CG 4.13Å; F674-L683 HydrophobicContact CE2-CD1 4.3Å; F674-L683 HydrophobicContact CG-CD1 4.2Å; F674-L683 HydrophobicContact CZ-CD1 4.01Å; F674-L683 HydrophobicContact CZ-CD2 4.31Å; F674-L697 HydrophobicContact CE1-CD1 4.01Å
675	C	94.2	Very high	92.2	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.014	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	128.7	-179.8	-173.4	0	0	0	0	110.8	M677 R682 F684 T729 V731	C675-M677 HydrophobicContact CB-CE 4.41Å; C675-M677 WeakPolarHBondContact SG-CE 3.42Å; C675-M677 VanDerWaalsContact SG-CG 3.58Å; C675-R682 PolarHBondContact N-O 3.39Å; C675-R682 PolarHBondContact O-N 3.18Å; C675-F684 HydrophobicContact CB-CD2 4.1Å; C675-F684 HydrophobicContact CB-CE2 3.92Å; C675-T729 WeakPolarHBondContact SG-CG2 3.47Å; C675-V731 HydrophobicContact CB-CG2 3.76Å
676	L	92.4	Very high	92.5	Very high	66 Å²	66	31.5 Å²	31.5	35%	0.346	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	108.7	172.5	-173	65.4	0	0	0	109.6	F632 P681 T729	F632-L676 HydrophobicContact CD1-CB 4Å; F632-L676 HydrophobicContact CD1-CD1 4.01Å; F632-L676 HydrophobicContact CD1-CG 4.42Å; F632-L676 HydrophobicContact CE1-CB 4.14Å; L676-P681 HydrophobicContact CD1-CB 4.31Å; L676-T729 VanDerWaalsContact O-CB 3.25Å; L676-T729 WeakPolarHBondContact O-CB 3.48Å; L676-T729 WeakPolarHBondContact O-CG2 3.41Å; L676-T729 PolarHBondContact O-OG1 3.37Å
677	M	91	Very high	93	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.02	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	119.1	178.6	-62.6	-173.8	179.9	0	0	110.7	C675 D679 A680 R682 F684 V731 L748	C675-M677 HydrophobicContact CB-CE 4.41Å; C675-M677 WeakPolarHBondContact SG-CE 3.42Å; C675-M677 VanDerWaalsContact SG-CG 3.58Å; M677-D679 VanDerWaalsContact C-N 3.33Å; M677-D679 PolarHBondContact O-N 3.1Å; M677-A680 PolarHBondContact N-O 3.25Å; M677-A680 PolarHBondContact O-N 3.39Å; M677-A680 VanDerWaalsContact O-N 3.16Å; M677-R682 PolarHBondContact O-NH1 3.2Å; M677-F684 HydrophobicContact CE-CE2 3.67Å; M677-F684 HydrophobicContact CE-CZ 3.66Å; M677-F684 HydrophobicContact SD-CE2 4.39Å; M677-F684 HydrophobicContact SD-CZ 4.18Å; M677-V731 HydrophobicContact CE-CG2 3.98Å; M677-L748 HydrophobicContact SD-CD2 3.74Å
678	E	86.2	Confident	93.1	Very high	100 Å²	100	26.9 Å²	26.9	47%	0.467	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	52.4	-178.7	-62	179.6	-145.2	0	0	111.9	A680 R743	E678-A680 PolarHBondContact O-N 2.84Å; E678-R743 WeakPolarHBondContact OE1-CG 3.34Å; E678-R743 IonicContact OE1-CZ 3.51Å; E678-R743 IonicContact OE1-NE 3.47Å; E678-R743 PolarHBondContact OE1-NE 3.04Å; E678-R743 VanDerWaalsContact OE1-NE 3.07Å; E678-R743 IonicContact OE2-CZ 3.62Å; E678-R743 IonicContact OE2-NE 2.78Å; E678-R743 PolarHBondContact OE2-NE 3.43Å; E678-R743 IonicContact OE2-NH2 3.72Å; E678-R743 PolarHBondContact OE2-NH2 3.1Å
679	D	84.6	Confident	92.7	Very high	154 Å²	154	29.1 Å²	29.1	82%	0.824	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	9	179.3	-51	-40.6	0	0	0	116.2	M677	M677-D679 VanDerWaalsContact C-N 3.33Å; M677-D679 PolarHBondContact O-N 3.1Å
680	A	89.8	Confident	92.3	Very high	22 Å²	22	33.3 Å²	33.3	18%	0.182	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.1	176.7	0	0	0	0	0	110.8	M677 E678 R682 L696	M677-A680 PolarHBondContact N-O 3.25Å; M677-A680 PolarHBondContact O-N 3.39Å; M677-A680 VanDerWaalsContact O-N 3.16Å; E678-A680 PolarHBondContact O-N 2.84Å; A680-R682 PolarHBondContact O-NH1 3.41Å; A680-L696 HydrophobicContact CB-CD1 3.94Å
681	P	92.9	Very high	92.1	Very high	7 Å²	7	32.3 Å²	32.3	5%	0.045	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	136.6	-180	31.2	-38.6	0	0	0	111.8	F632 L676 L697 Q700	F632-P681 HydrophobicContact CD1-CB 3.82Å; F632-P681 HydrophobicContact CD2-CB 3.67Å; F632-P681 HydrophobicContact CD2-CG 4.45Å; F632-P681 HydrophobicContact CE1-CB 3.75Å; F632-P681 HydrophobicContact CE2-CB 3.6Å; F632-P681 HydrophobicContact CG-CB 3.76Å; F632-P681 HydrophobicContact CZ-CB 3.62Å; L676-P681 HydrophobicContact CD1-CB 4.31Å; P681-L697 HydrophobicContact CB-CD1 4.32Å; P681-L697 HydrophobicContact CG-CB 4.04Å; P681-L697 PolarHBondContact O-N 2.96Å; P681-L697 VanDerWaalsContact O-N 3.08Å; P681-Q700 HydrophobicContact CG-CG 4.06Å
682	R	94.7	Very high	92	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.008	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	148	179	-68.4	169.1	175.8	73.1	7.1	110.8	F674 C675 M677 A680 F684 L695 L696 E708	F674-R682 CarbonylContact C-O 3.44Å; F674-R682 WeakPolarHBondContact CA-O 3.22Å; C675-R682 PolarHBondContact N-O 3.39Å; C675-R682 PolarHBondContact O-N 3.18Å; M677-R682 PolarHBondContact O-NH1 3.2Å; A680-R682 PolarHBondContact O-NH1 3.41Å; R682-F684 HydrophobicContact CB-CD2 4.47Å; R682-F684 HydrophobicContact CB-CE2 4Å; R682-L695 CarbonylContact C-O 3.6Å; R682-L695 WeakPolarHBondContact CA-O 3.27Å; R682-L696 HydrophobicContact CG-CD1 4.11Å; R682-E708 WeakPolarHBondContact CD-OE2 3.32Å; R682-E708 IonicContact CZ-OE1 3.01Å; R682-E708 IonicContact CZ-OE2 2.84Å; R682-E708 IonicContact NE-OE1 3.75Å; R682-E708 PolarHBondContact NE-OE1 2.96Å; R682-E708 IonicContact NE-OE2 3.6Å; R682-E708 PolarHBondContact NE-OE2 3.33Å; R682-E708 IonicContact NH2-OE1 3.98Å; R682-E708 PolarHBondContact NH2-OE1 2.98Å; R682-E708 IonicContact NH2-OE2 3.16Å; R682-E708 PolarHBondContact NH2-OE2 2.57Å
683	L	95.7	Very high	91.8	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.7	166.8	177.4	60.7	0	0	0	108.8	A640 I649 L651 L672 F674 V685 L695	A640-L683 HydrophobicContact CB-CD1 4.24Å; A640-L683 HydrophobicContact CB-CD2 3.75Å; I649-L683 HydrophobicContact CG2-CD2 4.3Å; L651-L683 HydrophobicContact CD2-CD2 3.97Å; L672-L683 HydrophobicContact CB-CD1 4.24Å; L672-L683 HydrophobicContact CD2-CD1 4.23Å; L672-L683 HydrophobicContact CD2-CD2 4.46Å; F674-L683 HydrophobicContact CD1-CB 3.98Å; F674-L683 HydrophobicContact CD1-CD1 3.9Å; F674-L683 HydrophobicContact CD1-CG 4.49Å; F674-L683 HydrophobicContact CD2-CD1 4.39Å; F674-L683 HydrophobicContact CE1-CB 3.75Å; F674-L683 HydrophobicContact CE1-CD1 3.8Å; F674-L683 HydrophobicContact CE1-CD2 4.22Å; F674-L683 HydrophobicContact CE1-CG 4.13Å; F674-L683 HydrophobicContact CE2-CD1 4.3Å; F674-L683 HydrophobicContact CG-CD1 4.2Å; F674-L683 HydrophobicContact CZ-CD1 4.01Å; F674-L683 HydrophobicContact CZ-CD2 4.31Å; L683-V685 HydrophobicContact CD2-CG2 4.36Å; L683-V685 HydrophobicContact CG-CG2 4.08Å; L683-L695 HydrophobicContact CB-CB 4.33Å; L683-L695 HydrophobicContact CD2-CD1 4.32Å; L683-L695 PolarHBondContact N-O 2.91Å; L683-L695 PolarHBondContact O-N 3.06Å
684	F	96.4	Very high	91.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134.6	170.4	-68.3	-91.6	0	0	0	109.9	L672 Q673 C675 M677 R682 V692 V693 A694 F711 L720 V731 L741 L748	L672-F684 WeakPolarHBondContact CA-O 3.44Å; Q673-F684 PolarHBondContact N-O 2.82Å; Q673-F684 PolarHBondContact O-N 3.04Å; C675-F684 HydrophobicContact CB-CD2 4.1Å; C675-F684 HydrophobicContact CB-CE2 3.92Å; M677-F684 HydrophobicContact CE-CE2 3.67Å; M677-F684 HydrophobicContact CE-CZ 3.66Å; M677-F684 HydrophobicContact SD-CE2 4.39Å; M677-F684 HydrophobicContact SD-CZ 4.18Å; R682-F684 HydrophobicContact CB-CD2 4.47Å; R682-F684 HydrophobicContact CB-CE2 4Å; F684-V692 HydrophobicContact CD1-CG1 4.29Å; F684-V693 CarbonylContact C-O 3.54Å; F684-V693 WeakPolarHBondContact CA-O 3.43Å; F684-A694 HydrophobicContact CD1-CB 3.87Å; F684-A694 HydrophobicContact CE1-CB 3.63Å; F684-A694 HydrophobicContact CZ-CB 4.32Å; F684-F711 HydrophobicContact CE1-CE2 4.47Å; F684-L720 HydrophobicContact CB-CD1 3.73Å; F684-V731 HydrophobicContact CD2-CB 4.49Å; F684-V731 HydrophobicContact CD2-CG2 3.7Å; F684-V731 HydrophobicContact CE2-CG2 3.78Å; F684-V731 HydrophobicContact CG-CG2 4.35Å; F684-V731 HydrophobicContact CZ-CG2 4.48Å; F684-L741 HydrophobicContact CD1-CD1 3.69Å; F684-L741 HydrophobicContact CE1-CB 4.21Å; F684-L741 HydrophobicContact CE1-CD1 3.87Å; F684-L748 HydrophobicContact CZ-CD1 4.47Å; F684-L748 HydrophobicContact CZ-CD2 4.25Å
685	V	95.7	Very high	91.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	117.4	-175	-176.6	0	0	0	0	108.7	I649 T665 A669 L672 L683 T687 V692 V693 L695	I649-V685 HydrophobicContact CD1-CB 3.89Å; I649-V685 HydrophobicContact CD1-CG1 3.33Å; I649-V685 HydrophobicContact CD1-CG2 3.27Å; I649-V685 HydrophobicContact CG1-CG1 4.38Å; T665-V685 HydrophobicContact CG2-CG1 4.23Å; A669-V685 HydrophobicContact CB-CG1 4.03Å; L672-V685 HydrophobicContact CD2-CB 4.19Å; L672-V685 HydrophobicContact CD2-CG1 3.99Å; L672-V685 HydrophobicContact CD2-CG2 3.82Å; L683-V685 HydrophobicContact CD2-CG2 4.36Å; L683-V685 HydrophobicContact CG-CG2 4.08Å; V685-T687 HydrophobicContact CG1-CG2 4.34Å; V685-V692 CarbonylContact O-C 3.41Å; V685-V692 WeakPolarHBondContact O-CA 3.29Å; V685-V693 HydrophobicContact CB-CB 4.36Å; V685-V693 PolarHBondContact N-O 2.97Å; V685-V693 PolarHBondContact O-N 3.47Å; V685-L695 HydrophobicContact CG2-CD1 4.12Å
686	S	95	Very high	91.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	132	166	-178.6	0	0	0	0	110.2	A669 R670 S671 Y691 P718	A669-S686 CarbonylContact C-O 3.43Å; A669-S686 WeakPolarHBondContact CA-O 3.48Å; R670-S686 PolarHBondContact N-O 3.32Å; S671-S686 PolarHBondContact O-N 3.04Å; S686-Y691 WeakPolarHBondContact CA-O 3.49Å; S686-P718 WeakPolarHBondContact CB-O 3.27Å; S686-P718 WeakPolarHBondContact OG-CD 3.44Å; S686-P718 PolarHBondContact OG-O 3.28Å
687	T	93	Very high	91.6	Very high	2 Å²	2	29 Å²	29	1%	0.012	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	162.6	177.3	66.2	0	0	0	0	112.2	G667 V668 V685 D689 R690 Y691 Y717	G667-T687 WeakPolarHBondContact O-CB 3.3Å; G667-T687 WeakPolarHBondContact O-CG2 3.04Å; V668-T687 CarbonylContact O-C 3.52Å; V668-T687 WeakPolarHBondContact O-CA 3.34Å; V685-T687 HydrophobicContact CG1-CG2 4.34Å; T687-D689 PolarHBondContact O-N 3.31Å; T687-R690 PolarHBondContact O-N 3.48Å; T687-Y691 PolarHBondContact N-O 3.38Å; T687-Y691 PolarHBondContact OG1-N 2.93Å; T687-Y691 PolarHBondContact OG1-O 2.92Å; T687-Y717 WeakPolarHBondContact O-CB 3.45Å
688	S	90.3	Very high	91.6	Very high	45 Å²	45	32.3 Å²	32.3	32%	0.315	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.9	172	53.6	0	0	0	0	113	V668 R690	V668-S688 PolarHBondContact N-OG 2.7Å; V668-S688 PolarHBondContact O-N 3.26Å; S688-R690 PolarHBondContact O-N 2.79Å
689	D	86.5	Confident	91.6	Very high	68 Å²	68	30.4 Å²	30.4	36%	0.364	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	8.8	179.6	-62.2	-14.2	0	0	0	113	Q666 T687 Y691	Q666-D689 VanDerWaalsContact C-OD2 3.31Å; T687-D689 PolarHBondContact O-N 3.31Å; D689-Y691 VanDerWaalsContact C-N 3.32Å; D689-Y691 HydrophobicContact CB-CD2 3.88Å; D689-Y691 HydrophobicContact CB-CE2 4.22Å; D689-Y691 WeakPolarHBondContact O-CD2 3.32Å; D689-Y691 PolarHBondContact O-N 3.11Å
690	R	86.2	Confident	91.5	Very high	88 Å²	88	25.1 Å²	25.1	33%	0.332	13%	0.132	S	C	.	.	S	Bend	trans	69.1	32.6	173.1	-44.1	167.1	-63.7	173.7	-4.7	112.1	T687 S688 E713 F714	T687-R690 PolarHBondContact O-N 3.48Å; S688-R690 PolarHBondContact O-N 2.79Å; R690-E713 IonicContact CZ-OE1 2.74Å; R690-E713 IonicContact NH2-OE1 2.71Å; R690-E713 PolarHBondContact NH2-OE1 2.86Å; R690-F714 HydrophobicContact CB-CB 4.3Å; R690-F714 VanDerWaalsContact CB-O 3.28Å; R690-F714 WeakPolarHBondContact CB-O 3.37Å; R690-F714 WeakPolarHBondContact CD-O 3.33Å; R690-F714 PolarHBondContact NE-O 3.38Å; R690-F714 WeakPolarHBondContact O-CD2 3.4Å; R690-F714 PolarHBondContact O-N 3.19Å
691	Y	88.5	Confident	91.2	Very high	64 Å²	64	29.9 Å²	29.9	25%	0.251	15%	0.15	S	C	.	.			trans	-106.4	152	167.8	-66.9	-81.2	0	0	0	110.8	S686 T687 D689 T710 F711	S686-Y691 WeakPolarHBondContact CA-O 3.49Å; T687-Y691 PolarHBondContact N-O 3.38Å; T687-Y691 PolarHBondContact OG1-N 2.93Å; T687-Y691 PolarHBondContact OG1-O 2.92Å; D689-Y691 VanDerWaalsContact C-N 3.32Å; D689-Y691 HydrophobicContact CB-CD2 3.88Å; D689-Y691 HydrophobicContact CB-CE2 4.22Å; D689-Y691 WeakPolarHBondContact O-CD2 3.32Å; D689-Y691 PolarHBondContact O-N 3.11Å; Y691-T710 HydrophobicContact CD1-CG2 3.93Å; Y691-T710 HydrophobicContact CG-CG2 4.37Å; Y691-F711 CarbonylContact C-O 3.54Å; Y691-F711 VanDerWaalsContact CA-O 3.25Å; Y691-F711 WeakPolarHBondContact CA-O 3.42Å
692	V	92	Very high	90.7	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.5	164.8	-179	0	0	0	0	108.8	F684 V685 T710 F711 F714 P718 L720 F739 L741	F684-V692 HydrophobicContact CD1-CG1 4.29Å; V685-V692 CarbonylContact O-C 3.41Å; V685-V692 WeakPolarHBondContact O-CA 3.29Å; V692-T710 CarbonylContact O-C 3.55Å; V692-F711 HydrophobicContact CB-CB 4.35Å; V692-F711 HydrophobicContact CB-CD2 4.32Å; V692-F711 HydrophobicContact CG1-CD2 4.35Å; V692-F711 PolarHBondContact N-O 2.89Å; V692-F711 WeakPolarHBondContact O-CD2 2.92Å; V692-F711 PolarHBondContact O-N 2.89Å; V692-F714 HydrophobicContact CB-CE2 4.32Å; V692-F714 HydrophobicContact CG2-CD2 4.39Å; V692-F714 HydrophobicContact CG2-CE2 3.9Å; V692-P718 HydrophobicContact CG2-CG 3.39Å; V692-L720 HydrophobicContact CG1-CD1 4.43Å; V692-L720 HydrophobicContact CG1-CD2 4.34Å; V692-L720 HydrophobicContact CG2-CD2 4.36Å; V692-F739 HydrophobicContact CG2-CZ 4.1Å; V692-L741 HydrophobicContact CG1-CD1 3.87Å
693	V	92.6	Very high	90.2	Very high	7 Å²	7	31.9 Å²	31.9	4%	0.042	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.5	176.7	-174.8	0	0	0	0	109.1	Y663 F684 V685 L695 V707 T710	Y663-V693 HydrophobicContact CE1-CG1 4.36Å; F684-V693 CarbonylContact C-O 3.54Å; F684-V693 WeakPolarHBondContact CA-O 3.43Å; V685-V693 HydrophobicContact CB-CB 4.36Å; V685-V693 PolarHBondContact N-O 2.97Å; V685-V693 PolarHBondContact O-N 3.47Å; V693-L695 HydrophobicContact CG1-CD2 3.88Å; V693-L695 HydrophobicContact CG1-CG 4.32Å; V693-V707 HydrophobicContact CG1-CG1 4.04Å; V693-T710 HydrophobicContact CG2-CG2 4.08Å
694	A	93.9	Very high	89.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114.4	170.6	0	0	0	0	0	109.6	F684 E708 K709 F711 L748	F684-A694 HydrophobicContact CD1-CB 3.87Å; F684-A694 HydrophobicContact CE1-CB 3.63Å; F684-A694 HydrophobicContact CZ-CB 4.32Å; A694-E708 PolarHBondContact O-N 3.46Å; A694-K709 PolarHBondContact N-O 3Å; A694-K709 PolarHBondContact O-N 3.28Å; A694-F711 HydrophobicContact CB-CE2 4.22Å; A694-L748 HydrophobicContact CB-CD1 3.65Å
695	L	94.4	Very high	89.7	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	121	174	-56.8	175.9	0	0	0	108.8	Y663 R682 L683 V685 V693 Y705 V707	Y663-L695 HydrophobicContact CD1-CD1 3.7Å; Y663-L695 HydrophobicContact CD1-CD2 4.33Å; Y663-L695 HydrophobicContact CD2-CD2 4.27Å; Y663-L695 HydrophobicContact CE1-CD1 4.13Å; Y663-L695 HydrophobicContact CE1-CD2 4.07Å; Y663-L695 HydrophobicContact CE2-CD2 4.05Å; Y663-L695 HydrophobicContact CG-CD1 3.93Å; Y663-L695 HydrophobicContact CG-CD2 4.41Å; R682-L695 CarbonylContact C-O 3.6Å; R682-L695 WeakPolarHBondContact CA-O 3.27Å; L683-L695 HydrophobicContact CB-CB 4.33Å; L683-L695 HydrophobicContact CD2-CD1 4.32Å; L683-L695 PolarHBondContact N-O 2.91Å; L683-L695 PolarHBondContact O-N 3.06Å; V685-L695 HydrophobicContact CG2-CD1 4.12Å; V693-L695 HydrophobicContact CG1-CD2 3.88Å; V693-L695 HydrophobicContact CG1-CG 4.32Å; L695-Y705 HydrophobicContact CD2-CD2 4.11Å; L695-V707 HydrophobicContact CD2-CB 4.34Å; L695-V707 HydrophobicContact CD2-CG2 3.72Å
696	L	93.6	Very high	89.5	Confident	37 Å²	37	47.4 Å²	47.4	19%	0.194	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	120.6	170.4	176	66.4	0	0	0	108.5	A680 R682 T698 Y705 K706 E708	A680-L696 HydrophobicContact CB-CD1 3.94Å; R682-L696 HydrophobicContact CG-CD1 4.11Å; L696-T698 HydrophobicContact CD2-CG2 4.5Å; L696-T698 PolarHBondContact O-N 3.29Å; L696-Y705 CarbonylContact O-C 3.54Å; L696-Y705 VanDerWaalsContact O-CA 3.28Å; L696-Y705 WeakPolarHBondContact O-CA 3.43Å; L696-K706 PolarHBondContact N-O 2.86Å; L696-K706 PolarHBondContact O-N 2.96Å; L696-E708 HydrophobicContact CB-CB 4.15Å
697	L	91.6	Very high	89.1	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.037	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	107.5	172.7	-61.1	175.1	0	0	0	108.2	F632 I638 L651 F674 P681	F632-L697 HydrophobicContact CE2-CD1 4.25Å; I638-L697 HydrophobicContact CD1-CD1 4.25Å; L651-L697 HydrophobicContact CD1-CD2 3.83Å; F674-L697 HydrophobicContact CE1-CD1 4.01Å; P681-L697 HydrophobicContact CB-CD1 4.32Å; P681-L697 HydrophobicContact CG-CB 4.04Å; P681-L697 PolarHBondContact O-N 2.96Å; P681-L697 VanDerWaalsContact O-N 3.08Å
698	T	89.1	Confident	88.8	Confident	74 Å²	74	53.1 Å²	53.1	45%	0.454	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-34.6	-178	47.9	0	0	0	0	111.6	L696 E704 K706	L696-T698 HydrophobicContact CD2-CG2 4.5Å; L696-T698 PolarHBondContact O-N 3.29Å; T698-E704 PolarHBondContact N-O 3.38Å; T698-E704 PolarHBondContact OG1-O 2.68Å; T698-E704 VanDerWaalsContact OG1-O 3.11Å; T698-K706 HydrophobicContact CG2-CB 4.03Å
699	D	86.9	Confident	88.5	Confident	59 Å²	59	52.5 Å²	52.5	32%	0.316	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	117.3	172	175.9	25.4	0	0	0	110.8	Q701 S702 G703 E704	D699-Q701 VanDerWaalsContact C-N 3.29Å; D699-Q701 PolarHBondContact O-N 2.86Å; D699-Q701 PolarHBondContact OD1-N 2.88Å; D699-S702 WeakPolarHBondContact CB-OG 3.42Å; D699-S702 VanDerWaalsContact CG-OG 3.32Å; D699-S702 VanDerWaalsContact OD2-CB 3.23Å; D699-S702 WeakPolarHBondContact OD2-CB 3.45Å; D699-S702 PolarHBondContact OD2-N 2.83Å; D699-S702 VanDerWaalsContact OD2-N 3.12Å; D699-S702 PolarHBondContact OD2-OG 3.21Å; D699-G703 WeakPolarHBondContact O-CA 3.41Å; D699-G703 PolarHBondContact O-N 2.85Å; D699-E704 HydrophobicContact CB-CB 4.19Å; D699-E704 PolarHBondContact N-O 2.99Å; D699-E704 PolarHBondContact O-N 3.31Å
700	Q	81.9	Confident	88.4	Confident	43 Å²	43	51.5 Å²	51.5	20%	0.201	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-24.7	178.2	-60	178.3	20.6	0	0	112.1	T635 I638 P681	T635-Q700 PolarHBondContact OG1-OE1 3.03Å; T635-Q700 VanDerWaalsContact OG1-OE1 3.08Å; I638-Q700 HydrophobicContact CD1-CB 4.11Å; I638-Q700 WeakPolarHBondContact CD1-O 3.34Å; P681-Q700 HydrophobicContact CG-CG 4.06Å
701	Q	83.4	Confident	88.3	Confident	122 Å²	122	48.1 Å²	48.1	57%	0.57	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-46.6	-176.8	-68.5	-167.1	-1.7	0	0	112.3	T635 R653 D699	T635-Q701 HydrophobicContact CG2-CG 3.97Å; R653-Q701 PolarHBondContact NH2-O 3.49Å; D699-Q701 VanDerWaalsContact C-N 3.29Å; D699-Q701 PolarHBondContact O-N 2.86Å; D699-Q701 PolarHBondContact OD1-N 2.88Å
702	S	84.4	Confident	87.3	Confident	52 Å²	52	47.3 Å²	47.3	36%	0.364	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.9	177.5	61.1	0	0	0	0	113.8	D699 E704	D699-S702 WeakPolarHBondContact CB-OG 3.42Å; D699-S702 VanDerWaalsContact CG-OG 3.32Å; D699-S702 VanDerWaalsContact OD2-CB 3.23Å; D699-S702 WeakPolarHBondContact OD2-CB 3.45Å; D699-S702 PolarHBondContact OD2-N 2.83Å; D699-S702 VanDerWaalsContact OD2-N 3.12Å; D699-S702 PolarHBondContact OD2-OG 3.21Å; S702-E704 VanDerWaalsContact C-N 3.28Å; S702-E704 WeakPolarHBondContact OG-CB 3.41Å; S702-E704 PolarHBondContact OG-N 3.32Å
703	G	83.1	Confident	86.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	18.8	-169.8	0	0	0	0	0	113.2	D699 Y705	D699-G703 WeakPolarHBondContact O-CA 3.41Å; D699-G703 PolarHBondContact O-N 2.85Å; G703-Y705 PolarHBondContact O-N 2.79Å
704	E	90.3	Very high	85.4	Confident	123 Å²	123	54.8 Å²	54.8	58%	0.575	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.1	133.2	172.8	-166.2	-176.9	-169.7	0	0	109.9	T698 D699 S702	T698-E704 PolarHBondContact N-O 3.38Å; T698-E704 PolarHBondContact OG1-O 2.68Å; T698-E704 VanDerWaalsContact OG1-O 3.11Å; D699-E704 HydrophobicContact CB-CB 4.19Å; D699-E704 PolarHBondContact N-O 2.99Å; D699-E704 PolarHBondContact O-N 3.31Å; S702-E704 VanDerWaalsContact C-N 3.28Å; S702-E704 WeakPolarHBondContact OG-CB 3.41Å; S702-E704 PolarHBondContact OG-N 3.32Å
705	Y	91.3	Very high	84.3	Confident	67 Å²	67	58.2 Å²	58.2	26%	0.263	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	154.4	-176.8	65.7	-95.7	0	0	0	111.3	L651 A661 T662 Y663 L695 L696 G703	L651-Y705 HydrophobicContact CD1-CD1 3.95Å; A661-Y705 HydrophobicContact CB-CD1 4.15Å; A661-Y705 HydrophobicContact CB-CE1 3.92Å; T662-Y705 PolarHBondContact O-OH 3.26Å; Y663-Y705 WeakPolarHBondContact CA-OH 3.33Å; Y663-Y705 HydrophobicContact CD2-CD2 4.43Å; Y663-Y705 AromaticContact CD2-CE2 3.47Å; Y663-Y705 HydrophobicContact CD2-CE2 3.47Å; Y663-Y705 VanDerWaalsContact CD2-CE2 3.47Å; Y663-Y705 AromaticContact CD2-CZ 3.74Å; Y663-Y705 HydrophobicContact CE2-CE2 4.24Å; Y663-Y705 HydrophobicContact CG-CE2 4.13Å; L695-Y705 HydrophobicContact CD2-CD2 4.11Å; L696-Y705 CarbonylContact O-C 3.54Å; L696-Y705 VanDerWaalsContact O-CA 3.28Å; L696-Y705 WeakPolarHBondContact O-CA 3.43Å; G703-Y705 PolarHBondContact O-N 2.79Å
706	K	90.8	Very high	83.8	Confident	137 Å²	137	60.4 Å²	60.4	60%	0.596	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.8	170	-179.1	179.4	176	-178.7	0	109.2	L696 T698 E708	L696-K706 PolarHBondContact N-O 2.86Å; L696-K706 PolarHBondContact O-N 2.96Å; T698-K706 HydrophobicContact CG2-CB 4.03Å; K706-E708 PolarHBondContact O-N 2.77Å; K706-E708 VanDerWaalsContact O-N 3.11Å
707	V	88.1	Confident	83.6	Confident	62 Å²	62	63.9 Å²	63.9	38%	0.376	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	112	167.6	-177.4	0	0	0	0	107.7	Y663 V693 L695	Y663-V707 HydrophobicContact CE2-CG2 3.85Å; V693-V707 HydrophobicContact CG1-CG1 4.04Å; L695-V707 HydrophobicContact CD2-CB 4.34Å; L695-V707 HydrophobicContact CD2-CG2 3.72Å
708	E	85.2	Confident	83.5	Confident	60 Å²	60	63.6 Å²	63.6	28%	0.28	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-44.5	-179.5	-172.8	175.7	-172	0	0	110.7	R682 A694 L696 K706 L748	R682-E708 WeakPolarHBondContact CD-OE2 3.32Å; R682-E708 IonicContact CZ-OE1 3.01Å; R682-E708 IonicContact CZ-OE2 2.84Å; R682-E708 IonicContact NE-OE1 3.75Å; R682-E708 PolarHBondContact NE-OE1 2.96Å; R682-E708 IonicContact NE-OE2 3.6Å; R682-E708 PolarHBondContact NE-OE2 3.33Å; R682-E708 IonicContact NH2-OE1 3.98Å; R682-E708 PolarHBondContact NH2-OE1 2.98Å; R682-E708 IonicContact NH2-OE2 3.16Å; R682-E708 PolarHBondContact NH2-OE2 2.57Å; A694-E708 PolarHBondContact O-N 3.46Å; L696-E708 HydrophobicContact CB-CB 4.15Å; K706-E708 PolarHBondContact O-N 2.77Å; K706-E708 VanDerWaalsContact O-N 3.11Å; E708-L748 HydrophobicContact CB-CD1 4.47Å; E708-L748 HydrophobicContact CG-CD1 4.02Å; E708-L748 WeakPolarHBondContact OE2-CD1 2.99Å
709	K	84.4	Confident	83.7	Confident	31 Å²	31	63.1 Å²	63.1	14%	0.135	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	147.1	179.3	-165.3	153.1	-178.6	160.7	0	112.5	A694 F711 L748 E1234	A694-K709 PolarHBondContact N-O 3Å; A694-K709 PolarHBondContact O-N 3.28Å; K709-F711 HydrophobicContact CB-CE1 4.49Å; K709-F711 HydrophobicContact CB-CE2 4.25Å; K709-F711 HydrophobicContact CB-CZ 4.01Å; K709-F711 HydrophobicContact CD-CD1 4.37Å; K709-F711 HydrophobicContact CD-CE1 3.57Å; K709-F711 HydrophobicContact CD-CZ 3.78Å; K709-F711 HydrophobicContact CG-CD1 4.24Å; K709-F711 HydrophobicContact CG-CE1 3.77Å; K709-F711 HydrophobicContact CG-CE2 4.3Å; K709-F711 HydrophobicContact CG-CZ 3.79Å; K709-L748 PolarHBondContact NZ-O 3.46Å; K709-E1234 IonicContact NZ-OE2 2.77Å; K709-E1234 PolarHBondContact NZ-OE2 2.95Å
710	T	85.4	Confident	84.2	Confident	48 Å²	48	60.7 Å²	60.7	29%	0.294	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.2	168.2	-58.3	0	0	0	0	109.3	Y691 V692 V693	Y691-T710 HydrophobicContact CD1-CG2 3.93Å; Y691-T710 HydrophobicContact CG-CG2 4.37Å; V692-T710 CarbonylContact O-C 3.55Å; V693-T710 HydrophobicContact CG2-CG2 4.08Å
711	F	82.7	Confident	84.8	Confident	17 Å²	17	61.8 Å²	61.8	8%	0.075	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.6	178	-51	-79.6	0	0	0	109.4	F684 Y691 V692 A694 K709 F714 L741 L748 T750	F684-F711 HydrophobicContact CE1-CE2 4.47Å; Y691-F711 CarbonylContact C-O 3.54Å; Y691-F711 VanDerWaalsContact CA-O 3.25Å; Y691-F711 WeakPolarHBondContact CA-O 3.42Å; V692-F711 HydrophobicContact CB-CB 4.35Å; V692-F711 HydrophobicContact CB-CD2 4.32Å; V692-F711 HydrophobicContact CG1-CD2 4.35Å; V692-F711 PolarHBondContact N-O 2.89Å; V692-F711 WeakPolarHBondContact O-CD2 2.92Å; V692-F711 PolarHBondContact O-N 2.89Å; A694-F711 HydrophobicContact CB-CE2 4.22Å; K709-F711 HydrophobicContact CB-CE1 4.49Å; K709-F711 HydrophobicContact CB-CE2 4.25Å; K709-F711 HydrophobicContact CB-CZ 4.01Å; K709-F711 HydrophobicContact CD-CD1 4.37Å; K709-F711 HydrophobicContact CD-CE1 3.57Å; K709-F711 HydrophobicContact CD-CZ 3.78Å; K709-F711 HydrophobicContact CG-CD1 4.24Å; K709-F711 HydrophobicContact CG-CE1 3.77Å; K709-F711 HydrophobicContact CG-CE2 4.3Å; K709-F711 HydrophobicContact CG-CZ 3.79Å; F711-F714 HydrophobicContact CB-CE2 4.05Å; F711-F714 HydrophobicContact CB-CZ 3.89Å; F711-L741 HydrophobicContact CD2-CD2 3.96Å; F711-L741 HydrophobicContact CE1-CD2 4.39Å; F711-L741 HydrophobicContact CE2-CD2 3.87Å; F711-L741 HydrophobicContact CG-CD2 4.29Å; F711-L741 HydrophobicContact CZ-CD2 4.09Å; F711-L748 HydrophobicContact CZ-CB 3.87Å; F711-T750 HydrophobicContact CB-CG2 4.31Å; F711-T750 HydrophobicContact CD1-CG2 3.12Å; F711-T750 HydrophobicContact CD2-CG2 4.46Å; F711-T750 HydrophobicContact CE1-CG2 3.33Å; F711-T750 HydrophobicContact CG-CG2 3.74Å; F711-T750 HydrophobicContact CZ-CG2 4.13Å
712	G	68.3	Low	85.3	Confident	46 Å²	46	57.7 Å²	57.7	47%	0.474	30%	0.302	S	S	.	.			trans	163.5	179.3	174.6	0	0	0	0	0	111.4
713	E	68.9	Low	85.7	Confident	123 Å²	123	55.5 Å²	55.5	58%	0.575	29%	0.286	S	S	*	.			cis	-95.2	106.7	7.4	-161.6	-179.3	-173.7	0	0	109.8	R690	R690-E713 IonicContact CZ-OE1 2.74Å; R690-E713 IonicContact NH2-OE1 2.71Å; R690-E713 PolarHBondContact NH2-OE1 2.86Å
714	F	76.1	Confident	86	Confident	42 Å²	42	62 Å²	62	18%	0.184	32%	0.315	C	S	.	.			trans	-73.1	163.4	-177.6	-59.4	-67.8	0	0	0	111.3	R690 V692 F711 D716 F739	R690-F714 HydrophobicContact CB-CB 4.3Å; R690-F714 VanDerWaalsContact CB-O 3.28Å; R690-F714 WeakPolarHBondContact CB-O 3.37Å; R690-F714 WeakPolarHBondContact CD-O 3.33Å; R690-F714 PolarHBondContact NE-O 3.38Å; R690-F714 WeakPolarHBondContact O-CD2 3.4Å; R690-F714 PolarHBondContact O-N 3.19Å; V692-F714 HydrophobicContact CB-CE2 4.32Å; V692-F714 HydrophobicContact CG2-CD2 4.39Å; V692-F714 HydrophobicContact CG2-CE2 3.9Å; F711-F714 HydrophobicContact CB-CE2 4.05Å; F711-F714 HydrophobicContact CB-CZ 3.89Å; F714-D716 WeakPolarHBondContact CB-O 3.5Å; F714-D716 PolarHBondContact O-N 2.86Å; F714-F739 HydrophobicContact CD1-CD1 4.36Å; F714-F739 AromaticContact CD1-CE1 3.73Å; F714-F739 HydrophobicContact CD1-CE1 3.73Å; F714-F739 HydrophobicContact CD1-CZ 4.22Å; F714-F739 HydrophobicContact CD2-CE1 4.17Å; F714-F739 HydrophobicContact CD2-CZ 4.05Å; F714-F739 HydrophobicContact CE1-CD1 4.03Å; F714-F739 AromaticContact CE1-CE1 3.51Å; F714-F739 HydrophobicContact CE1-CE1 3.51Å; F714-F739 HydrophobicContact CE1-CE2 4.32Å; F714-F739 AromaticContact CE1-CZ 3.67Å; F714-F739 HydrophobicContact CE1-CZ 3.67Å; F714-F739 AromaticContact CE2-CE1 4Å; F714-F739 HydrophobicContact CE2-CE1 4Å; F714-F739 HydrophobicContact CE2-CE2 4.33Å; F714-F739 AromaticContact CE2-CZ 3.5Å; F714-F739 HydrophobicContact CE2-CZ 3.5Å; F714-F739 HydrophobicContact CG-CE1 4.07Å; F714-F739 HydrophobicContact CG-CZ 4.4Å; F714-F739 HydrophobicContact CZ-CD1 4.46Å; F714-F739 AromaticContact CZ-CE1 3.66Å; F714-F739 HydrophobicContact CZ-CE1 3.66Å; F714-F739 AromaticContact CZ-CE2 3.84Å; F714-F739 HydrophobicContact CZ-CE2 3.84Å; F714-F739 AromaticContact CZ-CZ 3.28Å; F714-F739 HydrophobicContact CZ-CZ 3.28Å
715	S	71.3	Confident	85.9	Confident	71 Å²	71	56.5 Å²	56.5	50%	0.497	29%	0.289	S	S	.	.	S	Bend	trans	-60.6	-33.2	174.5	38.6	0	0	0	0	112.7	S736	S715-S736 PolarHBondContact OG-OG 2.81Å
716	D	84	Confident	85.5	Confident	47 Å²	47	60.1 Å²	60.1	25%	0.251	30%	0.302	S	S	.	.	S	Bend	trans	-151.5	164.4	-172.9	53.2	-34.1	0	0	0	110.8	F714 P718 C735 S736	F714-D716 WeakPolarHBondContact CB-O 3.5Å; F714-D716 PolarHBondContact O-N 2.86Å; D716-P718 WeakPolarHBondContact O-CD 3.17Å; D716-C735 WeakPolarHBondContact OD1-CB 3.28Å; D716-C735 WeakPolarHBondContact OD2-CA 3.4Å; D716-C735 WeakPolarHBondContact OD2-CB 3.31Å; D716-S736 VanDerWaalsContact CG-OG 3.29Å; D716-S736 WeakPolarHBondContact OD1-CB 3.07Å; D716-S736 PolarHBondContact OD1-N 2.98Å; D716-S736 PolarHBondContact OD1-OG 3.19Å; D716-S736 WeakPolarHBondContact OD2-CB 3.49Å; D716-S736 PolarHBondContact OD2-N 2.92Å; D716-S736 PolarHBondContact OD2-OG 3.24Å
717	Y	87.5	Confident	85.2	Confident	111 Å²	111	60.6 Å²	60.6	44%	0.435	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-80.2	120.7	-179.6	56.9	-92.8	0	0	0	110.5	R670 T687	R670-Y717 HydrophobicContact CB-CD2 4.02Å; R670-Y717 HydrophobicContact CG-CD2 4.07Å; R670-Y717 HydrophobicContact CG-CG 4.3Å; R670-Y717 PolarHBondContact NH2-OH 3.19Å; T687-Y717 WeakPolarHBondContact O-CB 3.45Å
718	P	91.2	Very high	85.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-78.1	143.6	-176.7	26.9	-33.6	0	0	0	114.3	S686 V692 D716 A733 C734 C735 F739	S686-P718 WeakPolarHBondContact CB-O 3.27Å; S686-P718 WeakPolarHBondContact OG-CD 3.44Å; S686-P718 PolarHBondContact OG-O 3.28Å; V692-P718 HydrophobicContact CG2-CG 3.39Å; D716-P718 WeakPolarHBondContact O-CD 3.17Å; P718-A733 HydrophobicContact CB-CB 3.73Å; P718-A733 HydrophobicContact CG-CB 4.35Å; P718-C734 CarbonylContact C-O 3.5Å; P718-C734 VanDerWaalsContact CA-O 3.27Å; P718-C734 WeakPolarHBondContact CA-O 3.26Å; P718-C735 HydrophobicContact CB-CB 4.11Å; P718-F739 HydrophobicContact CB-CE1 4.4Å; P718-F739 HydrophobicContact CB-CZ 4.44Å; P718-F739 HydrophobicContact CG-CE1 4.41Å; P718-F739 HydrophobicContact CG-CZ 4.15Å
719	T	93.6	Very high	85.6	Confident	64 Å²	64	62.9 Å²	62.9	39%	0.393	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	126.1	164.3	-56.1	0	0	0	0	109.2	C734	T719-C734 PolarHBondContact N-O 3.37Å; T719-C734 WeakPolarHBondContact O-CB 3.43Å; T719-C734 PolarHBondContact O-N 2.76Å
720	L	95.6	Very high	86	Confident	9 Å²	9	61.4 Å²	61.4	5%	0.047	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	141.4	-173	-56.6	174.5	0	0	0	111.1	S671 Q673 F684 V692 V731 I732 A733	S671-L720 PolarHBondContact OG-N 2.78Å; Q673-L720 HydrophobicContact CB-CB 3.78Å; Q673-L720 HydrophobicContact CB-CD1 4.47Å; F684-L720 HydrophobicContact CB-CD1 3.73Å; V692-L720 HydrophobicContact CG1-CD1 4.43Å; V692-L720 HydrophobicContact CG1-CD2 4.34Å; V692-L720 HydrophobicContact CG2-CD2 4.36Å; L720-V731 HydrophobicContact CB-CG1 4.03Å; L720-V731 HydrophobicContact CD2-CG1 4.18Å; L720-I732 CarbonylContact C-O 3.45Å; L720-A733 HydrophobicContact CD2-CB 3.85Å
721	K	94.4	Very high	86.5	Confident	65 Å²	65	59.1 Å²	59.1	28%	0.283	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	123.6	172.1	-175.5	63.5	177.9	174.6	0	111.3	V723 V731 I732	K721-V723 HydrophobicContact CG-CG1 4.19Å; K721-V731 CarbonylContact O-C 3.55Å; K721-V731 WeakPolarHBondContact O-CA 3.3Å; K721-I732 PolarHBondContact N-O 3.4Å; K721-I732 PolarHBondContact O-N 2.97Å
722	C	94.2	Very high	87.1	Confident	36 Å²	36	58.3 Å²	58.3	24%	0.243	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	133.2	171.4	-173	0	0	0	0	110	Q673	Q673-C722 VanDerWaalsContact CD-CB 3.48Å; Q673-C722 VanDerWaalsContact CD-N 3.27Å; Q673-C722 HydrophobicContact CG-CB 3.66Å
723	V	92.4	Very high	88.3	Confident	6 Å²	6	56.1 Å²	56.1	4%	0.036	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	157.4	-179.7	-64.5	0	0	0	0	111	K721 I725 A730 I732 T763 F773	K721-V723 HydrophobicContact CG-CG1 4.19Å; V723-I725 HydrophobicContact CG2-CD1 4.03Å; V723-I725 HydrophobicContact CG2-CG1 3.98Å; V723-A730 HydrophobicContact CG2-CB 4.22Å; V723-A730 PolarHBondContact N-O 2.84Å; V723-A730 PolarHBondContact O-N 2.81Å; V723-I732 HydrophobicContact CG1-CD1 4.03Å; V723-I732 HydrophobicContact CG1-CG1 4.4Å; V723-I732 HydrophobicContact CG2-CD1 3.82Å; V723-I732 HydrophobicContact CG2-CG1 3.72Å; V723-T763 HydrophobicContact CG1-CG2 4.48Å; V723-F773 HydrophobicContact CB-CE1 3.77Å; V723-F773 HydrophobicContact CB-CZ 4.41Å; V723-F773 HydrophobicContact CG1-CD1 4.22Å; V723-F773 HydrophobicContact CG1-CE1 3.82Å; V723-F773 HydrophobicContact CG2-CE1 4.31Å
724	K	90.3	Very high	89.5	Confident	137 Å²	137	50.5 Å²	50.5	60%	0.596	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.6	168.7	-165.3	-179.8	178.6	-176.8	0	108.5	R726	K724-R726 WeakPolarHBondContact CE-O 3.34Å; K724-R726 WeakPolarHBondContact CG-O 3.27Å
725	I	88.1	Confident	90.1	Very high	7 Å²	7	48.8 Å²	48.8	4%	0.036	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	106.9	178.1	-60.6	168.4	0	0	0	106.7	V723 D727 K728 A730 I740 F773 I786 L789	V723-I725 HydrophobicContact CG2-CD1 4.03Å; V723-I725 HydrophobicContact CG2-CG1 3.98Å; I725-D727 PolarHBondContact O-N 2.78Å; I725-D727 VanDerWaalsContact O-N 3.15Å; I725-K728 PolarHBondContact N-O 2.83Å; I725-K728 PolarHBondContact O-N 3.06Å; I725-A730 HydrophobicContact CD1-CB 3.95Å; I725-I740 HydrophobicContact CD1-CD1 3.87Å; I725-I740 HydrophobicContact CD1-CG2 4.1Å; I725-F773 HydrophobicContact CG1-CE2 4.07Å; I725-F773 HydrophobicContact CG1-CZ 3.65Å; I725-I786 HydrophobicContact CD1-CD1 4.22Å; I725-I786 HydrophobicContact CG2-CB 4.4Å; I725-I786 HydrophobicContact CG2-CG2 3.98Å; I725-L789 HydrophobicContact CB-CD1 4.38Å; I725-L789 HydrophobicContact CD1-CD2 3.87Å; I725-L789 HydrophobicContact CG2-CD1 4.4Å; I725-L789 HydrophobicContact CG2-CD2 4.47Å; I725-L789 HydrophobicContact CG2-CG 4.21Å
726	R	84.1	Confident	90.8	Very high	144 Å²	144	47.2 Å²	47.2	54%	0.543	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	-113.3	-167	-58.4	179.9	173.5	-177.4	-1.5	110.5	K724 V787	K724-R726 WeakPolarHBondContact CE-O 3.34Å; K724-R726 WeakPolarHBondContact CG-O 3.27Å; R726-V787 PolarHBondContact NE-O 3.14Å; R726-V787 PolarHBondContact NH2-O 3.34Å
727	D	83.6	Confident	90.7	Very high	147 Å²	147	47.3 Å²	47.3	79%	0.786	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.7	1.9	-179.7	-61	-40	0	0	0	113.7	I725	I725-D727 PolarHBondContact O-N 2.78Å; I725-D727 VanDerWaalsContact O-N 3.15Å
728	K	88.6	Confident	90.8	Very high	121 Å²	121	42 Å²	42	53%	0.526	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.5	-176.3	-65.7	-174.6	-178.7	178.8	0	111.6	I725 L789	I725-K728 PolarHBondContact N-O 2.83Å; I725-K728 PolarHBondContact O-N 3.06Å; K728-L789 HydrophobicContact CB-CD1 4.13Å; K728-L789 HydrophobicContact CD-CD1 4.19Å
729	T	92.1	Very high	90.7	Very high	49 Å²	49	42.2 Å²	42.2	30%	0.301	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	135.5	169.7	-32.5	0	0	0	0	110.1	C675 L676	C675-T729 WeakPolarHBondContact SG-CG2 3.47Å; L676-T729 VanDerWaalsContact O-CB 3.25Å; L676-T729 WeakPolarHBondContact O-CB 3.48Å; L676-T729 WeakPolarHBondContact O-CG2 3.41Å; L676-T729 PolarHBondContact O-OG1 3.37Å
730	A	93.9	Very high	90.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	167.3	179.9	0	0	0	0	0	110.2	V723 I725 I740 L741	V723-A730 HydrophobicContact CG2-CB 4.22Å; V723-A730 PolarHBondContact N-O 2.84Å; V723-A730 PolarHBondContact O-N 2.81Å; I725-A730 HydrophobicContact CD1-CB 3.95Å; A730-I740 HydrophobicContact CB-CG2 3.71Å; A730-L741 CarbonylContact C-O 3.58Å; A730-L741 WeakPolarHBondContact CA-O 3.4Å; A730-L741 WeakPolarHBondContact CB-O 3.44Å
731	V	95.2	Very high	90.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	122.8	172.4	176.8	0	0	0	0	108.8	Q673 C675 M677 F684 L720 K721 I740 L741	Q673-V731 HydrophobicContact CG-CG1 4.41Å; Q673-V731 HydrophobicContact CG-CG2 4.41Å; C675-V731 HydrophobicContact CB-CG2 3.76Å; M677-V731 HydrophobicContact CE-CG2 3.98Å; F684-V731 HydrophobicContact CD2-CB 4.49Å; F684-V731 HydrophobicContact CD2-CG2 3.7Å; F684-V731 HydrophobicContact CE2-CG2 3.78Å; F684-V731 HydrophobicContact CG-CG2 4.35Å; F684-V731 HydrophobicContact CZ-CG2 4.48Å; L720-V731 HydrophobicContact CB-CG1 4.03Å; L720-V731 HydrophobicContact CD2-CG1 4.18Å; K721-V731 CarbonylContact O-C 3.55Å; K721-V731 WeakPolarHBondContact O-CA 3.3Å; V731-I740 CarbonylContact O-C 3.04Å; V731-I740 WeakPolarHBondContact O-CA 3.44Å; V731-L741 HydrophobicContact CB-CB 4.18Å; V731-L741 HydrophobicContact CB-CD1 4.43Å; V731-L741 HydrophobicContact CG1-CD1 4.38Å; V731-L741 PolarHBondContact N-O 2.92Å; V731-L741 PolarHBondContact O-N 2.99Å
732	I	94.9	Very high	90.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	125.8	172.2	-61.2	176.1	0	0	0	108.1	L720 K721 V723 I740 V761 F773 I786	L720-I732 CarbonylContact C-O 3.45Å; K721-I732 PolarHBondContact N-O 3.4Å; K721-I732 PolarHBondContact O-N 2.97Å; V723-I732 HydrophobicContact CG1-CD1 4.03Å; V723-I732 HydrophobicContact CG1-CG1 4.4Å; V723-I732 HydrophobicContact CG2-CD1 3.82Å; V723-I732 HydrophobicContact CG2-CG1 3.72Å; I732-I740 HydrophobicContact CD1-CD1 4.34Å; I732-I740 HydrophobicContact CG1-CD1 4.07Å; I732-I740 HydrophobicContact CG1-CG1 4.08Å; I732-I740 HydrophobicContact CG1-CG2 4.47Å; I732-V761 HydrophobicContact CD1-CG1 4Å; I732-V761 HydrophobicContact CG2-CG2 4.14Å; I732-F773 HydrophobicContact CD1-CD1 4.39Å; I732-I786 HydrophobicContact CD1-CD1 4.37Å
733	A	94.3	Very high	89.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	111.8	172.4	0	0	0	0	0	108.8	P718 L720 P738 F739	P718-A733 HydrophobicContact CB-CB 3.73Å; P718-A733 HydrophobicContact CG-CB 4.35Å; L720-A733 HydrophobicContact CD2-CB 3.85Å; A733-P738 VanDerWaalsContact O-CA 3.25Å; A733-P738 WeakPolarHBondContact O-CA 3.16Å; A733-F739 HydrophobicContact CB-CD1 3.9Å; A733-F739 HydrophobicContact CB-CD2 3.65Å; A733-F739 HydrophobicContact CB-CE1 3.56Å; A733-F739 HydrophobicContact CB-CE2 3.27Å; A733-F739 HydrophobicContact CB-CG 3.95Å; A733-F739 HydrophobicContact CB-CZ 3.23Å; A733-F739 PolarHBondContact N-O 2.8Å; A733-F739 PolarHBondContact O-N 2.85Å; A733-F739 VanDerWaalsContact O-N 3.08Å
734	C	93.5	Very high	89.2	Confident	4 Å²	4	40.8 Å²	40.8	3%	0.027	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	116.6	-178.6	-53.6	0	0	0	0	109.4	P718 T719 T758 V761	P718-C734 CarbonylContact C-O 3.5Å; P718-C734 VanDerWaalsContact CA-O 3.27Å; P718-C734 WeakPolarHBondContact CA-O 3.26Å; T719-C734 PolarHBondContact N-O 3.37Å; T719-C734 WeakPolarHBondContact O-CB 3.43Å; T719-C734 PolarHBondContact O-N 2.76Å; C734-T758 CarbonylContact C-O 3.6Å; C734-T758 HydrophobicContact CB-CG2 4.14Å; C734-V761 VanDerWaalsContact SG-CG2 3.6Å
735	C	90	Very high	88.5	Confident	7 Å²	7	40.7 Å²	40.7	5%	0.047	19%	0.187	C	C	.	.	S	Bend	trans	-155.9	-166.4	177.2	64	0	0	0	0	109.1	D716 P718 Q737 T758	D716-C735 WeakPolarHBondContact OD1-CB 3.28Å; D716-C735 WeakPolarHBondContact OD2-CA 3.4Å; D716-C735 WeakPolarHBondContact OD2-CB 3.31Å; P718-C735 HydrophobicContact CB-CB 4.11Å; C735-Q737 PolarHBondContact O-N 2.78Å; C735-Q737 PolarHBondContact SG-O 3.38Å; C735-T758 PolarHBondContact N-O 2.8Å; C735-T758 PolarHBondContact O-N 2.94Å
736	S	85.7	Confident	88	Confident	38 Å²	38	48 Å²	48	27%	0.266	22%	0.219	S	C	.	.	S	Bend	trans	-59	-30.6	176.1	64.1	0	0	0	0	112.8	S715 D716	S715-S736 PolarHBondContact OG-OG 2.81Å; D716-S736 VanDerWaalsContact CG-OG 3.29Å; D716-S736 WeakPolarHBondContact OD1-CB 3.07Å; D716-S736 PolarHBondContact OD1-N 2.98Å; D716-S736 PolarHBondContact OD1-OG 3.19Å; D716-S736 WeakPolarHBondContact OD2-CB 3.49Å; D716-S736 PolarHBondContact OD2-N 2.92Å; D716-S736 PolarHBondContact OD2-OG 3.24Å
737	Q	82.3	Confident	87.7	Confident	48 Å²	48	43.5 Å²	43.5	22%	0.224	20%	0.202	C	C	.	.	S	Bend	trans	-129.3	85.4	172.1	-65.8	-173.9	7.1	0	0	110.1	C735	C735-Q737 PolarHBondContact O-N 2.78Å; C735-Q737 PolarHBondContact SG-O 3.38Å
738	P	89.5	Confident	87.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.166	C	C	.	.			trans	-61.2	145.6	-172.5	25.2	-33.8	0	0	0	112.5	A733 V753 V755	A733-P738 VanDerWaalsContact O-CA 3.25Å; A733-P738 WeakPolarHBondContact O-CA 3.16Å; P738-V753 PolarHBondContact O-N 3.42Å; P738-V755 HydrophobicContact CG-CB 4.19Å; P738-V755 HydrophobicContact CG-CG2 4.48Å
739	F	88.4	Confident	87.4	Confident	5 Å²	5	32.6 Å²	32.6	2%	0.022	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	159.2	179.4	60.7	-90.6	0	0	0	112	V692 F714 P718 A733 L741 T751	V692-F739 HydrophobicContact CG2-CZ 4.1Å; F714-F739 HydrophobicContact CD1-CD1 4.36Å; F714-F739 AromaticContact CD1-CE1 3.73Å; F714-F739 HydrophobicContact CD1-CE1 3.73Å; F714-F739 HydrophobicContact CD1-CZ 4.22Å; F714-F739 HydrophobicContact CD2-CE1 4.17Å; F714-F739 HydrophobicContact CD2-CZ 4.05Å; F714-F739 HydrophobicContact CE1-CD1 4.03Å; F714-F739 AromaticContact CE1-CE1 3.51Å; F714-F739 HydrophobicContact CE1-CE1 3.51Å; F714-F739 HydrophobicContact CE1-CE2 4.32Å; F714-F739 AromaticContact CE1-CZ 3.67Å; F714-F739 HydrophobicContact CE1-CZ 3.67Å; F714-F739 AromaticContact CE2-CE1 4Å; F714-F739 HydrophobicContact CE2-CE1 4Å; F714-F739 HydrophobicContact CE2-CE2 4.33Å; F714-F739 AromaticContact CE2-CZ 3.5Å; F714-F739 HydrophobicContact CE2-CZ 3.5Å; F714-F739 HydrophobicContact CG-CE1 4.07Å; F714-F739 HydrophobicContact CG-CZ 4.4Å; F714-F739 HydrophobicContact CZ-CD1 4.46Å; F714-F739 AromaticContact CZ-CE1 3.66Å; F714-F739 HydrophobicContact CZ-CE1 3.66Å; F714-F739 AromaticContact CZ-CE2 3.84Å; F714-F739 HydrophobicContact CZ-CE2 3.84Å; F714-F739 AromaticContact CZ-CZ 3.28Å; F714-F739 HydrophobicContact CZ-CZ 3.28Å; P718-F739 HydrophobicContact CB-CE1 4.4Å; P718-F739 HydrophobicContact CB-CZ 4.44Å; P718-F739 HydrophobicContact CG-CE1 4.41Å; P718-F739 HydrophobicContact CG-CZ 4.15Å; A733-F739 HydrophobicContact CB-CD1 3.9Å; A733-F739 HydrophobicContact CB-CD2 3.65Å; A733-F739 HydrophobicContact CB-CE1 3.56Å; A733-F739 HydrophobicContact CB-CE2 3.27Å; A733-F739 HydrophobicContact CB-CG 3.95Å; A733-F739 HydrophobicContact CB-CZ 3.23Å; A733-F739 PolarHBondContact N-O 2.8Å; A733-F739 PolarHBondContact O-N 2.85Å; A733-F739 VanDerWaalsContact O-N 3.08Å; F739-L741 HydrophobicContact CD2-CD2 4.01Å; F739-L741 HydrophobicContact CD2-CG 4.11Å; F739-L741 HydrophobicContact CE2-CD1 4.16Å; F739-L741 HydrophobicContact CE2-CD2 3.77Å; F739-L741 HydrophobicContact CE2-CG 3.89Å; F739-T751 CarbonylContact C-O 3.58Å; F739-T751 VanDerWaalsContact CA-O 3.3Å; F739-T751 WeakPolarHBondContact CA-O 3.49Å; F739-T751 WeakPolarHBondContact CB-O 3.32Å
740	I	91.6	Very high	87	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.7	179.6	-48.3	-163.3	0	0	0	109.1	I474 I725 A730 V731 I732 Y742 T750 T751 V753 I786 L789	I474-I740 HydrophobicContact CD1-CB 3.77Å; I474-I740 HydrophobicContact CD1-CD1 3.55Å; I474-I740 HydrophobicContact CD1-CG1 3.67Å; I725-I740 HydrophobicContact CD1-CD1 3.87Å; I725-I740 HydrophobicContact CD1-CG2 4.1Å; A730-I740 HydrophobicContact CB-CG2 3.71Å; V731-I740 CarbonylContact O-C 3.04Å; V731-I740 WeakPolarHBondContact O-CA 3.44Å; I732-I740 HydrophobicContact CD1-CD1 4.34Å; I732-I740 HydrophobicContact CG1-CD1 4.07Å; I732-I740 HydrophobicContact CG1-CG1 4.08Å; I732-I740 HydrophobicContact CG1-CG2 4.47Å; I740-Y742 HydrophobicContact CG2-CD1 4.23Å; I740-T750 CarbonylContact O-C 3.59Å; I740-T750 VanDerWaalsContact O-CA 3.32Å; I740-T750 WeakPolarHBondContact O-CA 3.15Å; I740-T751 PolarHBondContact N-O 3.08Å; I740-T751 PolarHBondContact O-N 3.17Å; I740-V753 HydrophobicContact CD1-CG2 3.7Å; I740-V753 HydrophobicContact CG1-CG2 3.41Å; I740-V753 VanDerWaalsContact CG1-CG2 3.41Å; I740-I786 HydrophobicContact CD1-CD1 3.61Å; I740-L789 HydrophobicContact CG2-CD2 4.23Å
741	L	91.4	Very high	86.4	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	120.2	171.7	-59.8	170.4	0	0	0	108.2	F684 V692 F711 A730 V731 F739 T749 T750	F684-L741 HydrophobicContact CD1-CD1 3.69Å; F684-L741 HydrophobicContact CE1-CB 4.21Å; F684-L741 HydrophobicContact CE1-CD1 3.87Å; V692-L741 HydrophobicContact CG1-CD1 3.87Å; F711-L741 HydrophobicContact CD2-CD2 3.96Å; F711-L741 HydrophobicContact CE1-CD2 4.39Å; F711-L741 HydrophobicContact CE2-CD2 3.87Å; F711-L741 HydrophobicContact CG-CD2 4.29Å; F711-L741 HydrophobicContact CZ-CD2 4.09Å; A730-L741 CarbonylContact C-O 3.58Å; A730-L741 WeakPolarHBondContact CA-O 3.4Å; A730-L741 WeakPolarHBondContact CB-O 3.44Å; V731-L741 HydrophobicContact CB-CB 4.18Å; V731-L741 HydrophobicContact CB-CD1 4.43Å; V731-L741 HydrophobicContact CG1-CD1 4.38Å; V731-L741 PolarHBondContact N-O 2.92Å; V731-L741 PolarHBondContact O-N 2.99Å; F739-L741 HydrophobicContact CD2-CD2 4.01Å; F739-L741 HydrophobicContact CD2-CG 4.11Å; F739-L741 HydrophobicContact CE2-CD1 4.16Å; F739-L741 HydrophobicContact CE2-CD2 3.77Å; F739-L741 HydrophobicContact CE2-CG 3.89Å; L741-T749 WeakPolarHBondContact CA-O 3.3Å; L741-T750 HydrophobicContact CD2-CG2 3.26Å
742	Y	90.1	Very high	85.7	Confident	3 Å²	3	35.8 Å²	35.8	1%	0.012	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	167.3	178	66.4	-79.2	0	0	0	110.5	I740 R744 T749 T751 L789	I740-Y742 HydrophobicContact CG2-CD1 4.23Å; Y742-R744 HydrophobicContact CD2-CB 4.4Å; Y742-R744 HydrophobicContact CE2-CB 3.91Å; Y742-T749 PolarHBondContact N-O 2.75Å; Y742-T749 VanDerWaalsContact N-O 3.07Å; Y742-T749 PolarHBondContact O-N 2.55Å; Y742-T751 WeakPolarHBondContact CE1-OG1 3.39Å; Y742-T751 PolarHBondContact OH-OG1 2.74Å; Y742-L789 HydrophobicContact CD1-CD2 4.17Å; Y742-L789 HydrophobicContact CD2-CB 4.23Å; Y742-L789 HydrophobicContact CD2-CD1 4.17Å; Y742-L789 HydrophobicContact CE1-CD2 4.4Å; Y742-L789 HydrophobicContact CE2-CB 3.99Å; Y742-L789 HydrophobicContact CG-CD1 4.23Å; Y742-L789 HydrophobicContact CG-CD2 4.35Å
743	R	87	Confident	85.2	Confident	45 Å²	45	36 Å²	36	17%	0.17	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.1	178.3	-159	163.8	125.6	163	-2.8	110.9	E678 R747 L748	E678-R743 WeakPolarHBondContact OE1-CG 3.34Å; E678-R743 IonicContact OE1-CZ 3.51Å; E678-R743 IonicContact OE1-NE 3.47Å; E678-R743 PolarHBondContact OE1-NE 3.04Å; E678-R743 VanDerWaalsContact OE1-NE 3.07Å; E678-R743 IonicContact OE2-CZ 3.62Å; E678-R743 IonicContact OE2-NE 2.78Å; E678-R743 PolarHBondContact OE2-NE 3.43Å; E678-R743 IonicContact OE2-NH2 3.72Å; E678-R743 PolarHBondContact OE2-NH2 3.1Å; R743-R747 CarbonylContact C-O 3.38Å; R743-R747 VanDerWaalsContact CA-O 3.27Å; R743-R747 WeakPolarHBondContact CA-O 3.41Å; R743-L748 HydrophobicContact CB-CD2 4.39Å
744	R	78	Confident	84.5	Confident	101 Å²	101	38.6 Å²	38.6	38%	0.381	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.9	175.4	-171.2	176.9	-178	-177.3	-1.2	108.9	Y742 K746 R747 S791	Y742-R744 HydrophobicContact CD2-CB 4.4Å; Y742-R744 HydrophobicContact CE2-CB 3.91Å; R744-K746 PolarHBondContact O-N 3.39Å; R744-R747 PolarHBondContact N-O 3.41Å; R744-R747 WeakPolarHBondContact O-CB 3.35Å; R744-R747 PolarHBondContact O-N 2.92Å; R744-S791 PolarHBondContact NH1-OG 3.03Å
745	K	76.4	Confident	83.9	Confident	135 Å²	135	39.2 Å²	39.2	59%	0.587	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.2	46.2	-175.4	-65.3	-177	167.3	-172.6	0	112.6	R747 D1196	K745-R747 PolarHBondContact O-N 3.18Å; K745-D1196 IonicContact NZ-OD1 3.78Å; K745-D1196 IonicContact NZ-OD2 3.65Å; K745-D1196 PolarHBondContact NZ-OD2 2.63Å
746	K	77	Confident	83.5	Confident	161 Å²	161	40.2 Å²	40.2	70%	0.7	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.9	10.8	-177.1	-52.8	-179.3	176.9	-178.6	0	116.4	R744	R744-K746 PolarHBondContact O-N 3.39Å
747	R	78	Confident	83.6	Confident	49 Å²	49	41.8 Å²	41.8	19%	0.185	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.3	179.3	-68.1	158.5	162.2	-80.8	-22.4	110.6	R743 R744 K745 L1195 E1234	R743-R747 CarbonylContact C-O 3.38Å; R743-R747 VanDerWaalsContact CA-O 3.27Å; R743-R747 WeakPolarHBondContact CA-O 3.41Å; R744-R747 PolarHBondContact N-O 3.41Å; R744-R747 WeakPolarHBondContact O-CB 3.35Å; R744-R747 PolarHBondContact O-N 2.92Å; K745-R747 PolarHBondContact O-N 3.18Å; R747-L1195 VanDerWaalsContact CZ-CA 3.47Å; R747-L1195 VanDerWaalsContact CZ-CB 3.41Å; R747-L1195 PolarHBondContact NE-O 3.38Å; R747-L1195 VanDerWaalsContact NH2-C 3.28Å; R747-L1195 PolarHBondContact NH2-O 2.67Å; R747-E1234 IonicContact CZ-OE1 3.7Å; R747-E1234 IonicContact NH1-OE1 2.76Å; R747-E1234 PolarHBondContact NH1-OE1 3.36Å; R747-E1234 IonicContact NH2-OE1 2.7Å
748	L	86	Confident	84	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	126.8	170.4	-67.9	173.3	0	0	0	110.1	M677 F684 A694 E708 K709 F711 R743	M677-L748 HydrophobicContact SD-CD2 3.74Å; F684-L748 HydrophobicContact CZ-CD1 4.47Å; F684-L748 HydrophobicContact CZ-CD2 4.25Å; A694-L748 HydrophobicContact CB-CD1 3.65Å; E708-L748 HydrophobicContact CB-CD1 4.47Å; E708-L748 HydrophobicContact CG-CD1 4.02Å; E708-L748 WeakPolarHBondContact OE2-CD1 2.99Å; K709-L748 PolarHBondContact NZ-O 3.46Å; F711-L748 HydrophobicContact CZ-CB 3.87Å; R743-L748 HydrophobicContact CB-CD2 4.39Å
749	T	80.5	Confident	84.1	Confident	34 Å²	34	41.9 Å²	41.9	21%	0.209	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	150.7	-179.3	-73.1	0	0	0	0	109.5	L741 Y742	L741-T749 WeakPolarHBondContact CA-O 3.3Å; Y742-T749 PolarHBondContact N-O 2.75Å; Y742-T749 VanDerWaalsContact N-O 3.07Å; Y742-T749 PolarHBondContact O-N 2.55Å
750	T	83.9	Confident	84.4	Confident	24 Å²	24	42 Å²	42	15%	0.147	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	143.9	171.6	79.4	0	0	0	0	109.2	F711 I740 L741	F711-T750 HydrophobicContact CB-CG2 4.31Å; F711-T750 HydrophobicContact CD1-CG2 3.12Å; F711-T750 HydrophobicContact CD2-CG2 4.46Å; F711-T750 HydrophobicContact CE1-CG2 3.33Å; F711-T750 HydrophobicContact CG-CG2 3.74Å; F711-T750 HydrophobicContact CZ-CG2 4.13Å; I740-T750 CarbonylContact O-C 3.59Å; I740-T750 VanDerWaalsContact O-CA 3.32Å; I740-T750 WeakPolarHBondContact O-CA 3.15Å; L741-T750 HydrophobicContact CD2-CG2 3.26Å
751	T	81.3	Confident	84.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	135.1	169.4	-51.3	0	0	0	0	110	I474 F739 I740 Y742	I474-T751 HydrophobicContact CD1-CG2 4.22Å; I474-T751 HydrophobicContact CG1-CG2 3.64Å; F739-T751 CarbonylContact C-O 3.58Å; F739-T751 VanDerWaalsContact CA-O 3.3Å; F739-T751 WeakPolarHBondContact CA-O 3.49Å; F739-T751 WeakPolarHBondContact CB-O 3.32Å; I740-T751 PolarHBondContact N-O 3.08Å; I740-T751 PolarHBondContact O-N 3.17Å; Y742-T751 WeakPolarHBondContact CE1-OG1 3.39Å; Y742-T751 PolarHBondContact OH-OG1 2.74Å
752	R	81.1	Confident	84.6	Confident	91 Å²	91	42.6 Å²	42.6	34%	0.343	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	147.1	-178.7	-65.8	-178.1	177.3	-177.5	-1.8	111.4	S473 I474	S473-R752 VanDerWaalsContact CA-O 3.3Å; S473-R752 WeakPolarHBondContact CA-O 3.45Å; S473-R752 WeakPolarHBondContact CB-O 3.11Å; I474-R752 PolarHBondContact N-O 3.22Å
753	V	84.5	Confident	84.7	Confident	5 Å²	5	46.2 Å²	46.2	3%	0.03	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-107.1	127.4	168.5	-162.7	0	0	0	0	107.6	N476 P738 I740 V755	N476-V753 HydrophobicContact CB-CG1 4.1Å; P738-V753 PolarHBondContact O-N 3.42Å; I740-V753 HydrophobicContact CD1-CG2 3.7Å; I740-V753 HydrophobicContact CG1-CG2 3.41Å; I740-V753 VanDerWaalsContact CG1-CG2 3.41Å; V753-V755 HydrophobicContact CB-CG2 4.08Å; V753-V755 HydrophobicContact CG1-CG2 3.45Å; V753-V755 VanDerWaalsContact CG1-CG2 3.45Å; V753-V755 PolarHBondContact O-N 2.76Å
754	L	78.2	Confident	84.8	Confident	55 Å²	55	44.1 Å²	44.1	29%	0.288	23%	0.225	S	C	.	.			trans	-80.3	71.6	179.8	-63.8	175.9	0	0	0	110.5	R471 S473 N476	R471-L754 HydrophobicContact CB-CD1 4.13Å; R471-L754 HydrophobicContact CG-CD1 4.37Å; S473-L754 VanDerWaalsContact CB-CG 3.49Å; S473-L754 WeakPolarHBondContact OG-CD1 3.43Å; S473-L754 WeakPolarHBondContact OG-CG 3.35Å; N476-L754 PolarHBondContact ND2-O 3.11Å
755	V	81.8	Confident	85.2	Confident	16 Å²	16	43.4 Å²	43.4	10%	0.097	23%	0.229	C	C	.	.			trans	-123.8	157.1	170.5	-150.9	0	0	0	0	108.1	P738 V753 F775 L777 I784	P738-V755 HydrophobicContact CG-CB 4.19Å; P738-V755 HydrophobicContact CG-CG2 4.48Å; V753-V755 HydrophobicContact CB-CG2 4.08Å; V753-V755 HydrophobicContact CG1-CG2 3.45Å; V753-V755 VanDerWaalsContact CG1-CG2 3.45Å; V753-V755 PolarHBondContact O-N 2.76Å; V755-F775 HydrophobicContact CB-CD1 4.39Å; V755-F775 HydrophobicContact CG1-CD1 4.3Å; V755-F775 HydrophobicContact CG2-CD1 4.13Å; V755-F775 HydrophobicContact CG2-CE1 3.95Å; V755-F775 HydrophobicContact CG2-CZ 4.37Å; V755-L777 HydrophobicContact CG1-CD1 4.17Å; V755-L777 HydrophobicContact CG1-CD2 3.66Å; V755-I784 HydrophobicContact CB-CD1 4.29Å; V755-I784 HydrophobicContact CG1-CD1 3.42Å; V755-I784 VanDerWaalsContact CG1-CD1 3.42Å; V755-I784 HydrophobicContact CG2-CD1 3.77Å
756	G	80.9	Confident	85.6	Confident	28 Å²	28	37.5 Å²	37.5	29%	0.289	20%	0.204	S	C	.	.	S	Bend	trans	-62.5	177	172.9	0	0	0	0	0	113	T758	G756-T758 PolarHBondContact O-N 2.84Å; G756-T758 VanDerWaalsContact O-N 3.11Å; G756-T758 PolarHBondContact O-OG1 3.25Å
757	P	87.5	Confident	85.9	Confident	71 Å²	71	32.5 Å²	32.5	46%	0.461	20%	0.198	S	C	.	.			trans	-50.6	120.3	177.5	-28.1	35.8	0	0	0	111.4	L777	P757-L777 WeakPolarHBondContact O-CA 3.48Å
758	T	91.5	Very high	86.2	Confident	6 Å²	6	32.7 Å²	32.7	4%	0.037	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	124.4	-171.6	-60.7	0	0	0	0	109.4	C734 C735 G756 S760 V761 F775 C776 L777	C734-T758 CarbonylContact C-O 3.6Å; C734-T758 HydrophobicContact CB-CG2 4.14Å; C735-T758 PolarHBondContact N-O 2.8Å; C735-T758 PolarHBondContact O-N 2.94Å; G756-T758 PolarHBondContact O-N 2.84Å; G756-T758 VanDerWaalsContact O-N 3.11Å; G756-T758 PolarHBondContact O-OG1 3.25Å; T758-S760 WeakPolarHBondContact CG2-O 3.5Å; T758-V761 HydrophobicContact CG2-CG2 3.83Å; T758-F775 HydrophobicContact CG2-CB 4.44Å; T758-F775 HydrophobicContact CG2-CD1 3.67Å; T758-F775 HydrophobicContact CG2-CE1 4.42Å; T758-F775 HydrophobicContact CG2-CG 4.47Å; T758-C776 WeakPolarHBondContact CA-O 3.28Å; T758-L777 WeakPolarHBondContact OG1-CD2 3.48Å
759	S	92.4	Very high	86.2	Confident	45 Å²	45	32.8 Å²	32.8	32%	0.315	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-36.1	177.4	59.2	0	0	0	0	112.4	V488 C776	V488-S759 VanDerWaalsContact O-CB 3.28Å; V488-S759 WeakPolarHBondContact O-CB 3.39Å; V488-S759 PolarHBondContact O-OG 2.72Å; S759-C776 PolarHBondContact N-O 3.48Å; S759-C776 WeakPolarHBondContact OG-CB 3.24Å; S759-C776 PolarHBondContact OG-O 3.44Å; S759-C776 PolarHBondContact OG-SG 2.91Å
760	S	93.2	Very high	86.5	Confident	6 Å²	6	34.9 Å²	34.9	4%	0.042	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	161.3	179.5	66.2	0	0	0	0	112.1	V488 Q489 T758 C776	V488-S760 PolarHBondContact O-OG 2.86Å; Q489-S760 VanDerWaalsContact CA-OG 3.29Å; Q489-S760 WeakPolarHBondContact CA-OG 2.87Å; T758-S760 WeakPolarHBondContact CG2-O 3.5Å; S760-C776 WeakPolarHBondContact O-CB 3.42Å; S760-C776 PolarHBondContact O-N 3.27Å; S760-C776 WeakPolarHBondContact OG-CB 3.3Å
761	V	94.7	Very high	86.6	Confident	8 Å²	8	38.9 Å²	38.9	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	141.4	174.4	171.4	0	0	0	0	109.9	I732 C734 T758 F773 L774 F775	I732-V761 HydrophobicContact CD1-CG1 4Å; I732-V761 HydrophobicContact CG2-CG2 4.14Å; C734-V761 VanDerWaalsContact SG-CG2 3.6Å; T758-V761 HydrophobicContact CG2-CG2 3.83Å; V761-F773 HydrophobicContact CG1-CB 4.16Å; V761-F773 HydrophobicContact CG1-CD1 4.28Å; V761-L774 WeakPolarHBondContact CA-O 3.37Å; V761-F775 HydrophobicContact CG2-CD1 3.55Å; V761-F775 HydrophobicContact CG2-CD2 4.31Å; V761-F775 HydrophobicContact CG2-CE1 3.58Å; V761-F775 HydrophobicContact CG2-CE2 4.36Å; V761-F775 HydrophobicContact CG2-CG 3.92Å; V761-F775 HydrophobicContact CG2-CZ 4.01Å
762	S	93.1	Very high	87.2	Confident	7 Å²	7	39 Å²	39	5%	0.049	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	166	167.5	57.3	0	0	0	0	111	A490 F773 L774	A490-S762 VanDerWaalsContact O-CB 3.25Å; A490-S762 WeakPolarHBondContact O-CB 3.49Å; A490-S762 PolarHBondContact O-OG 3.02Å; S762-F773 CarbonylContact O-C 3.59Å; S762-F773 WeakPolarHBondContact O-CA 3.12Å; S762-L774 PolarHBondContact N-O 3.22Å; S762-L774 VanDerWaalsContact N-O 3.08Å; S762-L774 PolarHBondContact O-N 3.38Å
763	T	91.5	Very high	87.8	Confident	78 Å²	78	35 Å²	35	48%	0.479	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	138.5	179	50.7	0	0	0	0	110.3	V723 F773	V723-T763 HydrophobicContact CG1-CG2 4.48Å; T763-F773 HydrophobicContact CG2-CD1 4.27Å; T763-F773 HydrophobicContact CG2-CE1 4.06Å
764	I	89.9	Confident	88.3	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	126.4	172.9	-179.9	170.6	0	0	0	108.8	F492 L518 T766 F769 S772 L774 V783	F492-I764 HydrophobicContact CB-CB 4.19Å; F492-I764 HydrophobicContact CB-CG1 4.3Å; F492-I764 HydrophobicContact CD1-CB 4.38Å; F492-I764 HydrophobicContact CD1-CG1 4.01Å; F492-I764 HydrophobicContact CD2-CD1 3.97Å; F492-I764 HydrophobicContact CD2-CG1 3.97Å; F492-I764 HydrophobicContact CE1-CG1 4.34Å; F492-I764 HydrophobicContact CE2-CD1 4.33Å; F492-I764 HydrophobicContact CE2-CG1 4.3Å; F492-I764 HydrophobicContact CG-CB 4.19Å; F492-I764 HydrophobicContact CG-CD1 4.25Å; F492-I764 HydrophobicContact CG-CG1 3.82Å; F492-I764 HydrophobicContact CZ-CG1 4.47Å; L518-I764 HydrophobicContact CD2-CD1 3.54Å; I764-T766 HydrophobicContact CG1-CG2 4.34Å; I764-F769 HydrophobicContact CD1-CD2 4.3Å; I764-S772 VanDerWaalsContact CG2-C 3.48Å; I764-S772 WeakPolarHBondContact CG2-O 3.24Å; I764-S772 PolarHBondContact N-O 2.96Å; I764-S772 CarbonylContact O-C 3.33Å; I764-S772 PolarHBondContact O-N 2.82Å; I764-S772 VanDerWaalsContact O-N 3.11Å; I764-L774 HydrophobicContact CG2-CB 4.35Å; I764-V783 HydrophobicContact CD1-CG2 4.32Å; I764-V783 HydrophobicContact CG2-CG1 3.97Å
765	N	86.3	Confident	89	Confident	87 Å²	87	32.1 Å²	32.1	47%	0.465	21%	0.21	S	C	.	.			trans	-136.3	103.6	179.6	-166.8	19.4	0	0	0	108.9	D771	N765-D771 PolarHBondContact OD1-N 3.35Å
766	T	85.6	Confident	89.7	Confident	11 Å²	11	31.4 Å²	31.4	7%	0.067	21%	0.206	C	C	.	.			trans	-131	165	175.4	65.2	0	0	0	0	109.3	F492 D501 L518 I764 T768 F769	F492-T766 HydrophobicContact CE1-CG2 4.05Å; F492-T766 HydrophobicContact CE2-CG2 3.98Å; F492-T766 HydrophobicContact CZ-CG2 3.4Å; D501-T766 WeakPolarHBondContact O-CB 3.34Å; L518-T766 HydrophobicContact CD2-CG2 4.37Å; I764-T766 HydrophobicContact CG1-CG2 4.34Å; T766-T768 PolarHBondContact O-N 3.47Å; T766-T768 PolarHBondContact OG1-OG1 2.98Å; T766-F769 PolarHBondContact N-O 3.42Å; T766-F769 VanDerWaalsContact N-O 3.16Å; T766-F769 CarbonylContact O-C 3.47Å; T766-F769 PolarHBondContact O-N 3.41Å; T766-F769 VanDerWaalsContact O-N 3.09Å; T766-F769 WeakPolarHBondContact OG1-CD2 3.49Å; T766-F769 PolarHBondContact OG1-N 3.16Å
767	G	82	Confident	90.2	Very high	56 Å²	56	30.7 Å²	30.7	58%	0.577	20%	0.196	S	C	*	.	S	Bend	trans	-56.2	-31	173.7	0	0	0	0	0	113.6
768	T	84.8	Confident	90.1	Very high	52 Å²	52	34.5 Å²	34.5	32%	0.319	21%	0.205	S	C	.	.	S	Bend	trans	-79.7	-34.5	174	39.8	0	0	0	0	114.1	N520 T766 P770	N520-T768 HydrophobicContact CB-CG2 3.94Å; N520-T768 PolarHBondContact O-OG1 3.44Å; N520-T768 VanDerWaalsContact O-OG1 3.12Å; T766-T768 PolarHBondContact O-N 3.47Å; T766-T768 PolarHBondContact OG1-OG1 2.98Å; T768-P770 WeakPolarHBondContact O-CD 3.26Å
769	F	86.6	Confident	90	Very high	7 Å²	7	39.4 Å²	39.4	3%	0.031	23%	0.231	C	C	.	.	S	Bend	trans	-125.4	74	-177.1	-49.8	-63.4	0	0	0	110.2	A480 L518 N520 E521 I764 T766 V783	A480-F769 HydrophobicContact CB-CE1 4.22Å; A480-F769 HydrophobicContact CB-CZ 4.07Å; L518-F769 HydrophobicContact CD1-CE2 4.36Å; L518-F769 HydrophobicContact CD2-CD2 4.22Å; L518-F769 HydrophobicContact CD2-CE2 4.16Å; N520-F769 VanDerWaalsContact O-CE2 3.25Å; N520-F769 WeakPolarHBondContact O-CE2 3.36Å; E521-F769 HydrophobicContact CG-CZ 4.33Å; I764-F769 HydrophobicContact CD1-CD2 4.3Å; T766-F769 PolarHBondContact N-O 3.42Å; T766-F769 VanDerWaalsContact N-O 3.16Å; T766-F769 CarbonylContact O-C 3.47Å; T766-F769 PolarHBondContact O-N 3.41Å; T766-F769 VanDerWaalsContact O-N 3.09Å; T766-F769 WeakPolarHBondContact OG1-CD2 3.49Å; T766-F769 PolarHBondContact OG1-N 3.16Å; F769-V783 HydrophobicContact CB-CG1 4.09Å; F769-V783 HydrophobicContact CD1-CG1 3.99Å; F769-V783 HydrophobicContact CD2-CG1 4.45Å; F769-V783 HydrophobicContact CG-CG1 3.92Å
770	P	86.2	Confident	90	Very high	78 Å²	78	37.8 Å²	37.8	51%	0.506	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	141.5	177	28.3	-34	0	0	0	110.4	T768 S772	T768-P770 WeakPolarHBondContact O-CD 3.26Å; P770-S772 PolarHBondContact O-N 2.86Å; P770-S772 PolarHBondContact O-OG 3.31Å
771	D	86.9	Confident	90	Very high	108 Å²	108	37.5 Å²	37.5	58%	0.578	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.9	43	174.4	-62.4	-34.5	0	0	0	114.4	N765	N765-D771 PolarHBondContact OD1-N 3.35Å
772	S	92	Very high	89.9	Confident	4 Å²	4	37.1 Å²	37.1	3%	0.028	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	164.5	-174.3	-68.9	0	0	0	0	112	I764 P770	I764-S772 VanDerWaalsContact CG2-C 3.48Å; I764-S772 WeakPolarHBondContact CG2-O 3.24Å; I764-S772 PolarHBondContact N-O 2.96Å; I764-S772 CarbonylContact O-C 3.33Å; I764-S772 PolarHBondContact O-N 2.82Å; I764-S772 VanDerWaalsContact O-N 3.11Å; P770-S772 PolarHBondContact O-N 2.86Å; P770-S772 PolarHBondContact O-OG 3.31Å
773	F	94.3	Very high	89.9	Confident	5 Å²	5	37 Å²	37	2%	0.022	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.7	-178.6	-60.6	-78.4	0	0	0	110.1	V723 I725 I732 V761 S762 T763 F775 V783 I784 I786	V723-F773 HydrophobicContact CB-CE1 3.77Å; V723-F773 HydrophobicContact CB-CZ 4.41Å; V723-F773 HydrophobicContact CG1-CD1 4.22Å; V723-F773 HydrophobicContact CG1-CE1 3.82Å; V723-F773 HydrophobicContact CG2-CE1 4.31Å; I725-F773 HydrophobicContact CG1-CE2 4.07Å; I725-F773 HydrophobicContact CG1-CZ 3.65Å; I732-F773 HydrophobicContact CD1-CD1 4.39Å; V761-F773 HydrophobicContact CG1-CB 4.16Å; V761-F773 HydrophobicContact CG1-CD1 4.28Å; S762-F773 CarbonylContact O-C 3.59Å; S762-F773 WeakPolarHBondContact O-CA 3.12Å; T763-F773 HydrophobicContact CG2-CD1 4.27Å; T763-F773 HydrophobicContact CG2-CE1 4.06Å; F773-F775 HydrophobicContact CB-CD2 4.06Å; F773-F775 HydrophobicContact CB-CE2 3.66Å; F773-V783 CarbonylContact O-C 3.59Å; F773-V783 WeakPolarHBondContact O-CA 3.29Å; F773-I784 PolarHBondContact N-O 3.27Å; F773-I784 PolarHBondContact O-N 3.27Å; F773-I786 HydrophobicContact CD2-CB 4.36Å; F773-I786 HydrophobicContact CD2-CD1 3.6Å; F773-I786 HydrophobicContact CD2-CG1 3.87Å; F773-I786 HydrophobicContact CE2-CB 4.11Å; F773-I786 HydrophobicContact CE2-CD1 3.72Å; F773-I786 HydrophobicContact CE2-CG1 4.06Å; F773-I786 HydrophobicContact CG-CD1 4.44Å
774	L	94.6	Very high	90	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	108.7	175.8	-175.2	70.2	0	0	0	108.8	A490 L505 V761 S762 I764 L781 V783	A490-L774 HydrophobicContact CB-CD2 3.77Å; L505-L774 HydrophobicContact CD1-CD1 4.36Å; L505-L774 HydrophobicContact CD1-CD2 3.68Å; L505-L774 HydrophobicContact CD2-CD2 4.29Å; L505-L774 HydrophobicContact CG-CD2 4.05Å; V761-L774 WeakPolarHBondContact CA-O 3.37Å; S762-L774 PolarHBondContact N-O 3.22Å; S762-L774 VanDerWaalsContact N-O 3.08Å; S762-L774 PolarHBondContact O-N 3.38Å; I764-L774 HydrophobicContact CG2-CB 4.35Å; L774-L781 HydrophobicContact CD1-CD2 3.65Å; L774-L781 HydrophobicContact CD2-CD2 3.81Å; L774-L781 HydrophobicContact CG-CD2 3.52Å; L774-V783 HydrophobicContact CD1-CG2 3.93Å
775	F	94.5	Very high	90	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121.7	176.8	-77.3	-106.5	0	0	0	109.9	V755 T758 V761 F773 L777 L781 S782 I784	V755-F775 HydrophobicContact CB-CD1 4.39Å; V755-F775 HydrophobicContact CG1-CD1 4.3Å; V755-F775 HydrophobicContact CG2-CD1 4.13Å; V755-F775 HydrophobicContact CG2-CE1 3.95Å; V755-F775 HydrophobicContact CG2-CZ 4.37Å; T758-F775 HydrophobicContact CG2-CB 4.44Å; T758-F775 HydrophobicContact CG2-CD1 3.67Å; T758-F775 HydrophobicContact CG2-CE1 4.42Å; T758-F775 HydrophobicContact CG2-CG 4.47Å; V761-F775 HydrophobicContact CG2-CD1 3.55Å; V761-F775 HydrophobicContact CG2-CD2 4.31Å; V761-F775 HydrophobicContact CG2-CE1 3.58Å; V761-F775 HydrophobicContact CG2-CE2 4.36Å; V761-F775 HydrophobicContact CG2-CG 3.92Å; V761-F775 HydrophobicContact CG2-CZ 4.01Å; F773-F775 HydrophobicContact CB-CD2 4.06Å; F773-F775 HydrophobicContact CB-CE2 3.66Å; F775-L777 HydrophobicContact CB-CD2 4.11Å; F775-L777 PolarHBondContact O-N 2.87Å; F775-L781 WeakPolarHBondContact O-CA 3.5Å; F775-S782 PolarHBondContact N-O 2.83Å; F775-S782 PolarHBondContact O-N 2.97Å; F775-I784 HydrophobicContact CB-CD1 4.15Å; F775-I784 HydrophobicContact CD1-CD1 4.48Å; F775-I784 HydrophobicContact CD2-CB 3.78Å; F775-I784 HydrophobicContact CD2-CD1 3.64Å; F775-I784 HydrophobicContact CD2-CG1 3.88Å; F775-I784 HydrophobicContact CE2-CB 3.88Å; F775-I784 HydrophobicContact CE2-CD1 4.13Å; F775-I784 HydrophobicContact CE2-CG1 4.4Å; F775-I784 HydrophobicContact CE2-CG2 4.28Å; F775-I784 HydrophobicContact CG-CD1 3.85Å; F775-I784 HydrophobicContact CG-CG1 4.47Å
776	C	94.9	Very high	90	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	100.3	172.1	-167.1	0	0	0	0	108.9	A487 T758 S759 S760 L781	A487-C776 VanDerWaalsContact CB-SG 3.51Å; A487-C776 PolarHBondContact O-SG 3.36Å; A487-C776 VanDerWaalsContact O-SG 3.35Å; T758-C776 WeakPolarHBondContact CA-O 3.28Å; S759-C776 PolarHBondContact N-O 3.48Å; S759-C776 WeakPolarHBondContact OG-CB 3.24Å; S759-C776 PolarHBondContact OG-O 3.44Å; S759-C776 PolarHBondContact OG-SG 2.91Å; S760-C776 WeakPolarHBondContact O-CB 3.42Å; S760-C776 PolarHBondContact O-N 3.27Å; S760-C776 WeakPolarHBondContact OG-CB 3.3Å; C776-L781 HydrophobicContact CB-CD2 4.27Å
777	L	92.5	Very high	89.6	Confident	14 Å²	14	32.8 Å²	32.8	7%	0.073	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	165.2	176.8	-45.6	177.9	0	0	0	110	V755 P757 T758 F775 D779 S780 S782	V755-L777 HydrophobicContact CG1-CD1 4.17Å; V755-L777 HydrophobicContact CG1-CD2 3.66Å; P757-L777 WeakPolarHBondContact O-CA 3.48Å; T758-L777 WeakPolarHBondContact OG1-CD2 3.48Å; F775-L777 HydrophobicContact CB-CD2 4.11Å; F775-L777 PolarHBondContact O-N 2.87Å; L777-D779 VanDerWaalsContact C-N 3.27Å; L777-D779 PolarHBondContact O-N 2.86Å; L777-S780 CarbonylContact C-O 3.49Å; L777-S780 VanDerWaalsContact CA-O 3.28Å; L777-S780 WeakPolarHBondContact CA-O 3.42Å; L777-S780 WeakPolarHBondContact CB-O 3.37Å; L777-S780 PolarHBondContact N-O 2.69Å; L777-S782 VanDerWaalsContact CD1-OG 3.3Å; L777-S782 WeakPolarHBondContact CD1-OG 3.34Å
778	K	85.7	Confident	89.3	Confident	151 Å²	151	34.9 Å²	34.9	66%	0.657	19%	0.187	S	C	*	.	S	Bend	trans	-51.2	-42.9	180	-171.5	-177.4	178.5	-175.7	0	114.2	G486	G486-K778 PolarHBondContact N-O 2.89Å; G486-K778 VanDerWaalsContact N-O 3.11Å
779	D	87.6	Confident	88.7	Confident	108 Å²	108	33.5 Å²	33.5	58%	0.578	18%	0.177	S	C	*	.	S	Bend	trans	-118.6	-0.4	-172.8	-58	-45.2	0	0	0	113.7	L484 L777	L484-D779 CarbonylContact C-O 3.52Å; L484-D779 PolarHBondContact N-O 2.91Å; L484-D779 CarbonylContact O-C 3.6Å; L777-D779 VanDerWaalsContact C-N 3.27Å; L777-D779 PolarHBondContact O-N 2.86Å
780	S	92.7	Very high	87.9	Confident	12 Å²	12	34.3 Å²	34.3	8%	0.084	18%	0.184	C	C	.	.			trans	-161	158.4	-179.7	57.9	0	0	0	0	113.6	I482 L484 L777	I482-S780 CarbonylContact O-C 3.57Å; I482-S780 VanDerWaalsContact O-CA 3.26Å; I482-S780 WeakPolarHBondContact O-CA 3.41Å; I482-S780 VanDerWaalsContact O-CB 3.27Å; I482-S780 WeakPolarHBondContact O-CB 3.32Å; L484-S780 WeakPolarHBondContact O-CA 3.46Å; L484-S780 PolarHBondContact O-N 2.85Å; L484-S780 VanDerWaalsContact O-N 3.1Å; L777-S780 CarbonylContact C-O 3.49Å; L777-S780 VanDerWaalsContact CA-O 3.28Å; L777-S780 WeakPolarHBondContact CA-O 3.42Å; L777-S780 WeakPolarHBondContact CB-O 3.37Å; L777-S780 PolarHBondContact N-O 2.69Å
781	L	93	Very high	86.9	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.2	166.9	-96.8	149.5	0	0	0	109.2	I482 L484 A487 A490 L505 V507 L774 F775 C776	I482-L781 HydrophobicContact CB-CB 4.17Å; I482-L781 PolarHBondContact N-O 3.31Å; I482-L781 PolarHBondContact O-N 2.99Å; L484-L781 HydrophobicContact CB-CD1 4.43Å; L484-L781 HydrophobicContact CD1-CD1 3.65Å; A487-L781 HydrophobicContact CB-CD1 4.46Å; A490-L781 HydrophobicContact CB-CD1 4.07Å; A490-L781 HydrophobicContact CB-CD2 3.47Å; A490-L781 VanDerWaalsContact CB-CD2 3.47Å; A490-L781 HydrophobicContact CB-CG 4.37Å; L505-L781 HydrophobicContact CD2-CD1 4.23Å; V507-L781 HydrophobicContact CB-CD1 4.48Å; V507-L781 HydrophobicContact CG1-CD1 3.86Å; V507-L781 HydrophobicContact CG2-CD1 3.7Å; L774-L781 HydrophobicContact CD1-CD2 3.65Å; L774-L781 HydrophobicContact CD2-CD2 3.81Å; L774-L781 HydrophobicContact CG-CD2 3.52Å; F775-L781 WeakPolarHBondContact O-CA 3.5Å; C776-L781 HydrophobicContact CB-CD2 4.27Å
782	S	93.3	Very high	86.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.9	-175	-55.8	0	0	0	0	111	E478 A480 F775 L777	E478-S782 WeakPolarHBondContact OE1-CB 3.29Å; E478-S782 PolarHBondContact OE1-OG 3.24Å; E478-S782 VanDerWaalsContact OE1-OG 3.1Å; A480-S782 CarbonylContact O-C 3.58Å; A480-S782 WeakPolarHBondContact O-CA 3.38Å; F775-S782 PolarHBondContact N-O 2.83Å; F775-S782 PolarHBondContact O-N 2.97Å; L777-S782 VanDerWaalsContact CD1-OG 3.3Å; L777-S782 WeakPolarHBondContact CD1-OG 3.34Å
783	V	93.5	Very high	85.5	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.024	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	116.9	173.1	-179	0	0	0	0	108.2	S479 A480 I764 F769 F773 L774	S479-V783 PolarHBondContact N-O 3.12Å; A480-V783 HydrophobicContact CB-CB 4.13Å; A480-V783 HydrophobicContact CB-CG2 4.21Å; A480-V783 PolarHBondContact N-O 2.93Å; A480-V783 PolarHBondContact O-N 3.43Å; I764-V783 HydrophobicContact CD1-CG2 4.32Å; I764-V783 HydrophobicContact CG2-CG1 3.97Å; F769-V783 HydrophobicContact CB-CG1 4.09Å; F769-V783 HydrophobicContact CD1-CG1 3.99Å; F769-V783 HydrophobicContact CD2-CG1 4.45Å; F769-V783 HydrophobicContact CG-CG1 3.92Å; F773-V783 CarbonylContact O-C 3.59Å; F773-V783 WeakPolarHBondContact O-CA 3.29Å; L774-V783 HydrophobicContact CD1-CG2 3.93Å
784	I	92.5	Very high	84.8	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	126.8	-171.7	-56.7	-175.6	0	0	0	109.4	N476 R477 E478 V755 F773 F775	N476-I784 HydrophobicContact CB-CG2 3.69Å; R477-I784 WeakPolarHBondContact O-CA 3.31Å; E478-I784 HydrophobicContact CB-CG1 4.42Å; E478-I784 HydrophobicContact CG-CG1 4.41Å; V755-I784 HydrophobicContact CB-CD1 4.29Å; V755-I784 HydrophobicContact CG1-CD1 3.42Å; V755-I784 VanDerWaalsContact CG1-CD1 3.42Å; V755-I784 HydrophobicContact CG2-CD1 3.77Å; F773-I784 PolarHBondContact N-O 3.27Å; F773-I784 PolarHBondContact O-N 3.27Å; F775-I784 HydrophobicContact CB-CD1 4.15Å; F775-I784 HydrophobicContact CD1-CD1 4.48Å; F775-I784 HydrophobicContact CD2-CB 3.78Å; F775-I784 HydrophobicContact CD2-CD1 3.64Å; F775-I784 HydrophobicContact CD2-CG1 3.88Å; F775-I784 HydrophobicContact CE2-CB 3.88Å; F775-I784 HydrophobicContact CE2-CD1 4.13Å; F775-I784 HydrophobicContact CE2-CG1 4.4Å; F775-I784 HydrophobicContact CE2-CG2 4.28Å; F775-I784 HydrophobicContact CG-CD1 3.85Å; F775-I784 HydrophobicContact CG-CG1 4.47Å
785	S	90.7	Very high	84.4	Confident	26 Å²	26	34.2 Å²	34.2	18%	0.182	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	137.8	169.8	60.6	0	0	0	0	109.9	N476 R477	N476-S785 WeakPolarHBondContact CA-O 3.43Å; R477-S785 PolarHBondContact N-O 3.5Å; R477-S785 PolarHBondContact O-N 2.77Å; R477-S785 PolarHBondContact O-OG 3.12Å
786	I	87.3	Confident	84.1	Confident	11 Å²	11	38 Å²	38	6%	0.056	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	115.2	175.9	-64.7	172.4	0	0	0	107.4	I474 I725 I732 I740 F773	I474-I786 HydrophobicContact CG2-CG2 3.6Å; I725-I786 HydrophobicContact CD1-CD1 4.22Å; I725-I786 HydrophobicContact CG2-CB 4.4Å; I725-I786 HydrophobicContact CG2-CG2 3.98Å; I732-I786 HydrophobicContact CD1-CD1 4.37Å; I740-I786 HydrophobicContact CD1-CD1 3.61Å; F773-I786 HydrophobicContact CD2-CB 4.36Å; F773-I786 HydrophobicContact CD2-CD1 3.6Å; F773-I786 HydrophobicContact CD2-CG1 3.87Å; F773-I786 HydrophobicContact CE2-CB 4.11Å; F773-I786 HydrophobicContact CE2-CD1 3.72Å; F773-I786 HydrophobicContact CE2-CG1 4.06Å; F773-I786 HydrophobicContact CG-CD1 4.44Å
787	V	76.9	Confident	84	Confident	50 Å²	50	39 Å²	39	30%	0.303	19%	0.194	S	C	.	.			trans	-79.5	-60.2	-172.7	-175.9	0	0	0	0	110	E475 R726	E475-V787 HydrophobicContact CG-CB 4.32Å; E475-V787 HydrophobicContact CG-CG2 4.25Å; E475-V787 PolarHBondContact O-N 3.19Å; R726-V787 PolarHBondContact NE-O 3.14Å; R726-V787 PolarHBondContact NH2-O 3.34Å
788	E	74.3	Confident	84	Confident	101 Å²	101	41.7 Å²	41.7	47%	0.472	22%	0.219	S	C	.	.			trans	-139.6	142.8	-175.1	-171.1	171.1	178.7	0	0	111.6	S790	E788-S790 PolarHBondContact O-N 2.82Å
789	L	73.5	Confident	84.4	Confident	22 Å²	22	34.6 Å²	34.6	12%	0.115	19%	0.188	C	C	.	.			trans	-79.9	71.6	171.8	-68	171.5	0	0	0	109.8	I474 I725 K728 I740 Y742	I474-L789 HydrophobicContact CD1-CD2 3.89Å; I725-L789 HydrophobicContact CB-CD1 4.38Å; I725-L789 HydrophobicContact CD1-CD2 3.87Å; I725-L789 HydrophobicContact CG2-CD1 4.4Å; I725-L789 HydrophobicContact CG2-CD2 4.47Å; I725-L789 HydrophobicContact CG2-CG 4.21Å; K728-L789 HydrophobicContact CB-CD1 4.13Å; K728-L789 HydrophobicContact CD-CD1 4.19Å; I740-L789 HydrophobicContact CG2-CD2 4.23Å; Y742-L789 HydrophobicContact CD1-CD2 4.17Å; Y742-L789 HydrophobicContact CD2-CB 4.23Å; Y742-L789 HydrophobicContact CD2-CD1 4.17Å; Y742-L789 HydrophobicContact CE1-CD2 4.4Å; Y742-L789 HydrophobicContact CE2-CB 3.99Å; Y742-L789 HydrophobicContact CG-CD1 4.23Å; Y742-L789 HydrophobicContact CG-CD2 4.35Å
790	S	68.6	Low	84.5	Confident	25 Å²	25	30.1 Å²	30.1	18%	0.175	17%	0.168	C	C	.	.			trans	-103.9	148.9	168.9	68.5	0	0	0	0	110.5	I474 E788 V792	I474-S790 WeakPolarHBondContact CG1-O 3.17Å; E788-S790 PolarHBondContact O-N 2.82Å; S790-V792 PolarHBondContact O-N 2.87Å; S790-V792 PolarHBondContact OG-O 3.39Å
791	S	66.1	Low	84.5	Confident	7 Å²	7	29.6 Å²	29.6	5%	0.049	16%	0.164	C	C	.	.	S	Bend	trans	-72.9	-19.5	176.2	46.1	0	0	0	0	113.1	G472 S473 R744 S1241	G472-S791 CarbonylContact C-O 3.51Å; S473-S791 PolarHBondContact N-O 3.26Å; R744-S791 PolarHBondContact NH1-OG 3.03Å; S791-S1241 PolarHBondContact OG-OG 3.25Å
792	V	71.3	Confident	84.6	Confident	15 Å²	15	30.5 Å²	30.5	9%	0.091	17%	0.169	C	C	.	.	S	Bend	trans	-139.2	138.2	-178.1	-178.9	0	0	0	0	109	Y164 I470 R471 S473 S790 S1241	Y164-V792 HydrophobicContact CE1-CB 4.31Å; Y164-V792 HydrophobicContact CE1-CG1 4.31Å; Y164-V792 HydrophobicContact CE2-CG1 4.34Å; Y164-V792 WeakPolarHBondContact OH-CB 3.47Å; Y164-V792 WeakPolarHBondContact OH-CG1 3.36Å; Y164-V792 WeakPolarHBondContact OH-CG2 3.03Å; I470-V792 HydrophobicContact CG2-CG1 3.61Å; R471-V792 CarbonylContact O-C 3.43Å; R471-V792 WeakPolarHBondContact O-CA 3.39Å; R471-V792 WeakPolarHBondContact O-CG1 3.39Å; S473-V792 CarbonylContact O-C 3.56Å; S790-V792 PolarHBondContact O-N 2.87Å; S790-V792 PolarHBondContact OG-O 3.39Å; V792-S1241 WeakPolarHBondContact CG2-O 3.46Å
793	H	76.7	Confident	84.7	Confident	28 Å²	28	30.5 Å²	30.5	13%	0.13	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.8	174.9	172.5	61.9	0	0	0	108.9	I470 R471 S473 E475	I470-H793 WeakPolarHBondContact CA-O 3.11Å; R471-H793 PolarHBondContact N-O 3.23Å; R471-H793 PolarHBondContact O-N 3.3Å; S473-H793 VanDerWaalsContact O-CB 3.29Å; S473-H793 WeakPolarHBondContact O-CB 3.23Å; S473-H793 PolarHBondContact O-N 2.84Å; E475-H793 HydrophobicContact CB-CB 4.46Å; E475-H793 VanDerWaalsContact CB-ND1 3.32Å; E475-H793 WeakPolarHBondContact CB-ND1 3.42Å; E475-H793 VanDerWaalsContact CG-CE1 3.42Å; E475-H793 WeakPolarHBondContact CG-CE1 3.45Å; E475-H793 WeakPolarHBondContact CG-ND1 3.34Å; E475-H793 IonicContact OE1-CE1 2.94Å; E475-H793 IonicContact OE2-CE1 2.8Å; E475-H793 PolarHBondContact OE2-CE1 3.25Å; E475-H793 IonicContact OE2-ND1 3.42Å; E475-H793 PolarHBondContact OE2-ND1 3.14Å; E475-H793 VanDerWaalsContact OE2-ND1 3.16Å
794	C	80.5	Confident	84.7	Confident	31 Å²	31	31.3 Å²	31.3	21%	0.209	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	106.8	174.4	-177	0	0	0	0	109.7	L435 L469	L435-C794 WeakPolarHBondContact CD2-SG 3.47Å; L469-C794 CarbonylContact O-C 3.57Å; L469-C794 WeakPolarHBondContact O-CA 3.32Å
795	R	85.8	Confident	84.9	Confident	112 Å²	112	34.8 Å²	34.8	42%	0.423	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.7	174	-176.9	177.8	176.2	-162.9	-3.4	110.2	R468 L469	R468-R795 WeakPolarHBondContact CA-O 3.47Å; L469-R795 HydrophobicContact CB-CB 4.22Å; L469-R795 PolarHBondContact N-O 2.75Å; L469-R795 PolarHBondContact O-N 3.43Å
796	K	89.8	Confident	85.1	Confident	80 Å²	80	34 Å²	34	35%	0.348	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	130.6	173.3	-174.6	-178.2	-173.9	174.3	0	111	D409	D409-K796 WeakPolarHBondContact OD2-CD 3.49Å; D409-K796 IonicContact OD2-NZ 3.56Å; D409-K796 PolarHBondContact OD2-NZ 3.01Å
797	I	92	Very high	85.5	Confident	20 Å²	20	34.1 Å²	34.1	10%	0.103	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	105.2	168.7	-57.9	152.8	0	0	0	106.6	L456 S466 L467 L799 C882	L456-I797 HydrophobicContact CD1-CD1 4.49Å; S466-I797 CarbonylContact C-O 3.59Å; S466-I797 WeakPolarHBondContact CA-O 3.5Å; S466-I797 VanDerWaalsContact CB-O 3.31Å; S466-I797 WeakPolarHBondContact CB-O 3.3Å; L467-I797 HydrophobicContact CB-CB 4.18Å; L467-I797 HydrophobicContact CB-CD1 4.18Å; L467-I797 PolarHBondContact N-O 3.16Å; L467-I797 PolarHBondContact O-N 3.3Å; I797-L799 PolarHBondContact O-N 3.21Å; I797-C882 HydrophobicContact CD1-CB 3.63Å; I797-C882 VanDerWaalsContact CD1-SG 3.54Å; I797-C882 HydrophobicContact CG1-CB 4.11Å
798	A	92.2	Very high	86.4	Confident	72 Å²	72	33.1 Å²	33.1	60%	0.595	18%	0.175	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	128.1	-178	0	0	0	0	0	110.8
799	L	93.2	Very high	87.3	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.153	C	C	.	.			trans	-100.1	-30.9	177.5	-58.7	175.2	0	0	0	112	G465 L467 I797 E801 P803 T819 S837 I838 F877	G465-L799 WeakPolarHBondContact O-CB 3.38Å; G465-L799 PolarHBondContact O-N 2.83Å; L467-L799 HydrophobicContact CD1-CD2 4.16Å; L467-L799 HydrophobicContact CD2-CD1 4.03Å; L467-L799 HydrophobicContact CG-CD1 3.94Å; L467-L799 HydrophobicContact CG-CD2 4.07Å; L467-L799 HydrophobicContact CG-CG 4.24Å; I797-L799 PolarHBondContact O-N 3.21Å; L799-E801 HydrophobicContact CB-CG 4.17Å; L799-E801 PolarHBondContact O-N 3.15Å; L799-P803 HydrophobicContact CD1-CB 3.73Å; L799-P803 HydrophobicContact CD1-CG 4.04Å; L799-T819 HydrophobicContact CD1-CG2 4.34Å; L799-S837 CarbonylContact O-C 3.07Å; L799-S837 WeakPolarHBondContact O-CA 3.43Å; L799-I838 HydrophobicContact CB-CG2 4Å; L799-I838 HydrophobicContact CD2-CB 4.4Å; L799-I838 HydrophobicContact CD2-CG1 4.48Å; L799-I838 HydrophobicContact CD2-CG2 3.87Å; L799-I838 WeakPolarHBondContact O-CB 3.48Å; L799-I838 WeakPolarHBondContact O-CG2 3.19Å; L799-I838 PolarHBondContact O-N 2.84Å; L799-F877 HydrophobicContact CD2-CE1 4.2Å; L799-F877 HydrophobicContact CD2-CZ 3.65Å
800	G	90.4	Very high	88.1	Confident	15 Å²	15	31.9 Å²	31.9	16%	0.155	18%	0.175	C	C	.	.	S	Bend	trans	70.8	10.9	-172.6	0	0	0	0	0	113.9	G462 K463 G465	G462-G800 CarbonylContact O-C 3.54Å; K463-G800 WeakPolarHBondContact O-CA 3.32Å; G465-G800 PolarHBondContact O-N 3.42Å
801	E	92.7	Very high	89.1	Confident	1 Å²	1	36 Å²	36	1%	0.005	19%	0.191	C	C	.	.	S	Bend	trans	-154	159.3	178.7	56.3	-170.3	-144.9	0	0	110.1	G462 G465 L799 P803 T819 K821 S837 I838 S839 H873 L875	G462-E801 CarbonylContact O-C 3.54Å; G462-E801 WeakPolarHBondContact O-CA 3.17Å; G462-E801 PolarHBondContact O-N 2.94Å; G465-E801 WeakPolarHBondContact CA-O 3.38Å; L799-E801 HydrophobicContact CB-CG 4.17Å; L799-E801 PolarHBondContact O-N 3.15Å; E801-P803 VanDerWaalsContact O-CD 3.32Å; E801-P803 WeakPolarHBondContact O-CD 3.34Å; E801-T819 HydrophobicContact CG-CG2 4.15Å; E801-T819 VanDerWaalsContact OE1-CB 3.26Å; E801-T819 WeakPolarHBondContact OE1-CB 3.5Å; E801-T819 PolarHBondContact OE1-OG1 3.06Å; E801-K821 HydrophobicContact CB-CB 4Å; E801-K821 HydrophobicContact CB-CG 4.35Å; E801-S837 PolarHBondContact OE2-OG 2.59Å; E801-I838 HydrophobicContact CG-CG2 4.25Å; E801-S839 WeakPolarHBondContact OE2-CB 3.31Å; E801-S839 PolarHBondContact OE2-OG 3.03Å; E801-H873 IonicContact OE1-ND1 3.73Å; E801-H873 IonicContact OE2-ND1 2.7Å; E801-L875 WeakPolarHBondContact OE1-CD1 3.34Å
802	T	94.6	Very high	90.2	Very high	18 Å²	18	36.4 Å²	36.4	11%	0.11	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	118.6	-171.7	-48.3	0	0	0	0	110.9	G462 T819 E820	G462-T802 WeakPolarHBondContact CA-OG1 3.36Å; G462-T802 PolarHBondContact N-OG1 2.91Å; T802-T819 CarbonylContact O-C 3.4Å; T802-T819 WeakPolarHBondContact O-CA 3.47Å; T802-T819 WeakPolarHBondContact O-CB 3.47Å; T802-E820 WeakPolarHBondContact CB-O 3.35Å; T802-E820 PolarHBondContact N-O 2.8Å; T802-E820 PolarHBondContact O-N 3.23Å; T802-E820 PolarHBondContact OG1-O 2.81Å
803	P	95.9	Very high	91.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	142	170.4	32.7	-33.7	0	0	0	111.1	C458 L467 L799 E801 V817	C458-P803 HydrophobicContact CB-CB 3.76Å; C458-P803 HydrophobicContact CB-CG 3.92Å; L467-P803 HydrophobicContact CD2-CB 4.29Å; L799-P803 HydrophobicContact CD1-CB 3.73Å; L799-P803 HydrophobicContact CD1-CG 4.04Å; E801-P803 VanDerWaalsContact O-CD 3.32Å; E801-P803 WeakPolarHBondContact O-CD 3.34Å; P803-V817 HydrophobicContact CB-CG1 4.27Å
804	V	94.5	Very high	91.9	Very high	22 Å²	22	37.8 Å²	37.8	13%	0.133	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	-47.4	-173.3	-171.9	0	0	0	0	112.3	C818 E820	V804-C818 PolarHBondContact N-O 3.27Å; V804-E820 HydrophobicContact CG2-CB 4.19Å
805	R	95.6	Very high	92.7	Very high	74 Å²	74	36.6 Å²	36.6	28%	0.279	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	150.4	-178.8	-64.9	-65.4	-176.6	-143.5	4.5	111.8	D440 V817 C818 C897 V899	D440-R805 VanDerWaalsContact OD2-CA 3.26Å; D440-R805 WeakPolarHBondContact OD2-CA 3.41Å; R805-V817 WeakPolarHBondContact O-CA 3.4Å; R805-C818 HydrophobicContact CB-CB 4.09Å; R805-C818 PolarHBondContact O-N 2.71Å; R805-C897 WeakPolarHBondContact CG-O 3.31Å; R805-C897 PolarHBondContact NE-O 3.05Å; R805-V899 HydrophobicContact CB-CG1 3.68Å
806	L	95.6	Very high	93.2	Very high	8 Å²	8	31.2 Å²	31.2	4%	0.042	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.4	-173.9	-178.7	61.6	0	0	0	111.9	D440 I442 L456 F815 A816 V817	D440-L806 HydrophobicContact CB-CB 4.39Å; D440-L806 PolarHBondContact OD2-N 3.08Å; I442-L806 HydrophobicContact CB-CD2 4.4Å; I442-L806 HydrophobicContact CD1-CD1 4.25Å; I442-L806 HydrophobicContact CD1-CD2 3.92Å; I442-L806 HydrophobicContact CD1-CG 3.78Å; I442-L806 HydrophobicContact CG1-CD2 3.57Å; I442-L806 HydrophobicContact CG1-CG 3.87Å; I442-L806 HydrophobicContact CG2-CB 4.28Å; I442-L806 HydrophobicContact CG2-CD2 4.15Å; I442-L806 HydrophobicContact CG2-CG 3.91Å; L456-L806 HydrophobicContact CB-CD2 3.96Å; L456-L806 HydrophobicContact CD2-CD1 3.9Å; L456-L806 HydrophobicContact CD2-CD2 4.01Å; L456-L806 HydrophobicContact CG-CD2 3.79Å; L456-L806 WeakPolarHBondContact O-CD2 3.22Å; L806-F815 HydrophobicContact CD1-CB 4.4Å; L806-A816 CarbonylContact C-O 3.57Å; L806-A816 WeakPolarHBondContact CA-O 3.43Å; L806-V817 HydrophobicContact CD1-CG2 3.71Å
807	S	95.8	Very high	93.5	Very high	14 Å²	14	27.4 Å²	27.4	10%	0.098	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	153.9	169.5	-177.9	0	0	0	0	110.4	F815 A816 S901	S807-F815 CarbonylContact O-C 3.52Å; S807-F815 WeakPolarHBondContact O-CA 3.42Å; S807-A816 PolarHBondContact N-O 2.76Å; S807-A816 PolarHBondContact O-N 2.87Å; S807-S901 WeakPolarHBondContact OG-CB 3.46Å; S807-S901 PolarHBondContact OG-N 2.81Å
808	H	95.1	Very high	93.8	Very high	29 Å²	29	26.5 Å²	26.5	13%	0.134	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.8	174.7	176.1	-129.6	0	0	0	111.2	I442 T814 F815 Q879 S901	I442-H808 HydrophobicContact CD1-CB 3.61Å; H808-T814 PolarHBondContact CD2-O 2.86Å; H808-F815 HydrophobicContact CB-CD1 3.79Å; H808-F815 HydrophobicContact CB-CE1 3.85Å; H808-F815 AromaticContact CD2-CD1 3.44Å; H808-F815 VanDerWaalsContact CD2-CD1 3.44Å; H808-F815 WeakPolarHBondContact CD2-CD1 3.33Å; H808-F815 AromaticContact CD2-CE1 3.15Å; H808-F815 WeakPolarHBondContact CD2-CE1 3.17Å; H808-F815 AromaticContact CD2-CZ 3.96Å; H808-F815 AromaticContact CG-CD1 3.93Å; H808-F815 AromaticContact CG-CE1 3.64Å; H808-F815 AromaticContact NE2-CE1 3.89Å; H808-Q879 PolarHBondContact NE2-OE1 2.8Å; H808-S901 WeakPolarHBondContact O-CB 3.32Å; H808-S901 PolarHBondContact O-OG 3.42Å
809	Q	94	Very high	94	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	104.8	170.7	-174.7	172.2	68.6	0	0	108.5	E811 T812 R813 T814 S901 V910 Y912	Q809-E811 VanDerWaalsContact C-N 3.32Å; Q809-E811 WeakPolarHBondContact CG-OE2 3.26Å; Q809-E811 PolarHBondContact O-N 3.45Å; Q809-T812 HydrophobicContact CG-CG2 4.28Å; Q809-T812 WeakPolarHBondContact CG-OG1 3.4Å; Q809-T812 PolarHBondContact O-N 2.77Å; Q809-T812 PolarHBondContact OE1-OG1 3.18Å; Q809-R813 PolarHBondContact O-N 2.92Å; Q809-R813 VanDerWaalsContact O-N 3.15Å; Q809-T814 PolarHBondContact N-O 3.36Å; Q809-T814 PolarHBondContact O-N 3.45Å; Q809-S901 WeakPolarHBondContact CB-OG 3.17Å; Q809-S901 WeakPolarHBondContact CG-OG 3.43Å; Q809-V910 HydrophobicContact CG-CG1 4.1Å; Q809-V910 PolarHBondContact NE2-O 2.99Å; Q809-Y912 HydrophobicContact CB-CE1 4Å; Q809-Y912 HydrophobicContact CB-CE2 3.9Å; Q809-Y912 VanDerWaalsContact CB-CZ 3.4Å; Q809-Y912 WeakPolarHBondContact CB-OH 3.23Å; Q809-Y912 PolarHBondContact N-OH 2.87Å
810	V	90	Very high	94	Very high	97 Å²	97	24 Å²	24	59%	0.588	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-42.3	-174.5	-176.6	0	0	0	0	110.5	T812 R813	V810-T812 VanDerWaalsContact C-N 3.28Å; V810-T812 PolarHBondContact O-N 2.93Å; V810-R813 PolarHBondContact O-N 3.04Å; V810-R813 VanDerWaalsContact O-N 3.15Å
811	E	88.9	Confident	94	Very high	110 Å²	110	24.6 Å²	24.6	51%	0.514	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.9	-172.4	-57.1	84.8	170.7	0	0	112.6	Q809 V910	Q809-E811 VanDerWaalsContact C-N 3.32Å; Q809-E811 WeakPolarHBondContact CG-OE2 3.26Å; Q809-E811 PolarHBondContact O-N 3.45Å; E811-V910 HydrophobicContact CB-CG2 4.34Å; E811-V910 HydrophobicContact CG-CG2 3.92Å
812	T	89.5	Confident	93.4	Very high	17 Å²	17	28.2 Å²	28.2	10%	0.104	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-1.1	178.1	62.8	0	0	0	0	113	Q809 V810 T814 R938	Q809-T812 HydrophobicContact CG-CG2 4.28Å; Q809-T812 WeakPolarHBondContact CG-OG1 3.4Å; Q809-T812 PolarHBondContact O-N 2.77Å; Q809-T812 PolarHBondContact OE1-OG1 3.18Å; V810-T812 VanDerWaalsContact C-N 3.28Å; V810-T812 PolarHBondContact O-N 2.93Å; T812-T814 VanDerWaalsContact C-N 3.28Å; T812-T814 WeakPolarHBondContact O-CG2 3.45Å; T812-T814 PolarHBondContact O-N 2.92Å; T812-T814 PolarHBondContact OG1-OG1 2.76Å; T812-R938 WeakPolarHBondContact O-CD 3.31Å; T812-R938 PolarHBondContact O-NH1 3.03Å; T812-R938 VanDerWaalsContact O-NH1 3.11Å
813	R	90.9	Very high	92.5	Very high	72 Å²	72	29.3 Å²	29.3	27%	0.272	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	48	49.2	-170.9	-61.4	-178.3	72.4	96	5.3	111.6	P446 Q809 V810 Q879 D880 R938	P446-R813 PolarHBondContact O-NH2 2.79Å; Q809-R813 PolarHBondContact O-N 2.92Å; Q809-R813 VanDerWaalsContact O-N 3.15Å; V810-R813 PolarHBondContact O-N 3.04Å; V810-R813 VanDerWaalsContact O-N 3.15Å; R813-Q879 HydrophobicContact CB-CB 4.13Å; R813-Q879 WeakPolarHBondContact O-CB 3.41Å; R813-Q879 PolarHBondContact O-N 2.86Å; R813-D880 IonicContact CZ-OD1 2.63Å; R813-D880 IonicContact CZ-OD2 2.83Å; R813-D880 IonicContact NE-OD1 3.75Å; R813-D880 IonicContact NE-OD2 2.69Å; R813-D880 PolarHBondContact NE-OD2 3.28Å; R813-D880 VanDerWaalsContact NH2-CG 3.3Å; R813-D880 IonicContact NH2-OD1 3.15Å; R813-D880 PolarHBondContact NH2-OD1 3.02Å; R813-D880 IonicContact NH2-OD2 3.56Å; R813-D880 PolarHBondContact NH2-OD2 2.82Å; R813-D880 VanDerWaalsContact NH2-OD2 3.08Å; R813-R938 PolarHBondContact O-NH1 2.7Å
814	T	93.7	Very high	91	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	154.5	179.3	62.4	0	0	0	0	112.6	H808 Q809 T812 V876 F877 L885 Y912	H808-T814 PolarHBondContact CD2-O 2.86Å; Q809-T814 PolarHBondContact N-O 3.36Å; Q809-T814 PolarHBondContact O-N 3.45Å; T812-T814 VanDerWaalsContact C-N 3.28Å; T812-T814 WeakPolarHBondContact O-CG2 3.45Å; T812-T814 PolarHBondContact O-N 2.92Å; T812-T814 PolarHBondContact OG1-OG1 2.76Å; T814-V876 HydrophobicContact CG2-CG1 4.01Å; T814-F877 CarbonylContact C-O 3.57Å; T814-F877 WeakPolarHBondContact CA-O 3.14Å; T814-F877 WeakPolarHBondContact CB-O 3.4Å; T814-L885 HydrophobicContact CG2-CD1 4.26Å; T814-Y912 PolarHBondContact O-OH 2.76Å; T814-Y912 PolarHBondContact OG1-OH 2.82Å
815	F	95.8	Very high	89.2	Confident	5 Å²	5	36.2 Å²	36.2	2%	0.022	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	141.9	166.9	-60.4	-65.2	0	0	0	110.5	I442 F444 L456 L806 S807 H808 V876 F877 Q879	I442-F815 HydrophobicContact CD1-CD1 3.74Å; I442-F815 HydrophobicContact CD1-CE1 3.78Å; F444-F815 AromaticContact CD1-CE1 3.98Å; F444-F815 HydrophobicContact CD1-CE1 3.98Å; F444-F815 AromaticContact CD1-CZ 3.96Å; F444-F815 HydrophobicContact CD1-CZ 3.96Å; F444-F815 HydrophobicContact CD2-CE1 4.2Å; F444-F815 AromaticContact CD2-CZ 3.76Å; F444-F815 HydrophobicContact CD2-CZ 3.76Å; F444-F815 HydrophobicContact CE1-CE1 4.22Å; F444-F815 AromaticContact CE1-CZ 3.79Å; F444-F815 HydrophobicContact CE1-CZ 3.79Å; F444-F815 HydrophobicContact CE2-CE1 4.42Å; F444-F815 HydrophobicContact CE2-CE2 4.47Å; F444-F815 AromaticContact CE2-CZ 3.58Å; F444-F815 HydrophobicContact CE2-CZ 3.58Å; F444-F815 AromaticContact CG-CE1 3.97Å; F444-F815 HydrophobicContact CG-CE1 3.97Å; F444-F815 AromaticContact CG-CZ 3.94Å; F444-F815 HydrophobicContact CG-CZ 3.94Å; F444-F815 HydrophobicContact CZ-CE1 4.41Å; F444-F815 HydrophobicContact CZ-CE2 4.35Å; F444-F815 AromaticContact CZ-CZ 3.58Å; F444-F815 HydrophobicContact CZ-CZ 3.58Å; L456-F815 HydrophobicContact CD2-CB 4.32Å; L456-F815 HydrophobicContact CD2-CD1 3.82Å; L456-F815 HydrophobicContact CD2-CD2 3.79Å; L456-F815 HydrophobicContact CD2-CE1 4.03Å; L456-F815 HydrophobicContact CD2-CE2 3.97Å; L456-F815 HydrophobicContact CD2-CG 3.71Å; L456-F815 HydrophobicContact CD2-CZ 4.11Å; L806-F815 HydrophobicContact CD1-CB 4.4Å; S807-F815 CarbonylContact O-C 3.52Å; S807-F815 WeakPolarHBondContact O-CA 3.42Å; H808-F815 HydrophobicContact CB-CD1 3.79Å; H808-F815 HydrophobicContact CB-CE1 3.85Å; H808-F815 AromaticContact CD2-CD1 3.44Å; H808-F815 VanDerWaalsContact CD2-CD1 3.44Å; H808-F815 WeakPolarHBondContact CD2-CD1 3.33Å; H808-F815 AromaticContact CD2-CE1 3.15Å; H808-F815 WeakPolarHBondContact CD2-CE1 3.17Å; H808-F815 AromaticContact CD2-CZ 3.96Å; H808-F815 AromaticContact CG-CD1 3.93Å; H808-F815 AromaticContact CG-CE1 3.64Å; H808-F815 AromaticContact NE2-CE1 3.89Å; F815-V876 CarbonylContact O-C 3.56Å; F815-V876 WeakPolarHBondContact O-CA 3.43Å; F815-F877 HydrophobicContact CB-CB 4.29Å; F815-F877 PolarHBondContact N-O 2.74Å; F815-F877 PolarHBondContact O-N 3.34Å; F815-Q879 HydrophobicContact CD2-CB 4.38Å; F815-Q879 HydrophobicContact CE2-CB 3.88Å; F815-Q879 HydrophobicContact CE2-CG 3.79Å; F815-Q879 HydrophobicContact CZ-CB 4.28Å; F815-Q879 HydrophobicContact CZ-CG 3.84Å
816	A	96.6	Very high	87.2	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.8	172	0	0	0	0	0	110.4	L806 S807 F874 L875 V899 Y912	L806-A816 CarbonylContact C-O 3.57Å; L806-A816 WeakPolarHBondContact CA-O 3.43Å; S807-A816 PolarHBondContact N-O 2.76Å; S807-A816 PolarHBondContact O-N 2.87Å; A816-F874 HydrophobicContact CB-CE2 3.58Å; A816-F874 HydrophobicContact CB-CZ 3.82Å; A816-L875 CarbonylContact C-O 3.52Å; A816-L875 VanDerWaalsContact CA-O 3.3Å; A816-L875 WeakPolarHBondContact CA-O 3.36Å; A816-V899 HydrophobicContact CB-CG2 4.15Å; A816-Y912 HydrophobicContact CB-CD1 3.57Å; A816-Y912 HydrophobicContact CB-CD2 4.43Å; A816-Y912 HydrophobicContact CB-CE1 3.26Å; A816-Y912 HydrophobicContact CB-CE2 4.19Å; A816-Y912 HydrophobicContact CB-CG 4.14Å
817	V	97.4	Very high	84.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	125.5	-176.5	-169.7	0	0	0	0	109.9	L467 P803 R805 L806 T819 L875 F877	L467-V817 HydrophobicContact CD1-CG2 3.92Å; L467-V817 HydrophobicContact CD2-CG1 4.08Å; L467-V817 HydrophobicContact CD2-CG2 4.3Å; P803-V817 HydrophobicContact CB-CG1 4.27Å; R805-V817 WeakPolarHBondContact O-CA 3.4Å; L806-V817 HydrophobicContact CD1-CG2 3.71Å; V817-T819 HydrophobicContact CG1-CG2 3.9Å; V817-L875 HydrophobicContact CB-CB 4.5Å; V817-L875 PolarHBondContact N-O 3.4Å; V817-L875 PolarHBondContact O-N 2.78Å; V817-F877 HydrophobicContact CB-CD2 4.28Å; V817-F877 HydrophobicContact CB-CE2 3.89Å; V817-F877 HydrophobicContact CG2-CD2 3.62Å; V817-F877 HydrophobicContact CG2-CE2 3.61Å
818	C	97.3	Very high	81.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	131.1	169.3	-65.4	0	0	0	0	109.5	V804 R805 H873 C896	V804-C818 PolarHBondContact N-O 3.27Å; R805-C818 HydrophobicContact CB-CB 4.09Å; R805-C818 PolarHBondContact O-N 2.71Å; C818-H873 CarbonylContact C-O 3.58Å; C818-H873 WeakPolarHBondContact CA-O 3.32Å; C818-C896 HydrophobicContact CB-CB 3.59Å
819	T	96	Very high	79.2	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	154.5	-177.5	63	0	0	0	0	113.1	L799 E801 T802 V817 N872 H873 L875	L799-T819 HydrophobicContact CD1-CG2 4.34Å; E801-T819 HydrophobicContact CG-CG2 4.15Å; E801-T819 VanDerWaalsContact OE1-CB 3.26Å; E801-T819 WeakPolarHBondContact OE1-CB 3.5Å; E801-T819 PolarHBondContact OE1-OG1 3.06Å; T802-T819 CarbonylContact O-C 3.4Å; T802-T819 WeakPolarHBondContact O-CA 3.47Å; T802-T819 WeakPolarHBondContact O-CB 3.47Å; V817-T819 HydrophobicContact CG1-CG2 3.9Å; T819-N872 CarbonylContact O-C 3.49Å; T819-N872 VanDerWaalsContact O-CA 3.24Å; T819-N872 WeakPolarHBondContact O-CA 3.24Å; T819-H873 PolarHBondContact N-O 2.72Å; T819-H873 PolarHBondContact O-N 2.77Å; T819-L875 HydrophobicContact CG2-CD1 3.68Å
820	E	93.7	Very high	76.5	Confident	21 Å²	21	65.2 Å²	65.2	10%	0.098	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.4	174.3	-175.2	173.7	172.7	0	0	109.7	T802 V804 R870 K895	T802-E820 WeakPolarHBondContact CB-O 3.35Å; T802-E820 PolarHBondContact N-O 2.8Å; T802-E820 PolarHBondContact O-N 3.23Å; T802-E820 PolarHBondContact OG1-O 2.81Å; V804-E820 HydrophobicContact CG2-CB 4.19Å; E820-R870 WeakPolarHBondContact OE1-CD 3.18Å; E820-R870 IonicContact OE1-CZ 3.05Å; E820-R870 IonicContact OE1-NE 3.99Å; E820-R870 PolarHBondContact OE1-NE 2.79Å; E820-R870 IonicContact OE1-NH1 3.87Å; E820-R870 PolarHBondContact OE1-NH1 3.29Å; E820-K895 WeakPolarHBondContact OE2-CE 3.4Å; E820-K895 IonicContact OE2-NZ 3.06Å; E820-K895 PolarHBondContact OE2-NZ 2.94Å
821	K	89.9	Confident	73.8	Confident	27 Å²	27	65.7 Å²	65.7	12%	0.117	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.1	-179.9	-177.5	-177.8	-172.2	159.6	0	110.3	E801 S837 S839 N840 R870 Q871	E801-K821 HydrophobicContact CB-CB 4Å; E801-K821 HydrophobicContact CB-CG 4.35Å; K821-S837 VanDerWaalsContact CE-OG 3.27Å; K821-S837 WeakPolarHBondContact CE-OG 3.3Å; K821-S837 PolarHBondContact NZ-OG 3.4Å; K821-S839 PolarHBondContact NZ-OG 2.87Å; K821-N840 PolarHBondContact NZ-ND2 2.92Å; K821-N840 VanDerWaalsContact NZ-ND2 3.12Å; K821-N840 PolarHBondContact NZ-OD1 3.39Å; K821-R870 WeakPolarHBondContact O-CA 3.24Å; K821-Q871 PolarHBondContact N-O 2.61Å; K821-Q871 PolarHBondContact O-N 2.96Å
822	E	80.7	Confident	71.2	Confident	78 Å²	78	68.6 Å²	68.6	36%	0.364	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.1	169.4	-65	-162.7	152.1	0	0	109.9	R870	E822-R870 HydrophobicContact CG-CG 4.23Å; E822-R870 IonicContact OE1-CZ 3.97Å; E822-R870 IonicContact OE1-NE 2.74Å; E822-R870 PolarHBondContact OE1-NE 2.83Å; E822-R870 IonicContact OE1-NH2 3.07Å; E822-R870 PolarHBondContact OE1-NH2 2.86Å
823	V	75.3	Confident	69	Low	41 Å²	41	72.4 Å²	72.4	25%	0.248	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.4	175.8	-175.6	0	0	0	0	108.7	S825 K869 Q871	V823-S825 PolarHBondContact O-N 3.2Å; V823-K869 WeakPolarHBondContact CA-O 3.25Å; V823-K869 HydrophobicContact CB-CB 4.44Å; V823-K869 VanDerWaalsContact CB-O 3.26Å; V823-K869 WeakPolarHBondContact CB-O 3.34Å; V823-K869 PolarHBondContact N-O 3.32Å; V823-K869 PolarHBondContact O-N 2.97Å; V823-Q871 HydrophobicContact CG2-CB 4.38Å; V823-Q871 HydrophobicContact CG2-CG 3.79Å
824	P	64.8	Low	66.9	Low	97 Å²	97	73.2 Å²	73.2	63%	0.63	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-59	136.7	174.4	-19.5	30.8	0	0	0	110.3	W826	P824-W826 PolarHBondContact O-N 2.85Å
825	S	55.9	Low	65	Low	69 Å²	69	76.7 Å²	76.7	48%	0.483	44%	0.443	S	S	.	.	S	Bend	trans	-68.5	-16.6	-180	46.2	0	0	0	0	113.5	V823	V823-S825 PolarHBondContact O-N 3.2Å
826	W	54.8	Low	63.7	Low	196 Å²	196	82 Å²	82	74%	0.742	48%	0.476	S	S	*	.			trans	-108.9	103.6	-178	-81.8	61.5	0	0	0	112.2	P824 A828	P824-W826 PolarHBondContact O-N 2.85Å; W826-A828 PolarHBondContact O-N 2.84Å; W826-A828 VanDerWaalsContact O-N 3.08Å
827	T	41.5	Very low	63.1	Low	143 Å²	143	82.2 Å²	82.2	88%	0.877	48%	0.477	S	S	*	.			trans	-80.5	63.9	163.3	43.4	0	0	0	0	110.2	K829	T827-K829 PolarHBondContact O-N 2.92Å
828	A	37.4	Very low	62.6	Low	56 Å²	56	83.4 Å²	83.4	46%	0.463	48%	0.483	S	S	.	.			trans	-75.9	122.2	163.8	0	0	0	0	0	108	W826 T830	W826-A828 PolarHBondContact O-N 2.84Å; W826-A828 VanDerWaalsContact O-N 3.08Å; A828-T830 PolarHBondContact O-N 3.13Å; A828-T830 PolarHBondContact O-OG1 2.85Å
829	K	38.4	Very low	62.1	Low	219 Å²	219	83.6 Å²	83.6	95%	0.952	48%	0.484	S	S	*	.			trans	-55.8	82.4	170.4	-67.6	176.4	178.5	178	0	109.5	T827	T827-K829 PolarHBondContact O-N 2.92Å
830	T	37.1	Very low	61.7	Low	122 Å²	122	89.1 Å²	89.1	75%	0.748	51%	0.514	S	S	*	.			trans	-116.3	129.4	172	41.4	0	0	0	0	107.5	A828	A828-T830 PolarHBondContact O-N 3.13Å; A828-T830 PolarHBondContact O-OG1 2.85Å
831	S	34.2	Very low	61.3	Low	106 Å²	106	91.7 Å²	91.7	74%	0.741	53%	0.531	S	S	*	.			trans	-64.1	127.5	-168.1	45	0	0	0	0	113.3	S833	S831-S833 PolarHBondContact O-N 2.89Å
832	N	34.5	Very low	61.1	Low	171 Å²	171	91.3 Å²	91.3	91%	0.914	53%	0.533	S	S	*	.	S	Bend	trans	63.9	20.8	140.6	-71.7	6.1	0	0	0	122.6
833	S	42.8	Very low	61.4	Low	98 Å²	98	92.9 Å²	92.9	69%	0.685	54%	0.539	S	S	*	.			trans	-144.3	19.1	173.4	74.7	0	0	0	0	117.8	S831	S831-S833 PolarHBondContact O-N 2.89Å
834	A	46.7	Very low	62	Low	88 Å²	88	93.5 Å²	93.5	73%	0.727	54%	0.538	S	S	*	.	S	Bend	trans	-68.9	126.5	166.1	0	0	0	0	0	108.4	T836	A834-T836 PolarHBondContact O-N 2.86Å; A834-T836 VanDerWaalsContact O-N 3.07Å
835	P	54.2	Low	63.2	Low	74 Å²	74	94.3 Å²	94.3	48%	0.481	53%	0.534	S	S	.	.			trans	-56.8	121.3	176.7	20	-28.4	0	0	0	108.5	K463 S837	K463-P835 HydrophobicContact CB-CG 4.01Å; P835-S837 PolarHBondContact O-N 2.92Å
836	T	67.7	Low	64.9	Low	117 Å²	117	93.5 Å²	93.5	72%	0.718	52%	0.524	S	S	*	.			trans	-61.7	104.9	178.2	36.7	0	0	0	0	108.4	A834	A834-T836 PolarHBondContact O-N 2.86Å; A834-T836 VanDerWaalsContact O-N 3.07Å
837	S	85.4	Confident	66.6	Low	3 Å²	3	88.7 Å²	88.7	2%	0.021	52%	0.516	C	S	.	.			trans	-69.6	140.4	175.2	125.6	0	0	0	0	109.9	L799 E801 K821 P835 S839 N840	L799-S837 CarbonylContact O-C 3.07Å; L799-S837 WeakPolarHBondContact O-CA 3.43Å; E801-S837 PolarHBondContact OE2-OG 2.59Å; K821-S837 VanDerWaalsContact CE-OG 3.27Å; K821-S837 WeakPolarHBondContact CE-OG 3.3Å; K821-S837 PolarHBondContact NZ-OG 3.4Å; P835-S837 PolarHBondContact O-N 2.92Å; S837-S839 PolarHBondContact O-N 2.63Å; S837-S839 PolarHBondContact OG-OG 2.69Å; S837-N840 WeakPolarHBondContact O-CB 3.45Å; S837-N840 PolarHBondContact O-N 2.85Å
838	I	86.8	Confident	68.7	Low	26 Å²	26	82.3 Å²	82.3	13%	0.133	48%	0.478	C	S	.	.	G	3₁₀ helix	trans	-61.9	-29.1	-170.7	-164.2	72.6	0	0	0	112.7	L799 E801 N840 T841 A842 L875 F877 A884	L799-I838 HydrophobicContact CB-CG2 4Å; L799-I838 HydrophobicContact CD2-CB 4.4Å; L799-I838 HydrophobicContact CD2-CG1 4.48Å; L799-I838 HydrophobicContact CD2-CG2 3.87Å; L799-I838 WeakPolarHBondContact O-CB 3.48Å; L799-I838 WeakPolarHBondContact O-CG2 3.19Å; L799-I838 PolarHBondContact O-N 2.84Å; E801-I838 HydrophobicContact CG-CG2 4.25Å; I838-N840 PolarHBondContact O-N 2.87Å; I838-T841 WeakPolarHBondContact CA-OG1 3.29Å; I838-T841 PolarHBondContact O-N 2.75Å; I838-T841 PolarHBondContact O-OG1 2.77Å; I838-A842 PolarHBondContact O-N 2.83Å; I838-L875 HydrophobicContact CG2-CD1 3.6Å; I838-F877 HydrophobicContact CD1-CE1 4.45Å; I838-F877 HydrophobicContact CG1-CE1 3.9Å; I838-F877 HydrophobicContact CG1-CZ 3.99Å; I838-F877 HydrophobicContact CG2-CZ 4.38Å; I838-A884 HydrophobicContact CD1-CB 4.16Å; I838-A884 HydrophobicContact CG1-CB 3.73Å
839	S	86.3	Confident	71.1	Confident	4 Å²	4	84.5 Å²	84.5	3%	0.028	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-60.9	-28.8	175.3	52.9	0	0	0	0	112.5	E801 K821 S837	E801-S839 WeakPolarHBondContact OE2-CB 3.31Å; E801-S839 PolarHBondContact OE2-OG 3.03Å; K821-S839 PolarHBondContact NZ-OG 2.87Å; S837-S839 PolarHBondContact O-N 2.63Å; S837-S839 PolarHBondContact OG-OG 2.69Å
840	N	86.9	Confident	73.2	Confident	116 Å²	116	78.6 Å²	78.6	62%	0.62	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-82.6	-15.3	176.8	-65	-13.7	0	0	0	113.2	K821 S837 I838	K821-N840 PolarHBondContact NZ-ND2 2.92Å; K821-N840 VanDerWaalsContact NZ-ND2 3.12Å; K821-N840 PolarHBondContact NZ-OD1 3.39Å; S837-N840 WeakPolarHBondContact O-CB 3.45Å; S837-N840 PolarHBondContact O-N 2.85Å; I838-N840 PolarHBondContact O-N 2.87Å
841	T	85.7	Confident	75.2	Confident	75 Å²	75	73.4 Å²	73.4	46%	0.46	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	0.9	-176	56.7	0	0	0	0	113.1	I838	I838-T841 WeakPolarHBondContact CA-OG1 3.29Å; I838-T841 PolarHBondContact O-N 2.75Å; I838-T841 PolarHBondContact O-OG1 2.77Å
842	A	86.4	Confident	77.2	Confident	18 Å²	18	77.2 Å²	77.2	15%	0.149	43%	0.431	C	S	.	.			trans	-62.6	143.9	178	0	0	0	0	0	111.5	I838 Q844 A884 C887	I838-A842 PolarHBondContact O-N 2.83Å; A842-Q844 VanDerWaalsContact C-N 3.3Å; A842-Q844 PolarHBondContact O-N 2.96Å; A842-A884 WeakPolarHBondContact CA-O 3.39Å; A842-A884 HydrophobicContact CB-CB 4.11Å; A842-C887 HydrophobicContact CB-CB 3.55Å
843	K	87	Confident	78.9	Confident	112 Å²	112	78.3 Å²	78.3	49%	0.487	43%	0.427	S	S	.	.	S	Bend	trans	-64.4	-33.3	-176.9	-63.3	-179.7	-178.7	172.7	0	113.1	E883 A884 L885	K843-E883 WeakPolarHBondContact CE-OE2 3.31Å; K843-E883 IonicContact NZ-OE2 3.67Å; K843-E883 PolarHBondContact NZ-OE2 3.03Å; K843-A884 PolarHBondContact N-O 2.87Å; K843-L885 WeakPolarHBondContact CB-O 3.47Å; K843-L885 HydrophobicContact CD-CD2 4.32Å; K843-L885 PolarHBondContact N-O 3.14Å
844	Q	88.5	Confident	80.2	Confident	53 Å²	53	80.6 Å²	80.6	25%	0.248	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	129.2	177.6	-173.9	-177.4	21.3	0	0	110.3	A842 L846 L885 V886 C887 N950	A842-Q844 VanDerWaalsContact C-N 3.3Å; A842-Q844 PolarHBondContact O-N 2.96Å; Q844-L846 HydrophobicContact CG-CG 4.46Å; Q844-L885 PolarHBondContact N-O 3.47Å; Q844-V886 HydrophobicContact CB-CG1 4.46Å; Q844-V886 HydrophobicContact CB-CG2 4.31Å; Q844-V886 CarbonylContact O-C 3.51Å; Q844-V886 WeakPolarHBondContact O-CA 3.28Å; Q844-C887 PolarHBondContact O-N 3.24Å; Q844-N950 PolarHBondContact NE2-OD1 2.78Å
845	E	89.8	Confident	81	Confident	115 Å²	115	78.9 Å²	78.9	54%	0.537	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.7	172.2	-168.2	-178	171.2	0	0	110.6	C887	E845-C887 CarbonylContact C-O 3.54Å; E845-C887 WeakPolarHBondContact CA-O 3.37Å
846	L	91.2	Very high	81.5	Confident	51 Å²	51	77.7 Å²	77.7	27%	0.267	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.3	175.6	-64.5	173.8	0	0	0	108.8	Q844 V886 C887 Y888 K889 M951	Q844-L846 HydrophobicContact CG-CG 4.46Å; L846-V886 HydrophobicContact CD1-CG1 4.02Å; L846-V886 HydrophobicContact CG-CG1 4.49Å; L846-C887 PolarHBondContact N-O 2.91Å; L846-Y888 HydrophobicContact CB-CD2 3.62Å; L846-Y888 HydrophobicContact CB-CE2 4.26Å; L846-Y888 HydrophobicContact CB-CG 4.47Å; L846-Y888 HydrophobicContact CD1-CD2 4.29Å; L846-Y888 CarbonylContact O-C 3.53Å; L846-Y888 WeakPolarHBondContact O-CA 3.2Å; L846-K889 PolarHBondContact O-N 3.45Å; L846-M951 HydrophobicContact CD1-CB 4.39Å; L846-M951 HydrophobicContact CD1-CE 3.7Å
847	V	89.9	Confident	81.1	Confident	96 Å²	96	77.9 Å²	77.9	58%	0.582	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.5	-176.9	-175.5	0	0	0	0	110.7	K889	V847-K889 HydrophobicContact CG2-CB 4.41Å
848	A	86.8	Confident	79.3	Confident	8 Å²	8	82.3 Å²	82.3	7%	0.066	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-71.1	144.1	179.5	0	0	0	0	0	112.9	Y888 K889	A848-Y888 WeakPolarHBondContact CA-OH 3.49Å; A848-Y888 HydrophobicContact CB-CD1 4.48Å; A848-Y888 HydrophobicContact CB-CE1 3.52Å; A848-K889 VanDerWaalsContact CB-O 3.28Å; A848-K889 WeakPolarHBondContact CB-O 3.39Å; A848-K889 PolarHBondContact N-O 2.98Å
849	N	86	Confident	77.6	Confident	102 Å²	102	86.7 Å²	86.7	55%	0.545	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-68.4	134.8	168.8	-71.8	-39.8	0	0	0	109.7	R930	N849-R930 PolarHBondContact O-NH1 2.96Å; N849-R930 PolarHBondContact O-NH2 3.49Å
850	P	82.6	Confident	76	Confident	96 Å²	96	88.9 Å²	88.9	62%	0.623	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-66.3	150.5	177.6	27.8	-34	0	0	0	111.2
851	F	79.6	Confident	74	Confident	13 Å²	13	91.7 Å²	91.7	6%	0.057	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-55.3	142.9	172	-81.3	-95.2	0	0	0	111.1	K853 M855 I856 E894 L918 V928 R930	F851-K853 PolarHBondContact O-N 3.37Å; F851-M855 HydrophobicContact CD1-CE 4.43Å; F851-I856 HydrophobicContact CB-CD1 3.83Å; F851-I856 HydrophobicContact CB-CG1 3.89Å; F851-E894 HydrophobicContact CE2-CB 4.38Å; F851-E894 HydrophobicContact CE2-CG 4.1Å; F851-L918 HydrophobicContact CD2-CD1 4.18Å; F851-L918 HydrophobicContact CE2-CB 4.34Å; F851-L918 HydrophobicContact CE2-CD1 4.37Å; F851-L918 HydrophobicContact CZ-CB 4.42Å; F851-V928 HydrophobicContact CD1-CG1 4.1Å; F851-V928 HydrophobicContact CE1-CG1 3.76Å; F851-R930 HydrophobicContact CE1-CG 4.29Å; F851-R930 HydrophobicContact CZ-CB 4.42Å; F851-R930 HydrophobicContact CZ-CG 3.79Å
852	R	77.1	Confident	72.1	Confident	186 Å²	186	93.2 Å²	93.2	70%	0.702	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-63.5	134.5	179.4	-64.5	-175.1	-179.6	175	-1.4	109.4	H854 M855	R852-H854 VanDerWaalsContact CB-CE1 3.43Å; R852-H854 WeakPolarHBondContact CB-CE1 3.41Å; R852-H854 VanDerWaalsContact CD-CE1 3.49Å; R852-H854 WeakPolarHBondContact CD-CE1 3.38Å; R852-H854 PolarHBondContact O-N 3.14Å; R852-M855 HydrophobicContact CB-CG 4.44Å; R852-M855 HydrophobicContact CB-SD 4.37Å; R852-M855 WeakPolarHBondContact O-CB 3.11Å; R852-M855 PolarHBondContact O-N 2.97Å
853	K	69.1	Low	70	Confident	193 Å²	193	99.1 Å²	99.1	84%	0.839	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-50	-32.6	-174.3	-67	-174.9	178.7	-177.9	0	115.4	F851 M855 I856	F851-K853 PolarHBondContact O-N 3.37Å; K853-M855 PolarHBondContact O-N 2.96Å; K853-I856 PolarHBondContact O-N 3.13Å
854	H	70.5	Confident	67.9	Low	147 Å²	147	97.4 Å²	97.4	68%	0.681	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-73.4	-14.2	179.4	65	-90.8	0	0	0	114.1	R852	R852-H854 VanDerWaalsContact CB-CE1 3.43Å; R852-H854 WeakPolarHBondContact CB-CE1 3.41Å; R852-H854 VanDerWaalsContact CD-CE1 3.49Å; R852-H854 WeakPolarHBondContact CD-CE1 3.38Å; R852-H854 PolarHBondContact O-N 3.14Å
855	M	64.7	Low	65.8	Low	51 Å²	51	106.4 Å²	106.4	25%	0.251	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-91.7	-13.1	176.5	-58.7	-179.5	66.5	0	0	112.2	F851 R852 K853 V928 T958	F851-M855 HydrophobicContact CD1-CE 4.43Å; R852-M855 HydrophobicContact CB-CG 4.44Å; R852-M855 HydrophobicContact CB-SD 4.37Å; R852-M855 WeakPolarHBondContact O-CB 3.11Å; R852-M855 PolarHBondContact O-N 2.97Å; K853-M855 PolarHBondContact O-N 2.96Å; M855-V928 HydrophobicContact CE-CG1 3.7Å; M855-T958 HydrophobicContact CE-CG2 3.78Å; M855-T958 HydrophobicContact SD-CG2 4.29Å
856	I	64	Low	63.7	Low	50 Å²	50	108.5 Å²	108.5	26%	0.256	54%	0.542	S	S	.	.	S	Bend	trans	-101.1	118.2	-177.9	-52	176.5	0	0	0	107.2	F851 K853 A858 V860 L918	F851-I856 HydrophobicContact CB-CD1 3.83Å; F851-I856 HydrophobicContact CB-CG1 3.89Å; K853-I856 PolarHBondContact O-N 3.13Å; I856-A858 PolarHBondContact O-N 3.24Å; I856-V860 HydrophobicContact CG2-CB 3.62Å; I856-V860 HydrophobicContact CG2-CG1 4.2Å; I856-V860 HydrophobicContact CG2-CG2 3.41Å; I856-V860 VanDerWaalsContact CG2-CG2 3.41Å; I856-L918 HydrophobicContact CG1-CD2 4.28Å
857	K	58.2	Low	61.7	Low	120 Å²	120	111.2 Å²	111.2	52%	0.522	55%	0.554	S	S	.	*			trans	-58.7	138.2	168.3	-72.7	177	-179.1	164.6	0	108.4	E859 V860 E923	K857-E859 PolarHBondContact O-N 2.96Å; K857-V860 PolarHBondContact O-N 2.96Å; K857-E923 WeakPolarHBondContact CE-OE1 3.5Å; K857-E923 IonicContact NZ-OE1 2.78Å; K857-E923 PolarHBondContact NZ-OE1 3.17Å
858	A	48.7	Very low	60	Low	96 Å²	96	108 Å²	108	79%	0.793	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-55.8	-16.3	-170.6	0	0	0	0	0	115.1	I856 V860	I856-A858 PolarHBondContact O-N 3.24Å; A858-V860 VanDerWaalsContact C-N 3.27Å; A858-V860 PolarHBondContact O-N 3.47Å
859	E	51.1	Low	59.2	Low	118 Å²	118	114.5 Å²	114.5	55%	0.551	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-66.1	-15.8	-179.1	-68.2	176.3	177.7	0	0	115.2	K857 Q861 V862 S922	K857-E859 PolarHBondContact O-N 2.96Å; E859-Q861 PolarHBondContact O-N 2.7Å; E859-V862 PolarHBondContact O-N 2.76Å; E859-S922 PolarHBondContact OE2-OG 3.11Å
860	V	52.5	Low	58.8	Low	50 Å²	50	115.9 Å²	115.9	30%	0.303	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-66.2	-11.1	-180	178.5	0	0	0	0	113	I856 K857 A858 I920	I856-V860 HydrophobicContact CG2-CB 3.62Å; I856-V860 HydrophobicContact CG2-CG1 4.2Å; I856-V860 HydrophobicContact CG2-CG2 3.41Å; I856-V860 VanDerWaalsContact CG2-CG2 3.41Å; K857-V860 PolarHBondContact O-N 2.96Å; A858-V860 VanDerWaalsContact C-N 3.27Å; A858-V860 PolarHBondContact O-N 3.47Å; V860-I920 HydrophobicContact CG2-CG1 4.28Å
861	Q	45.6	Very low	59.1	Low	176 Å²	176	114 Å²	114	82%	0.822	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-85.7	2.7	180	-72.3	-164.9	-24.6	0	0	115.9	E859 N863	E859-Q861 PolarHBondContact O-N 2.7Å; Q861-N863 PolarHBondContact O-N 2.71Å
862	V	44.2	Very low	59.8	Low	106 Å²	106	113.8 Å²	113.8	64%	0.642	54%	0.544	S	S	*	.			trans	-75	98.4	176.7	-173.5	0	0	0	0	109.5	E859 T864	E859-V862 PolarHBondContact O-N 2.76Å; V862-T864 HydrophobicContact CG1-CG2 4.44Å; V862-T864 PolarHBondContact O-N 3.39Å
863	N	42.5	Very low	60.7	Low	142 Å²	142	105.1 Å²	105.1	76%	0.759	51%	0.511	S	S	*	.			trans	-60.4	86.5	162.5	-83	-29.5	0	0	0	108.9	Q861 R865	Q861-N863 PolarHBondContact O-N 2.71Å; N863-R865 PolarHBondContact O-N 2.88Å
864	T	43.6	Very low	62	Low	76 Å²	76	96 Å²	96	47%	0.466	47%	0.472	S	S	.	.			trans	-67.7	122.4	160.5	31.9	0	0	0	0	107.6	V862 E866 R921	V862-T864 HydrophobicContact CG1-CG2 4.44Å; V862-T864 PolarHBondContact O-N 3.39Å; T864-E866 VanDerWaalsContact C-N 3.27Å; T864-E866 PolarHBondContact O-N 2.77Å; T864-R921 PolarHBondContact OG1-NH1 2.8Å
865	R	43.6	Very low	63.2	Low	242 Å²	242	89 Å²	89	91%	0.913	44%	0.439	S	S	*	.	S	Bend	trans	-74.6	-6.8	-158.3	-130.8	174.2	-179.3	178.3	-1.7	114.6	N863	N863-R865 PolarHBondContact O-N 2.88Å
866	E	46	Very low	64.7	Low	160 Å²	160	86.6 Å²	86.6	75%	0.748	43%	0.427	S	S	*	.	S	Bend	trans	-141.8	-2.1	-163.8	-80.6	170.8	169.3	0	0	117	T864	T864-E866 VanDerWaalsContact C-N 3.27Å; T864-E866 PolarHBondContact O-N 2.77Å
867	E	49	Very low	66.1	Low	107 Å²	107	84.3 Å²	84.3	50%	0.5	42%	0.416	S	S	.	.	S	Bend	trans	-89.8	142.4	-178.3	-71.9	175.4	-116.6	0	0	113.4	K869 R921	E867-K869 PolarHBondContact O-N 3.28Å; E867-R921 IonicContact OE1-CZ 3.18Å; E867-R921 IonicContact OE1-NH1 3.48Å; E867-R921 PolarHBondContact OE1-NH1 3.08Å; E867-R921 IonicContact OE1-NH2 2.7Å; E867-R921 IonicContact OE2-CZ 3.16Å; E867-R921 IonicContact OE2-NH1 2.65Å; E867-R921 PolarHBondContact OE2-NH1 3.18Å; E867-R921 IonicContact OE2-NH2 3.44Å; E867-R921 PolarHBondContact OE2-NH2 3.47Å
868	A	53.6	Low	67.7	Low	29 Å²	29	79.1 Å²	79.1	24%	0.24	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-57.6	124.5	178.4	0	0	0	0	0	110.6	R870	A868-R870 PolarHBondContact O-N 2.79Å
869	K	70	Confident	69.6	Low	145 Å²	145	74.9 Å²	74.9	63%	0.63	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	119.6	177.8	-76.6	-175.7	178.4	179.3	0	108.8	V823 E867	V823-K869 WeakPolarHBondContact CA-O 3.25Å; V823-K869 HydrophobicContact CB-CB 4.44Å; V823-K869 VanDerWaalsContact CB-O 3.26Å; V823-K869 WeakPolarHBondContact CB-O 3.34Å; V823-K869 PolarHBondContact N-O 3.32Å; V823-K869 PolarHBondContact O-N 2.97Å; E867-K869 PolarHBondContact O-N 3.28Å
870	R	79.7	Confident	71.2	Confident	131 Å²	131	73.2 Å²	73.2	49%	0.494	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	130.6	172.2	-74.4	160.9	170.1	-148.5	12.3	110.2	E820 K821 E822 A868	E820-R870 WeakPolarHBondContact OE1-CD 3.18Å; E820-R870 IonicContact OE1-CZ 3.05Å; E820-R870 IonicContact OE1-NE 3.99Å; E820-R870 PolarHBondContact OE1-NE 2.79Å; E820-R870 IonicContact OE1-NH1 3.87Å; E820-R870 PolarHBondContact OE1-NH1 3.29Å; K821-R870 WeakPolarHBondContact O-CA 3.24Å; E822-R870 HydrophobicContact CG-CG 4.23Å; E822-R870 IonicContact OE1-CZ 3.97Å; E822-R870 IonicContact OE1-NE 2.74Å; E822-R870 PolarHBondContact OE1-NE 2.83Å; E822-R870 IonicContact OE1-NH2 3.07Å; E822-R870 PolarHBondContact OE1-NH2 2.86Å; A868-R870 PolarHBondContact O-N 2.79Å
871	Q	89	Confident	72.6	Confident	56 Å²	56	73.2 Å²	73.2	26%	0.262	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.9	174.1	-67.7	-175.9	2.2	0	0	108.7	K821 V823 K889	K821-Q871 PolarHBondContact N-O 2.61Å; K821-Q871 PolarHBondContact O-N 2.96Å; V823-Q871 HydrophobicContact CG2-CB 4.38Å; V823-Q871 HydrophobicContact CG2-CG 3.79Å; Q871-K889 VanDerWaalsContact OE1-CE 3.23Å
872	N	94	Very high	74.4	Confident	9 Å²	9	65.6 Å²	65.6	5%	0.048	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	142.3	176.2	-63.3	-84.9	0	0	0	110.2	T819 M890 E894	T819-N872 CarbonylContact O-C 3.49Å; T819-N872 VanDerWaalsContact O-CA 3.24Å; T819-N872 WeakPolarHBondContact O-CA 3.24Å; N872-M890 HydrophobicContact CB-CB 4.14Å; N872-M890 HydrophobicContact CB-CG 4.1Å; N872-M890 VanDerWaalsContact O-CB 3.3Å; N872-M890 WeakPolarHBondContact O-CB 3.43Å; N872-M890 WeakPolarHBondContact O-CG 3.42Å; N872-M890 PolarHBondContact O-N 3.02Å; N872-E894 WeakPolarHBondContact CB-O 3.33Å; N872-E894 PolarHBondContact ND2-O 2.85Å
873	H	95.3	Very high	76.5	Confident	3 Å²	3	65.1 Å²	65.1	1%	0.014	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	151.1	178.9	-47.2	96.1	0	0	0	110.8	E801 C818 T819 L875 Y888	E801-H873 IonicContact OE1-ND1 3.73Å; E801-H873 IonicContact OE2-ND1 2.7Å; C818-H873 CarbonylContact C-O 3.58Å; C818-H873 WeakPolarHBondContact CA-O 3.32Å; T819-H873 PolarHBondContact N-O 2.72Å; T819-H873 PolarHBondContact O-N 2.77Å; H873-L875 HydrophobicContact CB-CG 4.38Å; H873-Y888 WeakPolarHBondContact CA-O 3.32Å
874	F	96.8	Very high	78.8	Confident	1 Å²	1	58.6 Å²	58.6	0%	0.004	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	113.7	163.9	169.1	-104.6	0	0	0	108	A816 V876 Y888 M890 V899 Y912 V914 F934 M951	A816-F874 HydrophobicContact CB-CE2 3.58Å; A816-F874 HydrophobicContact CB-CZ 3.82Å; F874-V876 HydrophobicContact CE1-CG2 3.83Å; F874-V876 HydrophobicContact CZ-CG2 4.14Å; F874-Y888 PolarHBondContact N-O 3.15Å; F874-Y888 PolarHBondContact O-N 2.79Å; F874-M890 HydrophobicContact CB-CE 3.52Å; F874-V899 HydrophobicContact CE2-CG2 3.83Å; F874-Y912 HydrophobicContact CZ-CD2 4.41Å; F874-Y912 HydrophobicContact CZ-CG 4.07Å; F874-V914 HydrophobicContact CD1-CG2 4.31Å; F874-V914 HydrophobicContact CD2-CG2 3.4Å; F874-V914 VanDerWaalsContact CD2-CG2 3.4Å; F874-V914 HydrophobicContact CE1-CG2 4.32Å; F874-V914 HydrophobicContact CE2-CG2 3.37Å; F874-V914 HydrophobicContact CG-CG2 3.87Å; F874-V914 HydrophobicContact CZ-CG2 3.89Å; F874-F934 HydrophobicContact CD1-CD2 4.28Å; F874-F934 HydrophobicContact CD1-CE2 4.12Å; F874-F934 AromaticContact CE1-CD2 3.91Å; F874-F934 HydrophobicContact CE1-CD2 3.91Å; F874-F934 HydrophobicContact CE1-CE2 4.22Å; F874-F934 HydrophobicContact CE1-CG 4.34Å; F874-F934 HydrophobicContact CZ-CD2 4.41Å; F874-M951 HydrophobicContact CD1-CE 4.35Å; F874-M951 HydrophobicContact CD1-SD 4.21Å; F874-M951 HydrophobicContact CE1-CE 4.4Å; F874-M951 HydrophobicContact CE1-SD 3.71Å
875	L	96.2	Very high	81.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	140.9	-175.2	-64	167.3	0	0	0	110.2	E801 A816 V817 T819 I838 H873 F877 V886 C887	E801-L875 WeakPolarHBondContact OE1-CD1 3.34Å; A816-L875 CarbonylContact C-O 3.52Å; A816-L875 VanDerWaalsContact CA-O 3.3Å; A816-L875 WeakPolarHBondContact CA-O 3.36Å; V817-L875 HydrophobicContact CB-CB 4.5Å; V817-L875 PolarHBondContact N-O 3.4Å; V817-L875 PolarHBondContact O-N 2.78Å; T819-L875 HydrophobicContact CG2-CD1 3.68Å; I838-L875 HydrophobicContact CG2-CD1 3.6Å; H873-L875 HydrophobicContact CB-CG 4.38Å; L875-F877 HydrophobicContact CB-CD2 4.12Å; L875-F877 HydrophobicContact CB-CE2 3.47Å; L875-F877 VanDerWaalsContact CB-CE2 3.47Å; L875-F877 HydrophobicContact CB-CZ 4.2Å; L875-F877 HydrophobicContact CD1-CE2 3.89Å; L875-F877 HydrophobicContact CD1-CZ 3.94Å; L875-F877 HydrophobicContact CG-CE2 4.32Å; L875-V886 CarbonylContact C-O 3.56Å; L875-V886 VanDerWaalsContact CA-O 3.32Å; L875-V886 WeakPolarHBondContact CA-O 3.47Å; L875-C887 HydrophobicContact CD2-CB 3.56Å
876	V	95.7	Very high	83.5	Confident	1 Å²	1	44 Å²	44	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	123.3	170.7	-177.7	0	0	0	0	108.5	T814 F815 F874 L885 V886 V936 M951	T814-V876 HydrophobicContact CG2-CG1 4.01Å; F815-V876 CarbonylContact O-C 3.56Å; F815-V876 WeakPolarHBondContact O-CA 3.43Å; F874-V876 HydrophobicContact CE1-CG2 3.83Å; F874-V876 HydrophobicContact CZ-CG2 4.14Å; V876-L885 WeakPolarHBondContact O-CA 3.5Å; V876-L885 WeakPolarHBondContact O-CB 3.43Å; V876-L885 PolarHBondContact O-N 3.48Å; V876-V886 HydrophobicContact CB-CB 4.24Å; V876-V886 HydrophobicContact CG2-CB 4.5Å; V876-V886 PolarHBondContact N-O 3.23Å; V876-V886 PolarHBondContact O-N 2.97Å; V876-V936 HydrophobicContact CG2-CG2 4.46Å; V876-M951 HydrophobicContact CG2-SD 3.98Å
877	F	94	Very high	85.8	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.009	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	148.7	179.6	-68.8	-97.5	0	0	0	111	L799 T814 F815 V817 I838 L875 C882 E883 A884	L799-F877 HydrophobicContact CD2-CE1 4.2Å; L799-F877 HydrophobicContact CD2-CZ 3.65Å; T814-F877 CarbonylContact C-O 3.57Å; T814-F877 WeakPolarHBondContact CA-O 3.14Å; T814-F877 WeakPolarHBondContact CB-O 3.4Å; F815-F877 HydrophobicContact CB-CB 4.29Å; F815-F877 PolarHBondContact N-O 2.74Å; F815-F877 PolarHBondContact O-N 3.34Å; V817-F877 HydrophobicContact CB-CD2 4.28Å; V817-F877 HydrophobicContact CB-CE2 3.89Å; V817-F877 HydrophobicContact CG2-CD2 3.62Å; V817-F877 HydrophobicContact CG2-CE2 3.61Å; I838-F877 HydrophobicContact CD1-CE1 4.45Å; I838-F877 HydrophobicContact CG1-CE1 3.9Å; I838-F877 HydrophobicContact CG1-CZ 3.99Å; I838-F877 HydrophobicContact CG2-CZ 4.38Å; L875-F877 HydrophobicContact CB-CD2 4.12Å; L875-F877 HydrophobicContact CB-CE2 3.47Å; L875-F877 VanDerWaalsContact CB-CE2 3.47Å; L875-F877 HydrophobicContact CB-CZ 4.2Å; L875-F877 HydrophobicContact CD1-CE2 3.89Å; L875-F877 HydrophobicContact CD1-CZ 3.94Å; L875-F877 HydrophobicContact CG-CE2 4.32Å; F877-C882 WeakPolarHBondContact CD1-O 3.38Å; F877-E883 VanDerWaalsContact CA-O 3.28Å; F877-E883 WeakPolarHBondContact CA-O 3.29Å; F877-A884 HydrophobicContact CD1-CB 4.07Å; F877-A884 HydrophobicContact CE1-CB 3.73Å; F877-A884 HydrophobicContact CZ-CB 4.17Å
878	D	91.1	Very high	88	Confident	12 Å²	12	31.9 Å²	31.9	6%	0.064	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	138.7	163	176.7	-131.9	0	0	0	111	D880 S881 C882 E883 L885 R938	D878-D880 PolarHBondContact OD1-N 3.22Å; D878-S881 VanDerWaalsContact CB-OG 3.31Å; D878-S881 WeakPolarHBondContact CB-OG 3.25Å; D878-S881 VanDerWaalsContact OD1-CB 3.28Å; D878-S881 WeakPolarHBondContact OD1-CB 3.26Å; D878-S881 PolarHBondContact OD1-N 3.44Å; D878-S881 PolarHBondContact OD1-OG 2.96Å; D878-C882 WeakPolarHBondContact O-CA 3.41Å; D878-C882 PolarHBondContact O-N 3.05Å; D878-C882 VanDerWaalsContact O-N 3.09Å; D878-E883 PolarHBondContact N-O 3.17Å; D878-L885 HydrophobicContact CB-CD1 4.04Å; D878-L885 HydrophobicContact CB-CD2 4.25Å; D878-L885 HydrophobicContact CB-CG 4.22Å; D878-R938 VanDerWaalsContact CG-NH2 3.33Å; D878-R938 IonicContact OD2-CZ 3.65Å; D878-R938 IonicContact OD2-NH1 2.75Å; D878-R938 PolarHBondContact OD2-NH1 2.82Å; D878-R938 IonicContact OD2-NH2 2.69Å; D878-R938 PolarHBondContact OD2-NH2 3.36Å
879	Q	89	Confident	90	Very high	7 Å²	7	33 Å²	33	3%	0.033	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-40.4	179.7	172.6	178.8	-43.8	0	0	113.2	F444 P446 H808 R813 F815	F444-Q879 HydrophobicContact CE2-CG 4.31Å; P446-Q879 PolarHBondContact O-NE2 2.84Å; P446-Q879 VanDerWaalsContact O-NE2 3.16Å; H808-Q879 PolarHBondContact NE2-OE1 2.8Å; R813-Q879 HydrophobicContact CB-CB 4.13Å; R813-Q879 WeakPolarHBondContact O-CB 3.41Å; R813-Q879 PolarHBondContact O-N 2.86Å; F815-Q879 HydrophobicContact CD2-CB 4.38Å; F815-Q879 HydrophobicContact CE2-CB 3.88Å; F815-Q879 HydrophobicContact CE2-CG 3.79Å; F815-Q879 HydrophobicContact CZ-CB 4.28Å; F815-Q879 HydrophobicContact CZ-CG 3.84Å
880	D	83.1	Confident	91.1	Very high	82 Å²	82	26.6 Å²	26.6	44%	0.439	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-48.3	-166.7	-61.2	-46.5	0	0	0	111.9	R813 D878	R813-D880 IonicContact CZ-OD1 2.63Å; R813-D880 IonicContact CZ-OD2 2.83Å; R813-D880 IonicContact NE-OD1 3.75Å; R813-D880 IonicContact NE-OD2 2.69Å; R813-D880 PolarHBondContact NE-OD2 3.28Å; R813-D880 VanDerWaalsContact NH2-CG 3.3Å; R813-D880 IonicContact NH2-OD1 3.15Å; R813-D880 PolarHBondContact NH2-OD1 3.02Å; R813-D880 IonicContact NH2-OD2 3.56Å; R813-D880 PolarHBondContact NH2-OD2 2.82Å; R813-D880 VanDerWaalsContact NH2-OD2 3.08Å; D878-D880 PolarHBondContact OD1-N 3.22Å
881	S	82.2	Confident	91.7	Very high	51 Å²	51	20.9 Å²	20.9	36%	0.357	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-22.5	176.3	64.5	0	0	0	0	113.4	D878 E883	D878-S881 VanDerWaalsContact CB-OG 3.31Å; D878-S881 WeakPolarHBondContact CB-OG 3.25Å; D878-S881 VanDerWaalsContact OD1-CB 3.28Å; D878-S881 WeakPolarHBondContact OD1-CB 3.26Å; D878-S881 PolarHBondContact OD1-N 3.44Å; D878-S881 PolarHBondContact OD1-OG 2.96Å; S881-E883 PolarHBondContact O-N 2.93Å; S881-E883 PolarHBondContact OG-N 2.97Å
882	C	84.4	Confident	91.4	Very high	15 Å²	15	23.2 Å²	23.2	10%	0.101	13%	0.129	C	C	.	.			trans	57.8	24.7	-170.2	-58.1	0	0	0	0	113.6	I797 F877 D878	I797-C882 HydrophobicContact CD1-CB 3.63Å; I797-C882 VanDerWaalsContact CD1-SG 3.54Å; I797-C882 HydrophobicContact CG1-CB 4.11Å; F877-C882 WeakPolarHBondContact CD1-O 3.38Å; D878-C882 WeakPolarHBondContact O-CA 3.41Å; D878-C882 PolarHBondContact O-N 3.05Å; D878-C882 VanDerWaalsContact O-N 3.09Å
883	E	88.5	Confident	91	Very high	96 Å²	96	26.4 Å²	26.4	45%	0.449	15%	0.147	S	C	.	.			trans	-78.2	142.2	172	-69.9	-173.9	169.5	0	0	111.5	K843 F877 D878 S881 L885	K843-E883 WeakPolarHBondContact CE-OE2 3.31Å; K843-E883 IonicContact NZ-OE2 3.67Å; K843-E883 PolarHBondContact NZ-OE2 3.03Å; F877-E883 VanDerWaalsContact CA-O 3.28Å; F877-E883 WeakPolarHBondContact CA-O 3.29Å; D878-E883 PolarHBondContact N-O 3.17Å; S881-E883 PolarHBondContact O-N 2.93Å; S881-E883 PolarHBondContact OG-N 2.97Å; E883-L885 PolarHBondContact O-N 3.34Å
884	A	91.3	Very high	90.9	Very high	6 Å²	6	26.3 Å²	26.3	5%	0.05	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	110.3	173.2	0	0	0	0	0	110.7	I838 A842 K843 F877	I838-A884 HydrophobicContact CD1-CB 4.16Å; I838-A884 HydrophobicContact CG1-CB 3.73Å; A842-A884 WeakPolarHBondContact CA-O 3.39Å; A842-A884 HydrophobicContact CB-CB 4.11Å; K843-A884 PolarHBondContact N-O 2.87Å; F877-A884 HydrophobicContact CD1-CB 4.07Å; F877-A884 HydrophobicContact CE1-CB 3.73Å; F877-A884 HydrophobicContact CZ-CB 4.17Å
885	L	91.8	Very high	90.7	Very high	9 Å²	9	29.3 Å²	29.3	5%	0.047	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-50.9	-178.8	-57.2	177	0	0	0	111.1	T814 K843 Q844 V876 D878 E883 T949	T814-L885 HydrophobicContact CG2-CD1 4.26Å; K843-L885 WeakPolarHBondContact CB-O 3.47Å; K843-L885 HydrophobicContact CD-CD2 4.32Å; K843-L885 PolarHBondContact N-O 3.14Å; Q844-L885 PolarHBondContact N-O 3.47Å; V876-L885 WeakPolarHBondContact O-CA 3.5Å; V876-L885 WeakPolarHBondContact O-CB 3.43Å; V876-L885 PolarHBondContact O-N 3.48Å; D878-L885 HydrophobicContact CB-CD1 4.04Å; D878-L885 HydrophobicContact CB-CD2 4.25Å; D878-L885 HydrophobicContact CB-CG 4.22Å; E883-L885 PolarHBondContact O-N 3.34Å; L885-T949 HydrophobicContact CB-CG2 4.42Å; L885-T949 HydrophobicContact CD1-CG2 3.96Å
886	V	93.3	Very high	90.7	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.006	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.1	-174.9	-173.5	0	0	0	0	110	Q844 L846 L875 V876 M951	Q844-V886 HydrophobicContact CB-CG1 4.46Å; Q844-V886 HydrophobicContact CB-CG2 4.31Å; Q844-V886 CarbonylContact O-C 3.51Å; Q844-V886 WeakPolarHBondContact O-CA 3.28Å; L846-V886 HydrophobicContact CD1-CG1 4.02Å; L846-V886 HydrophobicContact CG-CG1 4.49Å; L875-V886 CarbonylContact C-O 3.56Å; L875-V886 VanDerWaalsContact CA-O 3.32Å; L875-V886 WeakPolarHBondContact CA-O 3.47Å; V876-V886 HydrophobicContact CB-CB 4.24Å; V876-V886 HydrophobicContact CG2-CB 4.5Å; V876-V886 PolarHBondContact N-O 3.23Å; V876-V886 PolarHBondContact O-N 2.97Å; V886-M951 HydrophobicContact CG1-CB 4.16Å; V886-M951 HydrophobicContact CG1-CE 3.88Å; V886-M951 HydrophobicContact CG1-SD 4.21Å; V886-M951 HydrophobicContact CG2-CB 4.31Å
887	C	94.6	Very high	90.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.6	169.3	175.2	0	0	0	0	109.9	A842 Q844 E845 L846 L875	A842-C887 HydrophobicContact CB-CB 3.55Å; Q844-C887 PolarHBondContact O-N 3.24Å; E845-C887 CarbonylContact C-O 3.54Å; E845-C887 WeakPolarHBondContact CA-O 3.37Å; L846-C887 PolarHBondContact N-O 2.91Å; L875-C887 HydrophobicContact CD2-CB 3.56Å
888	Y	95.4	Very high	90.7	Very high	13 Å²	13	30.4 Å²	30.4	5%	0.051	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	107.5	171.7	-170.4	-87.8	0	0	0	110	L846 A848 H873 F874 M890 L932 F934 M951	L846-Y888 HydrophobicContact CB-CD2 3.62Å; L846-Y888 HydrophobicContact CB-CE2 4.26Å; L846-Y888 HydrophobicContact CB-CG 4.47Å; L846-Y888 HydrophobicContact CD1-CD2 4.29Å; L846-Y888 CarbonylContact O-C 3.53Å; L846-Y888 WeakPolarHBondContact O-CA 3.2Å; A848-Y888 WeakPolarHBondContact CA-OH 3.49Å; A848-Y888 HydrophobicContact CB-CD1 4.48Å; A848-Y888 HydrophobicContact CB-CE1 3.52Å; H873-Y888 WeakPolarHBondContact CA-O 3.32Å; F874-Y888 PolarHBondContact N-O 3.15Å; F874-Y888 PolarHBondContact O-N 2.79Å; Y888-M890 HydrophobicContact CD1-CE 3.82Å; Y888-M890 HydrophobicContact CD1-SD 3.84Å; Y888-M890 HydrophobicContact CE1-CE 4.27Å; Y888-M890 HydrophobicContact CE1-SD 3.87Å; Y888-L932 HydrophobicContact CE1-CD1 4.13Å; Y888-F934 AromaticContact CD1-CZ 3.91Å; Y888-F934 HydrophobicContact CD1-CZ 3.91Å; Y888-F934 AromaticContact CD2-CE1 3.77Å; Y888-F934 HydrophobicContact CD2-CE1 3.77Å; Y888-F934 AromaticContact CD2-CZ 4Å; Y888-F934 HydrophobicContact CD2-CZ 4Å; Y888-F934 HydrophobicContact CE1-CE1 4.42Å; Y888-F934 AromaticContact CE1-CZ 3.83Å; Y888-F934 HydrophobicContact CE1-CZ 3.83Å; Y888-F934 AromaticContact CE2-CE1 3.69Å; Y888-F934 HydrophobicContact CE2-CE1 3.69Å; Y888-F934 AromaticContact CE2-CZ 3.95Å; Y888-F934 HydrophobicContact CE2-CZ 3.95Å; Y888-F934 HydrophobicContact CG-CE1 4.2Å; Y888-F934 AromaticContact CG-CZ 3.98Å; Y888-F934 HydrophobicContact CG-CZ 3.98Å; Y888-F934 AromaticContact CZ-CZ 3.85Å; Y888-M951 HydrophobicContact CD2-CE 3.75Å; Y888-M951 HydrophobicContact CG-CE 4.09Å
889	K	95	Very high	91	Very high	54 Å²	54	30.8 Å²	30.8	24%	0.235	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	120.9	-178.4	-175.3	173.7	-166.1	154.8	0	111.4	L846 V847 A848 Q871	L846-K889 PolarHBondContact O-N 3.45Å; V847-K889 HydrophobicContact CG2-CB 4.41Å; A848-K889 VanDerWaalsContact CB-O 3.28Å; A848-K889 WeakPolarHBondContact CB-O 3.39Å; A848-K889 PolarHBondContact N-O 2.98Å; Q871-K889 VanDerWaalsContact OE1-CE 3.23Å
890	M	93.9	Very high	91.4	Very high	10 Å²	10	31.8 Å²	31.8	5%	0.049	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-70.8	162.4	179.2	-60.8	-57	172.1	0	0	112.2	N872 F874 Y888 E894 C896 V914 T916 L932	N872-M890 HydrophobicContact CB-CB 4.14Å; N872-M890 HydrophobicContact CB-CG 4.1Å; N872-M890 VanDerWaalsContact O-CB 3.3Å; N872-M890 WeakPolarHBondContact O-CB 3.43Å; N872-M890 WeakPolarHBondContact O-CG 3.42Å; N872-M890 PolarHBondContact O-N 3.02Å; F874-M890 HydrophobicContact CB-CE 3.52Å; Y888-M890 HydrophobicContact CD1-CE 3.82Å; Y888-M890 HydrophobicContact CD1-SD 3.84Å; Y888-M890 HydrophobicContact CE1-CE 4.27Å; Y888-M890 HydrophobicContact CE1-SD 3.87Å; M890-E894 HydrophobicContact CB-CB 4.16Å; M890-E894 HydrophobicContact CB-CG 4.16Å; M890-C896 WeakPolarHBondContact CE-SG 3.38Å; M890-V914 HydrophobicContact CE-CG1 4.15Å; M890-T916 HydrophobicContact CE-CG2 4.21Å; M890-T916 HydrophobicContact SD-CG2 4.18Å; M890-L932 HydrophobicContact CE-CD1 4.2Å; M890-L932 HydrophobicContact SD-CD1 4.08Å
891	S	90.2	Very high	92	Very high	10 Å²	10	29 Å²	29	7%	0.07	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-69.7	159.6	175.8	68.4	0	0	0	0	111.1	N893 E894	S891-N893 PolarHBondContact O-N 3.22Å; S891-E894 VanDerWaalsContact CB-OE2 3.29Å; S891-E894 WeakPolarHBondContact CB-OE2 3.06Å; S891-E894 PolarHBondContact N-OE2 3.48Å; S891-E894 VanDerWaalsContact O-CB 3.24Å; S891-E894 WeakPolarHBondContact O-CB 3.18Å; S891-E894 PolarHBondContact O-N 3.35Å; S891-E894 WeakPolarHBondContact OG-CB 3.17Å; S891-E894 PolarHBondContact OG-OE2 2.8Å
892	P	84.6	Confident	92.6	Very high	106 Å²	106	27 Å²	27	69%	0.688	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	135.5	179.6	-25.6	34.9	0	0	0	112.1	E894	P892-E894 PolarHBondContact O-N 3.29Å
893	N	85.6	Confident	93.1	Very high	76 Å²	76	30.7 Å²	30.7	41%	0.406	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	6.2	-175.9	-52.2	-32.1	0	0	0	115.7	S891 L918 I919	S891-N893 PolarHBondContact O-N 3.22Å; N893-L918 HydrophobicContact CB-CD1 4.17Å; N893-I919 WeakPolarHBondContact CB-O 3.45Å; N893-I919 PolarHBondContact O-N 3.4Å
894	E	91.5	Very high	93.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.9	171.7	-179.1	178.8	-159.8	0	0	109.6	F851 N872 M890 S891 P892 T916 A917 R930	F851-E894 HydrophobicContact CE2-CB 4.38Å; F851-E894 HydrophobicContact CE2-CG 4.1Å; N872-E894 WeakPolarHBondContact CB-O 3.33Å; N872-E894 PolarHBondContact ND2-O 2.85Å; M890-E894 HydrophobicContact CB-CB 4.16Å; M890-E894 HydrophobicContact CB-CG 4.16Å; S891-E894 VanDerWaalsContact CB-OE2 3.29Å; S891-E894 WeakPolarHBondContact CB-OE2 3.06Å; S891-E894 PolarHBondContact N-OE2 3.48Å; S891-E894 VanDerWaalsContact O-CB 3.24Å; S891-E894 WeakPolarHBondContact O-CB 3.18Å; S891-E894 PolarHBondContact O-N 3.35Å; S891-E894 WeakPolarHBondContact OG-CB 3.17Å; S891-E894 PolarHBondContact OG-OE2 2.8Å; P892-E894 PolarHBondContact O-N 3.29Å; E894-T916 HydrophobicContact CG-CG2 4.29Å; E894-T916 PolarHBondContact OE1-OG1 3.24Å; E894-T916 VanDerWaalsContact OE1-OG1 3.13Å; E894-A917 WeakPolarHBondContact CA-O 3.45Å; E894-R930 IonicContact OE1-CZ 2.7Å; E894-R930 IonicContact OE1-NE 3.85Å; E894-R930 PolarHBondContact OE1-NE 3.08Å; E894-R930 IonicContact OE1-NH2 2.73Å; E894-R930 PolarHBondContact OE1-NH2 2.99Å; E894-R930 IonicContact OE2-CZ 3.66Å; E894-R930 IonicContact OE2-NH2 2.68Å; E894-R930 PolarHBondContact OE2-NH2 3.09Å
895	K	93.3	Very high	93.4	Very high	64 Å²	64	27.5 Å²	27.5	28%	0.278	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	139.1	179.7	-175.5	167.4	-177.9	159.3	0	110.8	E820 T916 A917 I919	E820-K895 WeakPolarHBondContact OE2-CE 3.4Å; E820-K895 IonicContact OE2-NZ 3.06Å; E820-K895 PolarHBondContact OE2-NZ 2.94Å; K895-T916 CarbonylContact O-C 3.45Å; K895-T916 WeakPolarHBondContact O-CA 3.27Å; K895-A917 PolarHBondContact N-O 2.92Å; K895-A917 PolarHBondContact O-N 2.92Å; K895-I919 HydrophobicContact CB-CD1 4.27Å; K895-I919 HydrophobicContact CB-CG1 3.82Å
896	C	95.5	Very high	93.2	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.014	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	126.7	170.9	-60.4	0	0	0	0	109.9	C818 M890	C818-C896 HydrophobicContact CB-CB 3.59Å; M890-C896 WeakPolarHBondContact CE-SG 3.38Å
897	C	94.7	Very high	93.1	Very high	19 Å²	19	34 Å²	34	13%	0.128	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-38.9	-177.4	-61.5	0	0	0	0	112.2	R805 G915 P963	R805-C897 WeakPolarHBondContact CG-O 3.31Å; R805-C897 PolarHBondContact NE-O 3.05Å; C897-G915 PolarHBondContact N-O 2.82Å; C897-P963 VanDerWaalsContact CB-O 3.28Å; C897-P963 WeakPolarHBondContact CB-O 3.49Å
898	S	96.1	Very high	92.8	Very high	6 Å²	6	39.1 Å²	39.1	4%	0.042	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	153.6	-175.5	52.5	0	0	0	0	111.4	V914 G915 P963 M966	S898-V914 WeakPolarHBondContact O-CA 3.34Å; S898-G915 PolarHBondContact N-O 2.99Å; S898-G915 PolarHBondContact O-N 3.19Å; S898-P963 WeakPolarHBondContact CB-O 3.18Å; S898-P963 PolarHBondContact OG-O 3.18Å; S898-M966 WeakPolarHBondContact OG-CE 3.45Å
899	V	97.2	Very high	92.7	Very high	20 Å²	20	40.6 Å²	40.6	12%	0.121	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	140.6	175.1	64.6	0	0	0	0	109	R805 A816 F874 I913 V914	R805-V899 HydrophobicContact CB-CG1 3.68Å; A816-V899 HydrophobicContact CB-CG2 4.15Å; F874-V899 HydrophobicContact CE2-CG2 3.83Å; V899-I913 CarbonylContact C-O 3.15Å; V899-I913 VanDerWaalsContact CA-O 3.31Å; V899-I913 WeakPolarHBondContact CA-O 3.36Å; V899-V914 HydrophobicContact CG2-CG2 4.32Å
900	L	96.9	Very high	92.6	Very high	27 Å²	27	39 Å²	39	14%	0.141	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	135.2	179.3	176	68.4	0	0	0	109.8	C902 Y912 I913 M966 L973	L900-C902 HydrophobicContact CD2-CB 4.16Å; L900-C902 HydrophobicContact CG-CB 4.18Å; L900-Y912 CarbonylContact O-C 3.52Å; L900-Y912 WeakPolarHBondContact O-CA 3.3Å; L900-I913 PolarHBondContact N-O 3.29Å; L900-I913 PolarHBondContact O-N 2.82Å; L900-M966 HydrophobicContact CB-CB 4.22Å; L900-M966 HydrophobicContact CB-CE 4.18Å; L900-M966 HydrophobicContact CD2-CB 4.14Å; L900-L973 HydrophobicContact CD2-CD1 3.78Å
901	S	96.5	Very high	92.7	Very high	24 Å²	24	38.7 Å²	38.7	17%	0.168	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.9	162.2	-178.9	0	0	0	0	109.1	S807 H808 Q809 Y911	S807-S901 WeakPolarHBondContact OG-CB 3.46Å; S807-S901 PolarHBondContact OG-N 2.81Å; H808-S901 WeakPolarHBondContact O-CB 3.32Å; H808-S901 PolarHBondContact O-OG 3.42Å; Q809-S901 WeakPolarHBondContact CB-OG 3.17Å; Q809-S901 WeakPolarHBondContact CG-OG 3.43Å; S901-Y911 WeakPolarHBondContact CA-O 3.4Å
902	C	95	Very high	93.1	Very high	8 Å²	8	38.2 Å²	38.2	5%	0.054	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	157.9	175.8	62.5	0	0	0	0	113.2	L900 Y911 E968	L900-C902 HydrophobicContact CD2-CB 4.16Å; L900-C902 HydrophobicContact CG-CB 4.18Å; C902-Y911 PolarHBondContact N-O 3.38Å; C902-Y911 PolarHBondContact O-N 3.37Å; C902-E968 HydrophobicContact CB-CB 3.69Å; C902-E968 HydrophobicContact CB-CG 4.01Å
903	Q	94.7	Very high	93.7	Very high	93 Å²	93	33.1 Å²	33.1	44%	0.435	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	135.2	164.1	-171.7	177.7	18.1	0	0	109.2	D907	Q903-D907 VanDerWaalsContact CG-O 3.23Å; Q903-D907 WeakPolarHBondContact CG-O 3.21Å; Q903-D907 PolarHBondContact NE2-O 3.37Å
904	L	93.8	Very high	94.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.168	C	C	.	.			trans	-116.5	143.1	-177	-64.5	177.6	0	0	0	111.8	N906 D907 I913 L973 W986 L995	L904-N906 PolarHBondContact O-N 2.88Å; L904-D907 WeakPolarHBondContact O-CB 3.22Å; L904-D907 PolarHBondContact O-N 2.76Å; L904-D907 VanDerWaalsContact O-N 3.14Å; L904-I913 HydrophobicContact CD1-CD1 3.81Å; L904-L973 HydrophobicContact CD2-CB 4.15Å; L904-W986 HydrophobicContact CB-CB 3.64Å; L904-W986 HydrophobicContact CB-CD2 4.48Å; L904-W986 HydrophobicContact CB-CG 3.7Å; L904-W986 HydrophobicContact CD1-CB 4.03Å; L904-W986 HydrophobicContact CD1-CD2 4.03Å; L904-W986 HydrophobicContact CD1-CE3 4.25Å; L904-W986 HydrophobicContact CD1-CG 3.99Å; L904-W986 HydrophobicContact CG-CB 4.44Å; L904-L995 HydrophobicContact CD1-CD2 4.4Å
905	A	91.2	Very high	94.6	Very high	36 Å²	36	29.5 Å²	29.5	30%	0.298	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	-132.6	-176.2	0	0	0	0	0	111.8	K971 W986	A905-K971 PolarHBondContact N-O 3.22Å; A905-K971 WeakPolarHBondContact O-CD 3.48Å; A905-W986 HydrophobicContact CB-CB 4.31Å
906	N	87.8	Confident	94.7	Very high	134 Å²	134	26.5 Å²	26.5	72%	0.717	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.9	25.5	172.2	-64.2	-29.1	0	0	0	111.2	L904 K971	L904-N906 PolarHBondContact O-N 2.88Å; N906-K971 PolarHBondContact OD1-NZ 3.46Å
907	D	91.2	Very high	94.7	Very high	12 Å²	12	26.4 Å²	26.4	6%	0.064	15%	0.154	C	C	.	.			trans	-74	125.3	176.8	-168.5	-23.2	0	0	0	109.1	Q903 L904 N909 Y911 W986 H993	Q903-D907 VanDerWaalsContact CG-O 3.23Å; Q903-D907 WeakPolarHBondContact CG-O 3.21Å; Q903-D907 PolarHBondContact NE2-O 3.37Å; L904-D907 WeakPolarHBondContact O-CB 3.22Å; L904-D907 PolarHBondContact O-N 2.76Å; L904-D907 VanDerWaalsContact O-N 3.14Å; D907-N909 PolarHBondContact O-N 2.84Å; D907-N909 VanDerWaalsContact O-N 3.17Å; D907-N909 WeakPolarHBondContact OD1-CB 3.32Å; D907-N909 PolarHBondContact OD1-N 2.76Å; D907-N909 VanDerWaalsContact OD1-N 3.08Å; D907-N909 PolarHBondContact OD1-ND2 3.32Å; D907-Y911 HydrophobicContact CB-CE2 4.49Å; D907-Y911 VanDerWaalsContact CG-OH 3.32Å; D907-Y911 WeakPolarHBondContact OD2-CE2 3.39Å; D907-Y911 PolarHBondContact OD2-OH 3.18Å; D907-W986 PolarHBondContact OD2-NE1 2.7Å; D907-W986 VanDerWaalsContact OD2-NE1 3.1Å; D907-H993 IonicContact OD2-CE1 3.28Å; D907-H993 PolarHBondContact OD2-CE1 3.06Å; D907-H993 IonicContact OD2-ND1 2.7Å; D907-H993 PolarHBondContact OD2-ND1 2.86Å; D907-H993 IonicContact OD2-NE2 3.45Å
908	P	89.2	Confident	94.5	Very high	107 Å²	107	25.7 Å²	25.7	70%	0.695	15%	0.149	S	C	*	.	S	Bend	trans	-66.8	-13.2	179.3	28.3	-36.7	0	0	0	113.3
909	N	92	Very high	94.2	Very high	44 Å²	44	29.3 Å²	29.3	24%	0.235	17%	0.167	C	C	.	.			trans	-83	143	-179.2	-56.2	-62.7	0	0	0	111.7	D907 Y911 K935	D907-N909 PolarHBondContact O-N 2.84Å; D907-N909 VanDerWaalsContact O-N 3.17Å; D907-N909 WeakPolarHBondContact OD1-CB 3.32Å; D907-N909 PolarHBondContact OD1-N 2.76Å; D907-N909 VanDerWaalsContact OD1-N 3.08Å; D907-N909 PolarHBondContact OD1-ND2 3.32Å; N909-Y911 HydrophobicContact CB-CE1 4Å; N909-Y911 HydrophobicContact CB-CE2 4.04Å; N909-K935 HydrophobicContact CB-CD 4.32Å; N909-K935 VanDerWaalsContact OD1-CE 3.27Å; N909-K935 WeakPolarHBondContact OD1-CE 3.15Å; N909-K935 PolarHBondContact OD1-NZ 3.04Å
910	V	93.2	Very high	93.5	Very high	21 Å²	21	28.9 Å²	28.9	13%	0.127	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	138.9	170.9	-163.7	0	0	0	0	108.7	Q809 E811	Q809-V910 HydrophobicContact CG-CG1 4.1Å; Q809-V910 PolarHBondContact NE2-O 2.99Å; E811-V910 HydrophobicContact CB-CG2 4.34Å; E811-V910 HydrophobicContact CG-CG2 3.92Å
911	Y	96.6	Very high	92.5	Very high	3 Å²	3	35.4 Å²	35.4	1%	0.012	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	145.7	-172.3	-60.2	-70.4	0	0	0	111.6	S901 C902 D907 N909 V933 F934 K935 V954 W986	S901-Y911 WeakPolarHBondContact CA-O 3.4Å; C902-Y911 PolarHBondContact N-O 3.38Å; C902-Y911 PolarHBondContact O-N 3.37Å; D907-Y911 HydrophobicContact CB-CE2 4.49Å; D907-Y911 VanDerWaalsContact CG-OH 3.32Å; D907-Y911 WeakPolarHBondContact OD2-CE2 3.39Å; D907-Y911 PolarHBondContact OD2-OH 3.18Å; N909-Y911 HydrophobicContact CB-CE1 4Å; N909-Y911 HydrophobicContact CB-CE2 4.04Å; Y911-V933 HydrophobicContact CD1-CG1 3.91Å; Y911-V933 HydrophobicContact CG-CG1 3.86Å; Y911-F934 VanDerWaalsContact CA-O 3.29Å; Y911-F934 WeakPolarHBondContact CA-O 3.29Å; Y911-K935 HydrophobicContact CD1-CB 4Å; Y911-K935 HydrophobicContact CE1-CB 3.98Å; Y911-K935 HydrophobicContact CE1-CD 4.41Å; Y911-K935 HydrophobicContact CE1-CG 4.42Å; Y911-V954 HydrophobicContact CD1-CG2 4.38Å; Y911-V954 HydrophobicContact CE1-CB 4.5Å; Y911-V954 HydrophobicContact CE1-CG1 4.38Å; Y911-V954 HydrophobicContact CE1-CG2 3.99Å; Y911-W986 HydrophobicContact CE2-CZ2 4Å; Y911-W986 AromaticContact CE2-NE1 3.7Å; Y911-W986 AromaticContact CZ-CZ2 3.96Å
912	Y	97.9	Very high	91.7	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	129.9	158	-78	-65.8	0	0	0	109.2	Q809 T814 A816 F874 L900 F934 V936	Q809-Y912 HydrophobicContact CB-CE1 4Å; Q809-Y912 HydrophobicContact CB-CE2 3.9Å; Q809-Y912 VanDerWaalsContact CB-CZ 3.4Å; Q809-Y912 WeakPolarHBondContact CB-OH 3.23Å; Q809-Y912 PolarHBondContact N-OH 2.87Å; T814-Y912 PolarHBondContact O-OH 2.76Å; T814-Y912 PolarHBondContact OG1-OH 2.82Å; A816-Y912 HydrophobicContact CB-CD1 3.57Å; A816-Y912 HydrophobicContact CB-CD2 4.43Å; A816-Y912 HydrophobicContact CB-CE1 3.26Å; A816-Y912 HydrophobicContact CB-CE2 4.19Å; A816-Y912 HydrophobicContact CB-CG 4.14Å; F874-Y912 HydrophobicContact CZ-CD2 4.41Å; F874-Y912 HydrophobicContact CZ-CG 4.07Å; L900-Y912 CarbonylContact O-C 3.52Å; L900-Y912 WeakPolarHBondContact O-CA 3.3Å; Y912-F934 PolarHBondContact N-O 2.98Å; Y912-F934 PolarHBondContact O-N 3.26Å; Y912-V936 HydrophobicContact CD2-CG2 3.77Å; Y912-V936 HydrophobicContact CE2-CG2 4.03Å
913	I	97.9	Very high	91.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.4	177.3	-52	-178.1	0	0	0	107.7	V899 L900 L904 L932 V933 M966 L973	V899-I913 CarbonylContact C-O 3.15Å; V899-I913 VanDerWaalsContact CA-O 3.31Å; V899-I913 WeakPolarHBondContact CA-O 3.36Å; L900-I913 PolarHBondContact N-O 3.29Å; L900-I913 PolarHBondContact O-N 2.82Å; L904-I913 HydrophobicContact CD1-CD1 3.81Å; I913-L932 CarbonylContact C-O 3.55Å; I913-L932 VanDerWaalsContact CA-O 3.3Å; I913-L932 WeakPolarHBondContact CA-O 3.34Å; I913-V933 HydrophobicContact CD1-CG2 4.49Å; I913-V933 HydrophobicContact CG1-CG1 4.3Å; I913-V933 HydrophobicContact CG1-CG2 4.26Å; I913-V933 HydrophobicContact CG2-CG2 4.32Å; I913-M966 HydrophobicContact CB-CE 4.35Å; I913-M966 HydrophobicContact CG2-CE 4.12Å; I913-M966 HydrophobicContact CG2-SD 3.82Å; I913-M966 WeakPolarHBondContact O-CE 3.25Å; I913-L973 HydrophobicContact CD1-CD1 3.94Å; I913-L973 HydrophobicContact CD1-CD2 3.93Å; I913-L973 HydrophobicContact CD1-CG 4.46Å; I913-L973 HydrophobicContact CG2-CD2 4.2Å
914	V	97.9	Very high	90.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.1	-179.6	-172.6	0	0	0	0	109.1	F874 M890 S898 V899 T916 L931 L932 F934	F874-V914 HydrophobicContact CD1-CG2 4.31Å; F874-V914 HydrophobicContact CD2-CG2 3.4Å; F874-V914 VanDerWaalsContact CD2-CG2 3.4Å; F874-V914 HydrophobicContact CE1-CG2 4.32Å; F874-V914 HydrophobicContact CE2-CG2 3.37Å; F874-V914 HydrophobicContact CG-CG2 3.87Å; F874-V914 HydrophobicContact CZ-CG2 3.89Å; M890-V914 HydrophobicContact CE-CG1 4.15Å; S898-V914 WeakPolarHBondContact O-CA 3.34Å; V899-V914 HydrophobicContact CG2-CG2 4.32Å; V914-T916 HydrophobicContact CG1-CG2 3.96Å; V914-L931 WeakPolarHBondContact O-CA 3.25Å; V914-L932 HydrophobicContact CB-CB 4.4Å; V914-L932 PolarHBondContact N-O 3.46Å; V914-L932 PolarHBondContact O-N 2.83Å; V914-F934 HydrophobicContact CB-CE2 4.36Å; V914-F934 HydrophobicContact CG2-CD2 4.03Å; V914-F934 HydrophobicContact CG2-CE2 3.85Å
915	G	97.6	Very high	90.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	125.9	171	0	0	0	0	0	110.2	C897 S898 P963	C897-G915 PolarHBondContact N-O 2.82Å; S898-G915 PolarHBondContact N-O 2.99Å; S898-G915 PolarHBondContact O-N 3.19Å; G915-P963 VanDerWaalsContact C-CG 3.5Å
916	T	96.5	Very high	90.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	151.4	-178.4	61	0	0	0	0	111.5	M890 E894 K895 V914 G929 R930 L932 P963	M890-T916 HydrophobicContact CE-CG2 4.21Å; M890-T916 HydrophobicContact SD-CG2 4.18Å; E894-T916 HydrophobicContact CG-CG2 4.29Å; E894-T916 PolarHBondContact OE1-OG1 3.24Å; E894-T916 VanDerWaalsContact OE1-OG1 3.13Å; K895-T916 CarbonylContact O-C 3.45Å; K895-T916 WeakPolarHBondContact O-CA 3.27Å; V914-T916 HydrophobicContact CG1-CG2 3.96Å; T916-G929 CarbonylContact O-C 3.57Å; T916-G929 WeakPolarHBondContact O-CA 3.47Å; T916-R930 PolarHBondContact N-O 2.91Å; T916-R930 PolarHBondContact O-N 3.4Å; T916-R930 WeakPolarHBondContact OG1-CG 3.27Å; T916-R930 PolarHBondContact OG1-O 2.93Å; T916-L932 HydrophobicContact CG2-CD1 4.15Å; T916-P963 VanDerWaalsContact O-CD 3.3Å; T916-P963 WeakPolarHBondContact O-CD 3.35Å
917	A	94.6	Very high	90.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	143.7	177	0	0	0	0	0	110.7	E894 K895 I919 A926 A962	E894-A917 WeakPolarHBondContact CA-O 3.45Å; K895-A917 PolarHBondContact N-O 2.92Å; K895-A917 PolarHBondContact O-N 2.92Å; A917-I919 HydrophobicContact CB-CD1 4.37Å; A917-A926 HydrophobicContact CB-CB 3.93Å; A917-A962 HydrophobicContact CB-CB 3.67Å
918	L	91.7	Very high	90.4	Very high	5 Å²	5	47 Å²	47	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	114.6	173.5	-174.7	68	0	0	0	109.3	F851 I856 N893 I920 V928	F851-L918 HydrophobicContact CD2-CD1 4.18Å; F851-L918 HydrophobicContact CE2-CB 4.34Å; F851-L918 HydrophobicContact CE2-CD1 4.37Å; F851-L918 HydrophobicContact CZ-CB 4.42Å; I856-L918 HydrophobicContact CG1-CD2 4.28Å; N893-L918 HydrophobicContact CB-CD1 4.17Å; L918-I920 HydrophobicContact CD2-CD1 4.37Å; L918-I920 HydrophobicContact CD2-CG1 4.46Å; L918-I920 HydrophobicContact CG-CG1 4.34Å; L918-V928 PolarHBondContact N-O 3.39Å
919	I	87.9	Confident	90.6	Very high	81 Å²	81	41.9 Å²	41.9	42%	0.415	20%	0.199	S	C	.	.			trans	-87.6	115.3	-178.4	-51.8	-55.8	0	0	0	109.6	N893 K895 A917 A926	N893-I919 WeakPolarHBondContact CB-O 3.45Å; N893-I919 PolarHBondContact O-N 3.4Å; K895-I919 HydrophobicContact CB-CD1 4.27Å; K895-I919 HydrophobicContact CB-CG1 3.82Å; A917-I919 HydrophobicContact CB-CD1 4.37Å; I919-A926 HydrophobicContact CD1-CB 4.42Å
920	I	83.9	Confident	90.8	Very high	11 Å²	11	39.8 Å²	39.8	6%	0.056	19%	0.188	C	C	.	.			trans	-112.9	121	177.2	-57.1	176.4	0	0	0	107.6	V860 L918 S922 E923	V860-I920 HydrophobicContact CG2-CG1 4.28Å; L918-I920 HydrophobicContact CD2-CD1 4.37Å; L918-I920 HydrophobicContact CD2-CG1 4.46Å; L918-I920 HydrophobicContact CG-CG1 4.34Å; I920-S922 WeakPolarHBondContact CG2-OG 3.46Å; I920-S922 PolarHBondContact O-N 2.91Å; I920-S922 VanDerWaalsContact O-N 3.14Å; I920-E923 HydrophobicContact CB-CB 4.36Å; I920-E923 HydrophobicContact CB-CG 4.03Å; I920-E923 HydrophobicContact CG2-CG 4.12Å; I920-E923 PolarHBondContact O-N 3.09Å
921	R	75.9	Confident	91	Very high	164 Å²	164	38.8 Å²	38.8	62%	0.619	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-28.5	-174.2	-67.6	-174.2	-179	179.9	-2.5	114.7	T864 E867 E923	T864-R921 PolarHBondContact OG1-NH1 2.8Å; E867-R921 IonicContact OE1-CZ 3.18Å; E867-R921 IonicContact OE1-NH1 3.48Å; E867-R921 PolarHBondContact OE1-NH1 3.08Å; E867-R921 IonicContact OE1-NH2 2.7Å; E867-R921 IonicContact OE2-CZ 3.16Å; E867-R921 IonicContact OE2-NH1 2.65Å; E867-R921 PolarHBondContact OE2-NH1 3.18Å; E867-R921 IonicContact OE2-NH2 3.44Å; E867-R921 PolarHBondContact OE2-NH2 3.47Å; R921-E923 VanDerWaalsContact C-N 3.25Å
922	S	79.6	Confident	91	Very high	79 Å²	79	38.7 Å²	38.7	55%	0.552	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-12.3	177.5	52.6	0	0	0	0	113.2	E859 I920	E859-S922 PolarHBondContact OE2-OG 3.11Å; I920-S922 WeakPolarHBondContact CG2-OG 3.46Å; I920-S922 PolarHBondContact O-N 2.91Å; I920-S922 VanDerWaalsContact O-N 3.14Å
923	E	83.6	Confident	91	Very high	39 Å²	39	38.7 Å²	38.7	18%	0.182	18%	0.182	C	C	.	.			trans	-102.3	134.9	-179.3	-57.2	-171	161.8	0	0	110.4	K857 I920 R921 S927	K857-E923 WeakPolarHBondContact CE-OE1 3.5Å; K857-E923 IonicContact NZ-OE1 2.78Å; K857-E923 PolarHBondContact NZ-OE1 3.17Å; I920-E923 HydrophobicContact CB-CB 4.36Å; I920-E923 HydrophobicContact CB-CG 4.03Å; I920-E923 HydrophobicContact CG2-CG 4.12Å; I920-E923 PolarHBondContact O-N 3.09Å; R921-E923 VanDerWaalsContact C-N 3.25Å; E923-S927 PolarHBondContact OE1-OG 3.05Å; E923-S927 WeakPolarHBondContact OE2-CB 3.43Å; E923-S927 PolarHBondContact OE2-N 3.36Å; E923-S927 PolarHBondContact OE2-OG 3.47Å
924	R	82.8	Confident	90.9	Very high	265 Å²	265	38.7 Å²	38.7	100%	1	18%	0.182	S	C	*	.	S	Bend	trans	-74.5	-29	173.8	-69.1	-174.3	176.8	-173.2	-2.5	112.6
925	E	86.5	Confident	90.8	Very high	88 Å²	88	41 Å²	41	41%	0.411	19%	0.192	S	C	.	.	S	Bend	trans	-133.6	140.3	179	-173.4	-179.9	-151.9	0	0	108.6	S927 N978	E925-S927 PolarHBondContact O-N 3.34Å; E925-N978 VanDerWaalsContact CD-CG 3.48Å; E925-N978 WeakPolarHBondContact OE1-CB 3.42Å; E925-N978 PolarHBondContact OE1-ND2 3.08Å; E925-N978 VanDerWaalsContact OE1-ND2 3.14Å; E925-N978 PolarHBondContact OE1-OD1 3.01Å; E925-N978 PolarHBondContact OE2-ND2 3.19Å
926	A	90.5	Very high	90.5	Very high	10 Å²	10	41.4 Å²	41.4	8%	0.083	19%	0.194	C	C	.	.			trans	-65.6	122.5	-179.6	0	0	0	0	0	110.5	A917 I919 G961 A962 N978	A917-A926 HydrophobicContact CB-CB 3.93Å; I919-A926 HydrophobicContact CD1-CB 4.42Å; A926-G961 WeakPolarHBondContact O-CA 3.2Å; A926-A962 HydrophobicContact CB-CB 4.24Å; A926-N978 PolarHBondContact O-ND2 3.42Å
927	S	90.3	Very high	90	Very high	48 Å²	48	46 Å²	46	34%	0.336	21%	0.214	S	C	.	.			trans	-83.3	-18.1	179.1	57.2	0	0	0	0	114.1	E923 E925 N960 G961	E923-S927 PolarHBondContact OE1-OG 3.05Å; E923-S927 WeakPolarHBondContact OE2-CB 3.43Å; E923-S927 PolarHBondContact OE2-N 3.36Å; E923-S927 PolarHBondContact OE2-OG 3.47Å; E925-S927 PolarHBondContact O-N 3.34Å; S927-N960 CarbonylContact O-C 3.57Å; S927-G961 PolarHBondContact O-N 3.48Å
928	V	92.3	Very high	89.2	Confident	21 Å²	21	48.2 Å²	48.2	13%	0.127	22%	0.222	C	C	.	.			trans	-136.9	134.6	-173.6	-179.7	0	0	0	0	110.5	F851 M855 L918	F851-V928 HydrophobicContact CD1-CG1 4.1Å; F851-V928 HydrophobicContact CE1-CG1 3.76Å; M855-V928 HydrophobicContact CE-CG1 3.7Å; L918-V928 PolarHBondContact N-O 3.39Å
929	G	94.5	Very high	88.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	-179.7	172.1	0	0	0	0	0	112.5	T916 T958 V959 G961	T916-G929 CarbonylContact O-C 3.57Å; T916-G929 WeakPolarHBondContact O-CA 3.47Å; G929-T958 WeakPolarHBondContact O-CA 3.2Å; G929-V959 PolarHBondContact N-O 3.12Å; G929-V959 PolarHBondContact O-N 2.72Å; G929-V959 VanDerWaalsContact O-O 3.08Å; G929-G961 VanDerWaalsContact CA-O 3.31Å; G929-G961 WeakPolarHBondContact CA-O 3.38Å; G929-G961 PolarHBondContact N-O 2.82Å
930	R	95.9	Very high	87.2	Confident	1 Å²	1	53.9 Å²	53.9	0%	0.004	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	154.2	173.9	63.8	-179	177.9	-176.4	-5.1	112.9	N849 F851 E894 T916 L932 E956 K957 T958	N849-R930 PolarHBondContact O-NH1 2.96Å; N849-R930 PolarHBondContact O-NH2 3.49Å; F851-R930 HydrophobicContact CE1-CG 4.29Å; F851-R930 HydrophobicContact CZ-CB 4.42Å; F851-R930 HydrophobicContact CZ-CG 3.79Å; E894-R930 IonicContact OE1-CZ 2.7Å; E894-R930 IonicContact OE1-NE 3.85Å; E894-R930 PolarHBondContact OE1-NE 3.08Å; E894-R930 IonicContact OE1-NH2 2.73Å; E894-R930 PolarHBondContact OE1-NH2 2.99Å; E894-R930 IonicContact OE2-CZ 3.66Å; E894-R930 IonicContact OE2-NH2 2.68Å; E894-R930 PolarHBondContact OE2-NH2 3.09Å; T916-R930 PolarHBondContact N-O 2.91Å; T916-R930 PolarHBondContact O-N 3.4Å; T916-R930 WeakPolarHBondContact OG1-CG 3.27Å; T916-R930 PolarHBondContact OG1-O 2.93Å; R930-L932 HydrophobicContact CG-CD2 4.36Å; R930-L932 HydrophobicContact CG-CG 4.48Å; R930-E956 WeakPolarHBondContact CD-OE1 3.48Å; R930-E956 IonicContact CZ-OE1 3.88Å; R930-E956 IonicContact NE-OE1 3.19Å; R930-E956 IonicContact NH1-OE1 3.98Å; R930-E956 PolarHBondContact NH1-OE1 2.76Å; R930-K957 CarbonylContact C-O 3.54Å; R930-K957 WeakPolarHBondContact CA-O 3.43Å; R930-K957 WeakPolarHBondContact CB-O 3.22Å; R930-T958 HydrophobicContact CB-CG2 4.48Å
931	L	97.4	Very high	86.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.4	172.5	-50.9	175	0	0	0	108.7	V914 E956 K957 V959 P963 M966 L973 V975 F984 L995	V914-L931 WeakPolarHBondContact O-CA 3.25Å; L931-E956 WeakPolarHBondContact O-CA 3.39Å; L931-K957 HydrophobicContact CB-CB 4.32Å; L931-K957 PolarHBondContact N-O 2.85Å; L931-K957 PolarHBondContact O-N 2.89Å; L931-V959 HydrophobicContact CD1-CG1 4.25Å; L931-V959 HydrophobicContact CG-CG1 4.23Å; L931-P963 HydrophobicContact CD2-CB 3.83Å; L931-P963 HydrophobicContact CD2-CG 4.08Å; L931-M966 HydrophobicContact CD2-SD 3.83Å; L931-L973 HydrophobicContact CD1-CD2 4.24Å; L931-V975 HydrophobicContact CD1-CG2 4.02Å; L931-V975 HydrophobicContact CD2-CG1 4.1Å; L931-F984 HydrophobicContact CD1-CD2 4.33Å; L931-F984 HydrophobicContact CD1-CE2 4.02Å; L931-L995 HydrophobicContact CB-CD1 4.46Å; L931-L995 HydrophobicContact CD1-CD1 4.13Å
932	L	96.9	Very high	84.9	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.5	177.6	-59.3	172.7	0	0	0	108.8	Y888 M890 I913 V914 T916 R930 F934 L953 E956	Y888-L932 HydrophobicContact CE1-CD1 4.13Å; M890-L932 HydrophobicContact CE-CD1 4.2Å; M890-L932 HydrophobicContact SD-CD1 4.08Å; I913-L932 CarbonylContact C-O 3.55Å; I913-L932 VanDerWaalsContact CA-O 3.3Å; I913-L932 WeakPolarHBondContact CA-O 3.34Å; V914-L932 HydrophobicContact CB-CB 4.4Å; V914-L932 PolarHBondContact N-O 3.46Å; V914-L932 PolarHBondContact O-N 2.83Å; T916-L932 HydrophobicContact CG2-CD1 4.15Å; R930-L932 HydrophobicContact CG-CD2 4.36Å; R930-L932 HydrophobicContact CG-CG 4.48Å; L932-F934 HydrophobicContact CB-CD2 4.33Å; L932-F934 HydrophobicContact CB-CE2 3.55Å; L932-F934 HydrophobicContact CB-CZ 3.89Å; L932-F934 HydrophobicContact CD1-CE2 4.28Å; L932-F934 HydrophobicContact CD1-CZ 4.14Å; L932-L953 HydrophobicContact CB-CD1 4.09Å; L932-L953 HydrophobicContact CD2-CD1 4.18Å; L932-E956 HydrophobicContact CD2-CB 4.24Å; L932-E956 HydrophobicContact CD2-CG 3.9Å
933	V	97.1	Very high	83.5	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	113.4	-179.2	-175.6	0	0	0	0	109.2	Y911 I913 V954 H955 W986 L995	Y911-V933 HydrophobicContact CD1-CG1 3.91Å; Y911-V933 HydrophobicContact CG-CG1 3.86Å; I913-V933 HydrophobicContact CD1-CG2 4.49Å; I913-V933 HydrophobicContact CG1-CG1 4.3Å; I913-V933 HydrophobicContact CG1-CG2 4.26Å; I913-V933 HydrophobicContact CG2-CG2 4.32Å; V933-V954 HydrophobicContact CG1-CB 4.49Å; V933-V954 PolarHBondContact O-N 2.88Å; V933-H955 HydrophobicContact CB-CB 4.13Å; V933-H955 HydrophobicContact CG2-CB 4.21Å; V933-H955 PolarHBondContact N-O 3.49Å; V933-H955 PolarHBondContact O-N 3.01Å; V933-W986 HydrophobicContact CB-CH2 4.28Å; V933-W986 HydrophobicContact CG1-CH2 3.83Å; V933-W986 HydrophobicContact CG1-CZ2 4.3Å; V933-W986 HydrophobicContact CG1-CZ3 4.46Å; V933-W986 HydrophobicContact CG2-CH2 4.34Å; V933-W986 HydrophobicContact CG2-CZ3 4.26Å; V933-L995 HydrophobicContact CG2-CD1 4.03Å
934	F	96.5	Very high	81.9	Confident	1 Å²	1	64.4 Å²	64.4	0%	0.004	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	142.8	-179.3	-61.8	-78.5	0	0	0	111.7	F874 Y888 Y911 Y912 V914 L932 M951 D952 L953	F874-F934 HydrophobicContact CD1-CD2 4.28Å; F874-F934 HydrophobicContact CD1-CE2 4.12Å; F874-F934 AromaticContact CE1-CD2 3.91Å; F874-F934 HydrophobicContact CE1-CD2 3.91Å; F874-F934 HydrophobicContact CE1-CE2 4.22Å; F874-F934 HydrophobicContact CE1-CG 4.34Å; F874-F934 HydrophobicContact CZ-CD2 4.41Å; Y888-F934 AromaticContact CD1-CZ 3.91Å; Y888-F934 HydrophobicContact CD1-CZ 3.91Å; Y888-F934 AromaticContact CD2-CE1 3.77Å; Y888-F934 HydrophobicContact CD2-CE1 3.77Å; Y888-F934 AromaticContact CD2-CZ 4Å; Y888-F934 HydrophobicContact CD2-CZ 4Å; Y888-F934 HydrophobicContact CE1-CE1 4.42Å; Y888-F934 AromaticContact CE1-CZ 3.83Å; Y888-F934 HydrophobicContact CE1-CZ 3.83Å; Y888-F934 AromaticContact CE2-CE1 3.69Å; Y888-F934 HydrophobicContact CE2-CE1 3.69Å; Y888-F934 AromaticContact CE2-CZ 3.95Å; Y888-F934 HydrophobicContact CE2-CZ 3.95Å; Y888-F934 HydrophobicContact CG-CE1 4.2Å; Y888-F934 AromaticContact CG-CZ 3.98Å; Y888-F934 HydrophobicContact CG-CZ 3.98Å; Y888-F934 AromaticContact CZ-CZ 3.85Å; Y911-F934 VanDerWaalsContact CA-O 3.29Å; Y911-F934 WeakPolarHBondContact CA-O 3.29Å; Y912-F934 PolarHBondContact N-O 2.98Å; Y912-F934 PolarHBondContact O-N 3.26Å; V914-F934 HydrophobicContact CB-CE2 4.36Å; V914-F934 HydrophobicContact CG2-CD2 4.03Å; V914-F934 HydrophobicContact CG2-CE2 3.85Å; L932-F934 HydrophobicContact CB-CD2 4.33Å; L932-F934 HydrophobicContact CB-CE2 3.55Å; L932-F934 HydrophobicContact CB-CZ 3.89Å; L932-F934 HydrophobicContact CD1-CE2 4.28Å; L932-F934 HydrophobicContact CD1-CZ 4.14Å; F934-M951 HydrophobicContact CB-CG 4.11Å; F934-M951 HydrophobicContact CB-SD 4.18Å; F934-M951 HydrophobicContact CD1-CE 3.68Å; F934-M951 HydrophobicContact CD1-CG 4.09Å; F934-M951 HydrophobicContact CD1-SD 3.95Å; F934-M951 HydrophobicContact CE1-CE 3.76Å; F934-M951 HydrophobicContact CG-CE 4.34Å; F934-M951 HydrophobicContact CG-CG 4.41Å; F934-M951 HydrophobicContact CG-SD 4.09Å; F934-M951 HydrophobicContact CZ-CE 4.48Å; F934-D952 CarbonylContact C-O 3.54Å; F934-D952 WeakPolarHBondContact CA-O 3.31Å; F934-L953 HydrophobicContact CD1-CB 4.12Å; F934-L953 HydrophobicContact CD1-CD1 3.95Å; F934-L953 HydrophobicContact CE1-CB 3.98Å; F934-L953 HydrophobicContact CE1-CD1 3.62Å; F934-L953 HydrophobicContact CE1-CG 4.34Å; F934-L953 HydrophobicContact CZ-CD1 3.95Å
935	K	94.7	Very high	80.2	Confident	49 Å²	49	58.4 Å²	58.4	21%	0.213	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.3	167.7	179.8	176.8	172.3	176.9	0	109	N909 Y911 M951 D952 V954	N909-K935 HydrophobicContact CB-CD 4.32Å; N909-K935 VanDerWaalsContact OD1-CE 3.27Å; N909-K935 WeakPolarHBondContact OD1-CE 3.15Å; N909-K935 PolarHBondContact OD1-NZ 3.04Å; Y911-K935 HydrophobicContact CD1-CB 4Å; Y911-K935 HydrophobicContact CE1-CB 3.98Å; Y911-K935 HydrophobicContact CE1-CD 4.41Å; Y911-K935 HydrophobicContact CE1-CG 4.42Å; K935-M951 WeakPolarHBondContact O-CA 3.31Å; K935-D952 PolarHBondContact N-O 2.87Å; K935-D952 PolarHBondContact O-N 2.9Å; K935-V954 HydrophobicContact CB-CG2 3.64Å
936	V	91	Very high	78.3	Confident	8 Å²	8	55.7 Å²	55.7	5%	0.048	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.6	172.7	-179.8	0	0	0	0	108.1	V876 Y912 T949 M951	V876-V936 HydrophobicContact CG2-CG2 4.46Å; Y912-V936 HydrophobicContact CD2-CG2 3.77Å; Y912-V936 HydrophobicContact CE2-CG2 4.03Å; V936-T949 HydrophobicContact CG1-CG2 3.88Å; V936-M951 HydrophobicContact CG2-CG 4.16Å
937	K	87.1	Confident	76.5	Confident	97 Å²	97	66.1 Å²	66.1	42%	0.422	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.1	172.6	-69.4	171.8	-179.8	157.1	0	107.9	N950 D952	K937-N950 PolarHBondContact N-O 2.95Å; K937-N950 PolarHBondContact O-N 3.2Å; K937-N950 VanDerWaalsContact O-N 3.1Å; K937-D952 WeakPolarHBondContact CE-OD2 3.48Å; K937-D952 IonicContact NZ-OD2 2.68Å; K937-D952 PolarHBondContact NZ-OD2 2.95Å
938	R	78.2	Confident	75.2	Confident	45 Å²	45	68 Å²	68	17%	0.17	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	120.2	179.6	-167.5	-179	-174.8	174.6	1.4	109.5	T812 R813 D878 L940	T812-R938 WeakPolarHBondContact O-CD 3.31Å; T812-R938 PolarHBondContact O-NH1 3.03Å; T812-R938 VanDerWaalsContact O-NH1 3.11Å; R813-R938 PolarHBondContact O-NH1 2.7Å; D878-R938 VanDerWaalsContact CG-NH2 3.33Å; D878-R938 IonicContact OD2-CZ 3.65Å; D878-R938 IonicContact OD2-NH1 2.75Å; D878-R938 PolarHBondContact OD2-NH1 2.82Å; D878-R938 IonicContact OD2-NH2 2.69Å; D878-R938 PolarHBondContact OD2-NH2 3.36Å; R938-L940 PolarHBondContact O-N 3.08Å
939	D	69.3	Low	74.4	Confident	110 Å²	110	68.3 Å²	68.3	59%	0.588	34%	0.34	S	S	*	.			trans	-85.7	104.9	172.5	-73.5	-26.4	0	0	0	109.1	E941 C942	D939-E941 PolarHBondContact O-N 2.8Å; D939-C942 PolarHBondContact O-N 3.17Å
940	L	67.9	Low	73.9	Confident	95 Å²	95	71.5 Å²	71.5	50%	0.497	36%	0.358	S	S	.	.	S	Bend	trans	-66.9	-24.6	-175.4	-69.2	166.2	0	0	0	112.8	R938	R938-L940 PolarHBondContact O-N 3.08Å
941	E	60	Low	73.7	Confident	194 Å²	194	71.8 Å²	71.8	91%	0.907	36%	0.359	S	S	*	.	S	Bend	trans	-76.7	-31.3	-179.2	-64.6	-176.2	171.7	0	0	113.2	D939	D939-E941 PolarHBondContact O-N 2.8Å
942	C	51.4	Low	73.4	Confident	69 Å²	69	74.5 Å²	74.5	47%	0.466	37%	0.374	S	S	.	.	S	Bend	trans	-94.7	3.7	-179.1	-66.3	0	0	0	0	113.5	D939 K944 D945	D939-C942 PolarHBondContact O-N 3.17Å; C942-K944 PolarHBondContact O-N 3.4Å; C942-D945 PolarHBondContact O-N 3.05Å
943	A	50.7	Low	73.3	Confident	46 Å²	46	77.4 Å²	77.4	38%	0.38	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-63	-7.4	-169.1	0	0	0	0	0	115.9	D945	A943-D945 VanDerWaalsContact C-N 3.3Å; A943-D945 PolarHBondContact O-N 3.27Å
944	K	49.6	Very low	73.1	Confident	205 Å²	205	79.9 Å²	79.9	89%	0.891	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-68.4	-24	177.2	-68.2	-172.7	179.5	-178.6	0	113.8	C942	C942-K944 PolarHBondContact O-N 3.4Å
945	D	46.2	Very low	73.1	Confident	140 Å²	140	81.6 Å²	81.6	75%	0.749	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-103.6	2.8	-176.8	-72.6	-25.6	0	0	0	114.6	C942 A943 R947	C942-D945 PolarHBondContact O-N 3.05Å; A943-D945 VanDerWaalsContact C-N 3.3Å; A943-D945 PolarHBondContact O-N 3.27Å; D945-R947 VanDerWaalsContact C-N 3.3Å; D945-R947 PolarHBondContact O-N 3.32Å; D945-R947 VanDerWaalsContact O-N 3.11Å
946	G	47.7	Very low	73	Confident	30 Å²	30	82.8 Å²	82.8	31%	0.309	42%	0.418	S	S	.	.	S	Bend	trans	65.7	13.8	165.3	0	0	0	0	0	117.8
947	R	51.6	Low	73.2	Confident	229 Å²	229	85.2 Å²	85.2	86%	0.864	43%	0.428	S	S	*	.			trans	-112.2	-2	-175.6	-69	-169.8	-154.9	-179.8	7.8	117.7	D945	D945-R947 VanDerWaalsContact C-N 3.3Å; D945-R947 PolarHBondContact O-N 3.32Å; D945-R947 VanDerWaalsContact O-N 3.11Å
948	D	63.6	Low	73.6	Confident	87 Å²	87	83.8 Å²	83.8	47%	0.465	43%	0.428	S	S	.	.			trans	-109.1	35.7	-169.6	-69.3	-26.1	0	0	0	115.4
949	T	74.3	Confident	74.4	Confident	28 Å²	28	82 Å²	82	17%	0.172	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.1	170.8	-45.4	0	0	0	0	110	L885 V936	L885-T949 HydrophobicContact CB-CG2 4.42Å; L885-T949 HydrophobicContact CD1-CG2 3.96Å; V936-T949 HydrophobicContact CG1-CG2 3.88Å
950	N	85.1	Confident	75.6	Confident	68 Å²	68	83.9 Å²	83.9	36%	0.364	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143.4	174.1	-173.6	25.4	0	0	0	110.7	Q844 K937	Q844-N950 PolarHBondContact NE2-OD1 2.78Å; K937-N950 PolarHBondContact N-O 2.95Å; K937-N950 PolarHBondContact O-N 3.2Å; K937-N950 VanDerWaalsContact O-N 3.1Å
951	M	90.7	Very high	76.8	Confident	7 Å²	7	79.3 Å²	79.3	3%	0.034	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	120.4	-179.8	-171	-178.4	76.7	0	0	111.1	L846 F874 V876 V886 Y888 F934 K935 V936	L846-M951 HydrophobicContact CD1-CB 4.39Å; L846-M951 HydrophobicContact CD1-CE 3.7Å; F874-M951 HydrophobicContact CD1-CE 4.35Å; F874-M951 HydrophobicContact CD1-SD 4.21Å; F874-M951 HydrophobicContact CE1-CE 4.4Å; F874-M951 HydrophobicContact CE1-SD 3.71Å; V876-M951 HydrophobicContact CG2-SD 3.98Å; V886-M951 HydrophobicContact CG1-CB 4.16Å; V886-M951 HydrophobicContact CG1-CE 3.88Å; V886-M951 HydrophobicContact CG1-SD 4.21Å; V886-M951 HydrophobicContact CG2-CB 4.31Å; Y888-M951 HydrophobicContact CD2-CE 3.75Å; Y888-M951 HydrophobicContact CG-CE 4.09Å; F934-M951 HydrophobicContact CB-CG 4.11Å; F934-M951 HydrophobicContact CB-SD 4.18Å; F934-M951 HydrophobicContact CD1-CE 3.68Å; F934-M951 HydrophobicContact CD1-CG 4.09Å; F934-M951 HydrophobicContact CD1-SD 3.95Å; F934-M951 HydrophobicContact CE1-CE 3.76Å; F934-M951 HydrophobicContact CG-CE 4.34Å; F934-M951 HydrophobicContact CG-CG 4.41Å; F934-M951 HydrophobicContact CG-SD 4.09Å; F934-M951 HydrophobicContact CZ-CE 4.48Å; K935-M951 WeakPolarHBondContact O-CA 3.31Å; V936-M951 HydrophobicContact CG2-CG 4.16Å
952	D	92	Very high	78.4	Confident	56 Å²	56	70.2 Å²	70.2	30%	0.299	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.8	178.9	-64.7	-35.8	0	0	0	110.7	F934 K935 K937 V954	F934-D952 CarbonylContact C-O 3.54Å; F934-D952 WeakPolarHBondContact CA-O 3.31Å; K935-D952 PolarHBondContact N-O 2.87Å; K935-D952 PolarHBondContact O-N 2.9Å; K937-D952 WeakPolarHBondContact CE-OD2 3.48Å; K937-D952 IonicContact NZ-OD2 2.68Å; K937-D952 PolarHBondContact NZ-OD2 2.95Å; D952-V954 PolarHBondContact O-N 2.93Å
953	L	93.9	Very high	80.5	Confident	62 Å²	62	67 Å²	67	33%	0.325	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	108.7	167.2	178.8	67.7	0	0	0	109.4	L932 F934	L932-L953 HydrophobicContact CB-CD1 4.09Å; L932-L953 HydrophobicContact CD2-CD1 4.18Å; F934-L953 HydrophobicContact CD1-CB 4.12Å; F934-L953 HydrophobicContact CD1-CD1 3.95Å; F934-L953 HydrophobicContact CE1-CB 3.98Å; F934-L953 HydrophobicContact CE1-CD1 3.62Å; F934-L953 HydrophobicContact CE1-CG 4.34Å; F934-L953 HydrophobicContact CZ-CD1 3.95Å
954	V	94.3	Very high	82.6	Confident	51 Å²	51	68.1 Å²	68.1	31%	0.309	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-42.9	-174.5	-179.4	0	0	0	0	111.8	Y911 V933 K935 D952 W986 H993	Y911-V954 HydrophobicContact CD1-CG2 4.38Å; Y911-V954 HydrophobicContact CE1-CB 4.5Å; Y911-V954 HydrophobicContact CE1-CG1 4.38Å; Y911-V954 HydrophobicContact CE1-CG2 3.99Å; V933-V954 HydrophobicContact CG1-CB 4.49Å; V933-V954 PolarHBondContact O-N 2.88Å; K935-V954 HydrophobicContact CB-CG2 3.64Å; D952-V954 PolarHBondContact O-N 2.93Å; V954-W986 HydrophobicContact CG1-CH2 4.11Å; V954-W986 HydrophobicContact CG1-CZ2 4.09Å; V954-H993 HydrophobicContact CG1-CB 4.49Å
955	H	94.8	Very high	84.8	Confident	37 Å²	37	59.1 Å²	59.1	17%	0.171	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	149.6	-177.6	-167.8	63.5	0	0	0	112.3	V933 W986 H993 L995	V933-H955 HydrophobicContact CB-CB 4.13Å; V933-H955 HydrophobicContact CG2-CB 4.21Å; V933-H955 PolarHBondContact N-O 3.49Å; V933-H955 PolarHBondContact O-N 3.01Å; H955-W986 HydrophobicContact CB-CH2 3.74Å; H955-W986 HydrophobicContact CB-CZ3 3.91Å; H955-H993 PolarHBondContact ND1-O 2.95Å; H955-L995 PolarHBondContact CD2-N 2.88Å; H955-L995 PolarHBondContact NE2-N 3.17Å; H955-L995 VanDerWaalsContact NE2-N 3.17Å
956	E	94.7	Very high	87.2	Confident	74 Å²	74	53.2 Å²	53.2	35%	0.346	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	127.8	174.1	175.9	-178.3	176.8	0	0	108.6	R930 L931 L932	R930-E956 WeakPolarHBondContact CD-OE1 3.48Å; R930-E956 IonicContact CZ-OE1 3.88Å; R930-E956 IonicContact NE-OE1 3.19Å; R930-E956 IonicContact NH1-OE1 3.98Å; R930-E956 PolarHBondContact NH1-OE1 2.76Å; L931-E956 WeakPolarHBondContact O-CA 3.39Å; L932-E956 HydrophobicContact CD2-CB 4.24Å; L932-E956 HydrophobicContact CD2-CG 3.9Å
957	K	95.1	Very high	89.5	Confident	59 Å²	59	52.5 Å²	52.5	26%	0.257	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	119	-179.3	-179.1	69.1	174.1	-150	0	110.9	R930 L931 F984 L995	R930-K957 CarbonylContact C-O 3.54Å; R930-K957 WeakPolarHBondContact CA-O 3.43Å; R930-K957 WeakPolarHBondContact CB-O 3.22Å; L931-K957 HydrophobicContact CB-CB 4.32Å; L931-K957 PolarHBondContact N-O 2.85Å; L931-K957 PolarHBondContact O-N 2.89Å; K957-F984 HydrophobicContact CG-CE1 4.45Å; K957-L995 HydrophobicContact CB-CB 4.47Å; K957-L995 HydrophobicContact CB-CD1 4.27Å; K957-L995 HydrophobicContact CG-CB 4.37Å; K957-L995 PolarHBondContact NZ-O 3.17Å
958	T	94.5	Very high	91.6	Very high	68 Å²	68	43.7 Å²	43.7	42%	0.417	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	140.4	176	55.4	0	0	0	0	111.8	M855 G929 R930	M855-T958 HydrophobicContact CE-CG2 3.78Å; M855-T958 HydrophobicContact SD-CG2 4.29Å; G929-T958 WeakPolarHBondContact O-CA 3.2Å; R930-T958 HydrophobicContact CB-CG2 4.48Å
959	V	95.1	Very high	93	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.042	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	156.3	177.5	-64.9	0	0	0	0	110.7	G929 L931 G961 V977 F984	G929-V959 PolarHBondContact N-O 3.12Å; G929-V959 PolarHBondContact O-N 2.72Å; G929-V959 VanDerWaalsContact O-O 3.08Å; L931-V959 HydrophobicContact CD1-CG1 4.25Å; L931-V959 HydrophobicContact CG-CG1 4.23Å; V959-G961 PolarHBondContact O-N 2.94Å; V959-V977 HydrophobicContact CB-CG1 4.34Å; V959-V977 HydrophobicContact CB-CG2 4.37Å; V959-V977 HydrophobicContact CG2-CG1 4.28Å; V959-V977 HydrophobicContact CG2-CG2 4.39Å; V959-F984 HydrophobicContact CG1-CZ 4.27Å
960	N	93.4	Very high	93.8	Very high	149 Å²	149	41.1 Å²	41.1	80%	0.797	21%	0.213	S	C	*	.	S	Bend	trans	-93.6	64.6	-176.1	-62.4	-21	0	0	0	110.9	S927	S927-N960 CarbonylContact O-C 3.57Å
961	G	93.2	Very high	94.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	152.4	-176.4	-178.9	0	0	0	0	0	112.3	A926 S927 G929 V959 P963	A926-G961 WeakPolarHBondContact O-CA 3.2Å; S927-G961 PolarHBondContact O-N 3.48Å; G929-G961 VanDerWaalsContact CA-O 3.31Å; G929-G961 WeakPolarHBondContact CA-O 3.38Å; G929-G961 PolarHBondContact N-O 2.82Å; V959-G961 PolarHBondContact O-N 2.94Å; G961-P963 WeakPolarHBondContact O-CD 3.43Å
962	A	94.4	Very high	94.3	Very high	3 Å²	3	44.3 Å²	44.3	3%	0.025	22%	0.224	C	C	.	.			trans	-84.9	122.1	173.3	0	0	0	0	0	110.7	A917 A926 Y964 V977 N978	A917-A962 HydrophobicContact CB-CB 3.67Å; A926-A962 HydrophobicContact CB-CB 4.24Å; A962-Y964 HydrophobicContact CB-CD1 4.16Å; A962-Y964 HydrophobicContact CB-CE1 3.67Å; A962-Y964 HydrophobicContact CB-CE2 4.32Å; A962-Y964 PolarHBondContact O-N 2.88Å; A962-V977 WeakPolarHBondContact O-CA 3.33Å; A962-N978 PolarHBondContact N-OD1 2.99Å; A962-N978 PolarHBondContact O-N 2.93Å; A962-N978 PolarHBondContact O-OD1 3.43Å
963	P	96.4	Very high	94.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	87.5	172.4	31	-34.1	0	0	0	110.5	C897 S898 G915 T916 L931 G961 V975 A976 V977	C897-P963 VanDerWaalsContact CB-O 3.28Å; C897-P963 WeakPolarHBondContact CB-O 3.49Å; S898-P963 WeakPolarHBondContact CB-O 3.18Å; S898-P963 PolarHBondContact OG-O 3.18Å; G915-P963 VanDerWaalsContact C-CG 3.5Å; T916-P963 VanDerWaalsContact O-CD 3.3Å; T916-P963 WeakPolarHBondContact O-CD 3.35Å; L931-P963 HydrophobicContact CD2-CB 3.83Å; L931-P963 HydrophobicContact CD2-CG 4.08Å; G961-P963 WeakPolarHBondContact O-CD 3.43Å; P963-V975 HydrophobicContact CB-CG1 3.8Å; P963-A976 CarbonylContact C-O 3.59Å; P963-A976 VanDerWaalsContact CA-O 3.26Å; P963-A976 WeakPolarHBondContact CA-O 3.41Å; P963-V977 HydrophobicContact CB-CG2 4.33Å
964	Y	94.8	Very high	94.7	Very high	70 Å²	70	38.7 Å²	38.7	28%	0.275	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	-36.1	-174.8	-66.5	-56.6	0	0	0	113.6	A962 A976	A962-Y964 HydrophobicContact CB-CD1 4.16Å; A962-Y964 HydrophobicContact CB-CE1 3.67Å; A962-Y964 HydrophobicContact CB-CE2 4.32Å; A962-Y964 PolarHBondContact O-N 2.88Å; Y964-A976 PolarHBondContact N-O 3.31Å
965	S	95.6	Very high	94.9	Very high	17 Å²	17	36.3 Å²	36.3	12%	0.119	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	150.3	-178.5	-175.2	0	0	0	0	112.1	A976 L1010	S965-A976 PolarHBondContact O-N 2.73Å; S965-L1010 WeakPolarHBondContact OG-CB 3.35Å; S965-L1010 PolarHBondContact OG-N 2.74Å
966	M	96.7	Very high	94.9	Very high	15 Å²	15	34.5 Å²	34.5	7%	0.074	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	143.7	179.9	-64.7	-175.3	-61.3	0	0	110.5	S898 L900 I913 L931 L973 L974 V975	S898-M966 WeakPolarHBondContact OG-CE 3.45Å; L900-M966 HydrophobicContact CB-CB 4.22Å; L900-M966 HydrophobicContact CB-CE 4.18Å; L900-M966 HydrophobicContact CD2-CB 4.14Å; I913-M966 HydrophobicContact CB-CE 4.35Å; I913-M966 HydrophobicContact CG2-CE 4.12Å; I913-M966 HydrophobicContact CG2-SD 3.82Å; I913-M966 WeakPolarHBondContact O-CE 3.25Å; L931-M966 HydrophobicContact CD2-SD 3.83Å; M966-L973 HydrophobicContact CB-CD1 4.38Å; M966-L974 WeakPolarHBondContact CA-O 3.47Å; M966-V975 HydrophobicContact CG-CB 4.44Å; M966-V975 HydrophobicContact CG-CG1 4Å; M966-V975 HydrophobicContact CG-CG2 4.12Å
967	V	95.7	Very high	95	Very high	16 Å²	16	31.3 Å²	31.3	10%	0.097	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	143.9	175.3	70.2	0	0	0	0	111.5	F969 L974 L1010 K1012 V1018	V967-F969 PolarHBondContact O-N 2.97Å; V967-L974 HydrophobicContact CG1-CB 3.85Å; V967-L974 HydrophobicContact CG1-CD2 3.95Å; V967-L974 HydrophobicContact CG1-CG 4.4Å; V967-L974 PolarHBondContact N-O 2.86Å; V967-L974 PolarHBondContact O-N 3.38Å; V967-L1010 HydrophobicContact CG1-CB 4.2Å; V967-L1010 HydrophobicContact CG1-CD1 4.34Å; V967-K1012 HydrophobicContact CG2-CB 3.72Å; V967-V1018 HydrophobicContact CG1-CG1 4.16Å; V967-V1018 HydrophobicContact CG1-CG2 4.19Å
968	E	94.9	Very high	94.9	Very high	43 Å²	43	29.1 Å²	29.1	20%	0.201	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	123.8	169.2	-178.5	-78.5	132.7	0	0	108.8	C902 K971 K1012	C902-E968 HydrophobicContact CB-CB 3.69Å; C902-E968 HydrophobicContact CB-CG 4.01Å; E968-K971 VanDerWaalsContact OE1-CA 3.24Å; E968-K971 WeakPolarHBondContact OE1-CA 3.3Å; E968-K971 PolarHBondContact OE1-N 3.45Å; E968-K1012 WeakPolarHBondContact O-CD 3.38Å; E968-K1012 IonicContact OE1-NZ 2.74Å; E968-K1012 IonicContact OE2-NZ 3.71Å; E968-K1012 PolarHBondContact OE2-NZ 2.85Å
969	F	94	Very high	94.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	114.5	-172.9	-175.8	-136.2	0	0	0	110.6	V967 K971 K972 L974 L983 P1015 S1016 V1018 Y1032 L1039	V967-F969 PolarHBondContact O-N 2.97Å; F969-K971 VanDerWaalsContact C-N 3.3Å; F969-K971 PolarHBondContact O-N 2.93Å; F969-K972 PolarHBondContact N-O 2.99Å; F969-K972 CarbonylContact O-C 3.6Å; F969-K972 WeakPolarHBondContact O-CA 3.32Å; F969-K972 VanDerWaalsContact O-CB 3.27Å; F969-K972 WeakPolarHBondContact O-CB 3.24Å; F969-K972 PolarHBondContact O-N 3.17Å; F969-L974 HydrophobicContact CB-CB 3.98Å; F969-L974 HydrophobicContact CD1-CB 4.34Å; F969-L974 HydrophobicContact CD1-CD1 4.42Å; F969-L974 HydrophobicContact CD1-CD2 4.12Å; F969-L983 HydrophobicContact CD1-CD1 4.09Å; F969-P1015 WeakPolarHBondContact CE2-O 3.49Å; F969-S1016 VanDerWaalsContact CZ-C 3.41Å; F969-S1016 WeakPolarHBondContact CZ-O 3.43Å; F969-V1018 HydrophobicContact CB-CG2 4.44Å; F969-V1018 HydrophobicContact CD1-CG2 4.24Å; F969-V1018 HydrophobicContact CD2-CG2 3.53Å; F969-V1018 HydrophobicContact CE1-CG2 4.28Å; F969-V1018 HydrophobicContact CE2-CG2 3.65Å; F969-V1018 HydrophobicContact CG-CG2 3.85Å; F969-V1018 HydrophobicContact CZ-CG2 4.02Å; F969-Y1032 HydrophobicContact CE1-CG 4.11Å; F969-Y1032 VanDerWaalsContact CZ-CB 3.47Å; F969-L1039 HydrophobicContact CE1-CD1 4.03Å
970	N	90.5	Very high	94.8	Very high	61 Å²	61	30.5 Å²	30.5	33%	0.326	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	46.3	-176.6	-160.1	13.4	0	0	0	113.7	K972 Y1032	N970-K972 PolarHBondContact O-N 3.26Å; N970-Y1032 HydrophobicContact CB-CD1 4.38Å; N970-Y1032 WeakPolarHBondContact ND2-CE1 3.5Å
971	K	91.1	Very high	94.9	Very high	112 Å²	112	23.4 Å²	23.4	49%	0.487	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	16.3	-174.6	-58.1	176.6	163.3	-170.8	0	114.4	A905 N906 E968 F969	A905-K971 PolarHBondContact N-O 3.22Å; A905-K971 WeakPolarHBondContact O-CD 3.48Å; N906-K971 PolarHBondContact OD1-NZ 3.46Å; E968-K971 VanDerWaalsContact OE1-CA 3.24Å; E968-K971 WeakPolarHBondContact OE1-CA 3.3Å; E968-K971 PolarHBondContact OE1-N 3.45Å; F969-K971 VanDerWaalsContact C-N 3.3Å; F969-K971 PolarHBondContact O-N 2.93Å
972	K	94.9	Very high	95	Very high	31 Å²	31	24.6 Å²	24.6	14%	0.135	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	173.6	177.1	-63.9	173.9	-178.1	-178.7	0	109	F969 N970 L983 F984 E998 Y1032	F969-K972 PolarHBondContact N-O 2.99Å; F969-K972 CarbonylContact O-C 3.6Å; F969-K972 WeakPolarHBondContact O-CA 3.32Å; F969-K972 VanDerWaalsContact O-CB 3.27Å; F969-K972 WeakPolarHBondContact O-CB 3.24Å; F969-K972 PolarHBondContact O-N 3.17Å; N970-K972 PolarHBondContact O-N 3.26Å; K972-L983 HydrophobicContact CB-CD1 3.8Å; K972-L983 HydrophobicContact CB-CG 4.42Å; K972-L983 HydrophobicContact CD-CD1 4.48Å; K972-L983 HydrophobicContact CD-CD2 4.23Å; K972-L983 HydrophobicContact CD-CG 4.35Å; K972-F984 WeakPolarHBondContact CB-O 3.37Å; K972-E998 WeakPolarHBondContact CD-OE2 3.48Å; K972-E998 WeakPolarHBondContact CE-OE2 3.41Å; K972-E998 IonicContact NZ-OE1 2.9Å; K972-E998 PolarHBondContact NZ-OE1 2.94Å; K972-E998 IonicContact NZ-OE2 3.75Å; K972-E998 PolarHBondContact NZ-OE2 3.49Å; K972-Y1032 PolarHBondContact NZ-OH 2.91Å
973	L	97	Very high	95.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	113.3	179.2	179.3	68.2	0	0	0	109.7	L900 L904 I913 L931 M966 V975 F984 L995	L900-L973 HydrophobicContact CD2-CD1 3.78Å; L904-L973 HydrophobicContact CD2-CB 4.15Å; I913-L973 HydrophobicContact CD1-CD1 3.94Å; I913-L973 HydrophobicContact CD1-CD2 3.93Å; I913-L973 HydrophobicContact CD1-CG 4.46Å; I913-L973 HydrophobicContact CG2-CD2 4.2Å; L931-L973 HydrophobicContact CD1-CD2 4.24Å; M966-L973 HydrophobicContact CB-CD1 4.38Å; L973-V975 HydrophobicContact CD1-CG2 4.36Å; L973-V975 HydrophobicContact CD2-CG2 3.84Å; L973-V975 HydrophobicContact CG-CG2 3.67Å; L973-F984 HydrophobicContact CB-CB 4.31Å; L973-F984 PolarHBondContact N-O 3.09Å; L973-F984 PolarHBondContact O-N 2.74Å; L973-L995 HydrophobicContact CB-CD2 4.36Å; L973-L995 HydrophobicContact CD2-CD1 3.95Å; L973-L995 HydrophobicContact CD2-CD2 4.03Å
974	L	97.4	Very high	95.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.6	171.5	-170.1	74.9	0	0	0	109.2	M966 V967 F969 V981 L982 L983 L1010 V1018 L1039	M966-L974 WeakPolarHBondContact CA-O 3.47Å; V967-L974 HydrophobicContact CG1-CB 3.85Å; V967-L974 HydrophobicContact CG1-CD2 3.95Å; V967-L974 HydrophobicContact CG1-CG 4.4Å; V967-L974 PolarHBondContact N-O 2.86Å; V967-L974 PolarHBondContact O-N 3.38Å; F969-L974 HydrophobicContact CB-CB 3.98Å; F969-L974 HydrophobicContact CD1-CB 4.34Å; F969-L974 HydrophobicContact CD1-CD1 4.42Å; F969-L974 HydrophobicContact CD1-CD2 4.12Å; L974-V981 HydrophobicContact CD1-CG1 3.57Å; L974-V981 HydrophobicContact CD2-CG1 4.15Å; L974-V981 HydrophobicContact CG-CG1 3.76Å; L974-L982 CarbonylContact C-O 3.53Å; L974-L982 WeakPolarHBondContact CA-O 3.41Å; L974-L983 HydrophobicContact CB-CD1 4.16Å; L974-L983 HydrophobicContact CD1-CB 4.02Å; L974-L983 HydrophobicContact CD1-CD1 3.91Å; L974-L1010 HydrophobicContact CD2-CD1 4.21Å; L974-L1010 HydrophobicContact CG-CD1 4.25Å; L974-V1018 HydrophobicContact CD2-CB 4.04Å; L974-V1018 HydrophobicContact CD2-CG1 3.92Å; L974-V1018 HydrophobicContact CD2-CG2 3.87Å; L974-L1039 HydrophobicContact CD1-CD2 3.73Å
975	V	97.7	Very high	95.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125	-174	-173.7	0	0	0	0	110	L931 P963 M966 L973 V977 V981 L982 F984	L931-V975 HydrophobicContact CD1-CG2 4.02Å; L931-V975 HydrophobicContact CD2-CG1 4.1Å; P963-V975 HydrophobicContact CB-CG1 3.8Å; M966-V975 HydrophobicContact CG-CB 4.44Å; M966-V975 HydrophobicContact CG-CG1 4Å; M966-V975 HydrophobicContact CG-CG2 4.12Å; L973-V975 HydrophobicContact CD1-CG2 4.36Å; L973-V975 HydrophobicContact CD2-CG2 3.84Å; L973-V975 HydrophobicContact CG-CG2 3.67Å; V975-V977 HydrophobicContact CB-CG2 4.39Å; V975-V977 HydrophobicContact CG1-CG2 3.59Å; V975-V981 CarbonylContact O-C 3.53Å; V975-V981 WeakPolarHBondContact O-CA 2.99Å; V975-L982 PolarHBondContact N-O 3.25Å; V975-L982 PolarHBondContact O-N 3.29Å; V975-F984 HydrophobicContact CB-CE2 4.34Å; V975-F984 HydrophobicContact CG2-CD2 3.9Å; V975-F984 HydrophobicContact CG2-CE2 4.09Å
976	A	96.5	Very high	95.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	115.8	168.9	0	0	0	0	0	109.7	P963 Y964 S965 M1007 L1010	P963-A976 CarbonylContact C-O 3.59Å; P963-A976 VanDerWaalsContact CA-O 3.26Å; P963-A976 WeakPolarHBondContact CA-O 3.41Å; Y964-A976 PolarHBondContact N-O 3.31Å; S965-A976 PolarHBondContact O-N 2.73Å; A976-M1007 HydrophobicContact CB-CB 3.82Å; A976-M1007 HydrophobicContact CB-CG 3.66Å; A976-M1007 WeakPolarHBondContact CB-O 3.41Å; A976-L1010 HydrophobicContact CB-CD1 3.76Å; A976-L1010 HydrophobicContact CB-CG 3.98Å
977	V	96.3	Very high	95.1	Very high	6 Å²	6	25.7 Å²	25.7	4%	0.036	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	105	179.2	-174.3	0	0	0	0	108.9	V959 A962 P963 V975 N979 V980 L982	V959-V977 HydrophobicContact CB-CG1 4.34Å; V959-V977 HydrophobicContact CB-CG2 4.37Å; V959-V977 HydrophobicContact CG2-CG1 4.28Å; V959-V977 HydrophobicContact CG2-CG2 4.39Å; A962-V977 WeakPolarHBondContact O-CA 3.33Å; P963-V977 HydrophobicContact CB-CG2 4.33Å; V975-V977 HydrophobicContact CB-CG2 4.39Å; V975-V977 HydrophobicContact CG1-CG2 3.59Å; V977-N979 PolarHBondContact O-N 3.25Å; V977-V980 CarbonylContact C-O 3.55Å; V977-V980 PolarHBondContact N-O 3.39Å; V977-V980 PolarHBondContact O-N 3.03Å; V977-L982 HydrophobicContact CB-CD1 4.38Å; V977-L982 HydrophobicContact CG2-CD1 3.88Å; V977-L982 HydrophobicContact CG2-CG 4.48Å
978	N	93.6	Very high	94.8	Very high	13 Å²	13	29.7 Å²	29.7	7%	0.07	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	-120.1	-173.3	-59.7	7.7	0	0	0	111.1	E925 A926 A962 V980 A1006 M1007	E925-N978 VanDerWaalsContact CD-CG 3.48Å; E925-N978 WeakPolarHBondContact OE1-CB 3.42Å; E925-N978 PolarHBondContact OE1-ND2 3.08Å; E925-N978 VanDerWaalsContact OE1-ND2 3.14Å; E925-N978 PolarHBondContact OE1-OD1 3.01Å; E925-N978 PolarHBondContact OE2-ND2 3.19Å; A926-N978 PolarHBondContact O-ND2 3.42Å; A962-N978 PolarHBondContact N-OD1 2.99Å; A962-N978 PolarHBondContact O-N 2.93Å; A962-N978 PolarHBondContact O-OD1 3.43Å; N978-V980 VanDerWaalsContact C-N 3.34Å; N978-V980 PolarHBondContact O-N 3.08Å; N978-A1006 WeakPolarHBondContact O-CA 3.31Å; N978-M1007 PolarHBondContact O-N 2.86Å
979	N	91.3	Very high	94.4	Very high	72 Å²	72	34.9 Å²	34.9	39%	0.385	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	13.6	179.3	74.4	-35.5	0	0	0	114.4	V977 C1003 V1005	V977-N979 PolarHBondContact O-N 3.25Å; N979-C1003 WeakPolarHBondContact CA-SG 3.3Å; N979-C1003 PolarHBondContact O-N 2.95Å; N979-C1003 PolarHBondContact O-SG 2.82Å; N979-V1005 VanDerWaalsContact CB-O 3.25Å; N979-V1005 WeakPolarHBondContact CB-O 3.03Å
980	V	94.6	Very high	93.9	Very high	33 Å²	33	42.6 Å²	42.6	20%	0.2	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.7	-178.8	-170.5	0	0	0	0	111	V977 N978 L982 F1000 T1002	V977-V980 CarbonylContact C-O 3.55Å; V977-V980 PolarHBondContact N-O 3.39Å; V977-V980 PolarHBondContact O-N 3.03Å; N978-V980 VanDerWaalsContact C-N 3.34Å; N978-V980 PolarHBondContact O-N 3.08Å; V980-L982 HydrophobicContact CG1-CD2 3.59Å; V980-L982 HydrophobicContact CG1-CG 4.25Å; V980-F1000 HydrophobicContact CG1-CB 4.04Å; V980-F1000 HydrophobicContact CG1-CD2 4.15Å; V980-F1000 HydrophobicContact CG1-CG 4.5Å; V980-T1002 HydrophobicContact CG2-CG2 4.39Å
981	V	95.7	Very high	93.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	122	170.5	-174.6	0	0	0	0	109.1	L974 V975 F1000 C1001 M1007 F1030 L1039	L974-V981 HydrophobicContact CD1-CG1 3.57Å; L974-V981 HydrophobicContact CD2-CG1 4.15Å; L974-V981 HydrophobicContact CG-CG1 3.76Å; V975-V981 CarbonylContact O-C 3.53Å; V975-V981 WeakPolarHBondContact O-CA 2.99Å; V981-F1000 CarbonylContact O-C 3.53Å; V981-F1000 WeakPolarHBondContact O-CA 3.47Å; V981-C1001 PolarHBondContact N-O 3.43Å; V981-C1001 PolarHBondContact O-N 3.06Å; V981-M1007 HydrophobicContact CG2-CB 4.14Å; V981-M1007 HydrophobicContact CG2-CE 4.42Å; V981-M1007 HydrophobicContact CG2-CG 3.85Å; V981-F1030 HydrophobicContact CB-CE1 4.38Å; V981-F1030 HydrophobicContact CB-CZ 4.25Å; V981-F1030 HydrophobicContact CG2-CE1 4.14Å; V981-F1030 HydrophobicContact CG2-CE2 3.94Å; V981-F1030 HydrophobicContact CG2-CZ 3.55Å; V981-L1039 HydrophobicContact CB-CD2 4.48Å; V981-L1039 HydrophobicContact CG1-CD2 4.05Å
982	L	96.9	Very high	93.2	Very high	25 Å²	25	51.9 Å²	51.9	13%	0.131	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.4	-174.7	-58	177.6	0	0	0	110.5	L974 V975 V977 V980 F984 L997 F1000	L974-L982 CarbonylContact C-O 3.53Å; L974-L982 WeakPolarHBondContact CA-O 3.41Å; V975-L982 PolarHBondContact N-O 3.25Å; V975-L982 PolarHBondContact O-N 3.29Å; V977-L982 HydrophobicContact CB-CD1 4.38Å; V977-L982 HydrophobicContact CG2-CD1 3.88Å; V977-L982 HydrophobicContact CG2-CG 4.48Å; V980-L982 HydrophobicContact CG1-CD2 3.59Å; V980-L982 HydrophobicContact CG1-CG 4.25Å; L982-F984 HydrophobicContact CB-CD2 4.21Å; L982-F984 HydrophobicContact CB-CE2 3.58Å; L982-F984 HydrophobicContact CB-CZ 4.09Å; L982-F984 HydrophobicContact CD1-CE2 3.92Å; L982-F984 HydrophobicContact CD1-CZ 3.82Å; L982-F984 HydrophobicContact CG-CE2 4.41Å; L982-L997 HydrophobicContact CB-CD1 3.86Å; L982-L997 HydrophobicContact CD2-CD1 3.88Å; L982-L997 HydrophobicContact CG-CD1 4.35Å; L982-F1000 HydrophobicContact CD2-CB 3.64Å
983	L	96.8	Very high	93.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	119.3	171.4	-174.4	64.8	0	0	0	110.2	F969 K972 L974 E998 C999 Y1032	F969-L983 HydrophobicContact CD1-CD1 4.09Å; K972-L983 HydrophobicContact CB-CD1 3.8Å; K972-L983 HydrophobicContact CB-CG 4.42Å; K972-L983 HydrophobicContact CD-CD1 4.48Å; K972-L983 HydrophobicContact CD-CD2 4.23Å; K972-L983 HydrophobicContact CD-CG 4.35Å; L974-L983 HydrophobicContact CB-CD1 4.16Å; L974-L983 HydrophobicContact CD1-CB 4.02Å; L974-L983 HydrophobicContact CD1-CD1 3.91Å; L983-E998 PolarHBondContact O-N 2.86Å; L983-C999 PolarHBondContact N-O 2.94Å; L983-Y1032 HydrophobicContact CD2-CD2 3.57Å; L983-Y1032 HydrophobicContact CD2-CE2 3.38Å; L983-Y1032 HydrophobicContact CD2-CG 4.25Å
984	F	96.7	Very high	92.9	Very high	5 Å²	5	53.7 Å²	53.7	2%	0.022	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132.2	179.2	-68	-82	0	0	0	112.3	L931 K957 V959 K972 L973 V975 L982 L995 Q996 L997	L931-F984 HydrophobicContact CD1-CD2 4.33Å; L931-F984 HydrophobicContact CD1-CE2 4.02Å; K957-F984 HydrophobicContact CG-CE1 4.45Å; V959-F984 HydrophobicContact CG1-CZ 4.27Å; K972-F984 WeakPolarHBondContact CB-O 3.37Å; L973-F984 HydrophobicContact CB-CB 4.31Å; L973-F984 PolarHBondContact N-O 3.09Å; L973-F984 PolarHBondContact O-N 2.74Å; V975-F984 HydrophobicContact CB-CE2 4.34Å; V975-F984 HydrophobicContact CG2-CD2 3.9Å; V975-F984 HydrophobicContact CG2-CE2 4.09Å; L982-F984 HydrophobicContact CB-CD2 4.21Å; L982-F984 HydrophobicContact CB-CE2 3.58Å; L982-F984 HydrophobicContact CB-CZ 4.09Å; L982-F984 HydrophobicContact CD1-CE2 3.92Å; L982-F984 HydrophobicContact CD1-CZ 3.82Å; L982-F984 HydrophobicContact CG-CE2 4.41Å; F984-L995 HydrophobicContact CB-CB 4.31Å; F984-L995 HydrophobicContact CB-CD2 3.86Å; F984-L995 HydrophobicContact CD1-CB 4.14Å; F984-L995 HydrophobicContact CG-CB 4.4Å; F984-Q996 CarbonylContact C-O 3.56Å; F984-Q996 VanDerWaalsContact CA-O 3.28Å; F984-Q996 WeakPolarHBondContact CA-O 3.49Å; F984-L997 HydrophobicContact CD1-CB 4.13Å; F984-L997 HydrophobicContact CD1-CD1 4.34Å; F984-L997 HydrophobicContact CE1-CB 3.89Å; F984-L997 HydrophobicContact CE1-CD1 4.02Å; F984-L997 HydrophobicContact CZ-CD1 4.19Å
985	E	95.3	Very high	92.8	Very high	86 Å²	86	53.8 Å²	53.8	40%	0.402	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	136.8	169.6	-167.5	-175.9	-175.2	0	0	110.8	V987 Q996	E985-V987 HydrophobicContact CB-CG2 4.1Å; E985-V987 HydrophobicContact CG-CG2 3.82Å; E985-V987 PolarHBondContact O-N 3.41Å; E985-Q996 PolarHBondContact N-O 3.43Å; E985-Q996 PolarHBondContact O-N 2.81Å
986	W	95.4	Very high	92.6	Very high	10 Å²	10	56.2 Å²	56.2	4%	0.038	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	100.7	174.8	-171.8	-121.7	0	0	0	110.7	L904 A905 D907 Y911 V933 V954 H955 H993 L995	L904-W986 HydrophobicContact CB-CB 3.64Å; L904-W986 HydrophobicContact CB-CD2 4.48Å; L904-W986 HydrophobicContact CB-CG 3.7Å; L904-W986 HydrophobicContact CD1-CB 4.03Å; L904-W986 HydrophobicContact CD1-CD2 4.03Å; L904-W986 HydrophobicContact CD1-CE3 4.25Å; L904-W986 HydrophobicContact CD1-CG 3.99Å; L904-W986 HydrophobicContact CG-CB 4.44Å; A905-W986 HydrophobicContact CB-CB 4.31Å; D907-W986 PolarHBondContact OD2-NE1 2.7Å; D907-W986 VanDerWaalsContact OD2-NE1 3.1Å; Y911-W986 HydrophobicContact CE2-CZ2 4Å; Y911-W986 AromaticContact CE2-NE1 3.7Å; Y911-W986 AromaticContact CZ-CZ2 3.96Å; V933-W986 HydrophobicContact CB-CH2 4.28Å; V933-W986 HydrophobicContact CG1-CH2 3.83Å; V933-W986 HydrophobicContact CG1-CZ2 4.3Å; V933-W986 HydrophobicContact CG1-CZ3 4.46Å; V933-W986 HydrophobicContact CG2-CH2 4.34Å; V933-W986 HydrophobicContact CG2-CZ3 4.26Å; V954-W986 HydrophobicContact CG1-CH2 4.11Å; V954-W986 HydrophobicContact CG1-CZ2 4.09Å; H955-W986 HydrophobicContact CB-CH2 3.74Å; H955-W986 HydrophobicContact CB-CZ3 3.91Å; W986-H993 AromaticContact CD1-ND1 3.76Å; W986-H993 HydrophobicContact CD2-CB 4.11Å; W986-H993 AromaticContact CE2-CG 3.76Å; W986-H993 AromaticContact CE2-ND1 3.7Å; W986-H993 HydrophobicContact CE3-CB 4.44Å; W986-H993 HydrophobicContact CH2-CB 3.58Å; W986-H993 HydrophobicContact CZ2-CB 3.13Å; W986-H993 AromaticContact CZ2-CG 3.77Å; W986-H993 HydrophobicContact CZ3-CB 4.2Å; W986-H993 AromaticContact NE1-CE1 3.93Å; W986-H993 AromaticContact NE1-CG 3.65Å; W986-H993 AromaticContact NE1-ND1 3.14Å; W986-H993 PolarHBondContact NE1-ND1 2.96Å; W986-H993 VanDerWaalsContact NE1-ND1 3.14Å; W986-L995 HydrophobicContact CE3-CD2 3.63Å; W986-L995 HydrophobicContact CE3-CG 3.76Å; W986-L995 HydrophobicContact CZ3-CD2 4.16Å; W986-L995 HydrophobicContact CZ3-CG 3.82Å
987	V	93.8	Very high	92.6	Very high	26 Å²	26	60.4 Å²	60.4	16%	0.158	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130	-172	-170.7	0	0	0	0	110.9	E985 R989 S994 Q996	E985-V987 HydrophobicContact CB-CG2 4.1Å; E985-V987 HydrophobicContact CG-CG2 3.82Å; E985-V987 PolarHBondContact O-N 3.41Å; V987-R989 HydrophobicContact CG1-CG 3.95Å; V987-S994 PolarHBondContact N-O 3Å; V987-S994 PolarHBondContact O-N 3.2Å; V987-S994 PolarHBondContact O-OG 3.35Å; V987-Q996 HydrophobicContact CB-CG 4.4Å; V987-Q996 HydrophobicContact CG2-CB 4.18Å; V987-Q996 HydrophobicContact CG2-CG 4.14Å
988	L	90.4	Very high	92.5	Very high	101 Å²	101	62.5 Å²	62.5	53%	0.529	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	110.3	169.9	-178.6	58.7	0	0	0	110.2
989	R	85.5	Confident	92.5	Very high	151 Å²	151	62.6 Å²	62.6	57%	0.57	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.6	171.6	-69.6	-167.2	-177.7	179.9	4	110.3	V987 K991 K992 Q996	V987-R989 HydrophobicContact CG1-CG 3.95Å; R989-K991 VanDerWaalsContact C-N 3.27Å; R989-K991 PolarHBondContact O-N 2.92Å; R989-K992 PolarHBondContact N-O 3.11Å; R989-K992 PolarHBondContact O-N 3.12Å; R989-Q996 VanDerWaalsContact NE-NE2 3.19Å; R989-Q996 VanDerWaalsContact NH2-OE1 3.1Å
990	N	83.6	Confident	92.6	Very high	163 Å²	163	65.2 Å²	65.2	87%	0.872	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	42.9	177.7	-58.9	-21	0	0	0	113.6	K992	N990-K992 PolarHBondContact O-N 3.41Å; N990-K992 VanDerWaalsContact O-N 3.13Å
991	K	82.1	Confident	92.5	Very high	204 Å²	204	64.7 Å²	64.7	89%	0.887	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	15.8	-176.7	-53.6	-178.3	176.9	-177.1	0	114.8	R989	R989-K991 VanDerWaalsContact C-N 3.27Å; R989-K991 PolarHBondContact O-N 2.92Å
992	K	86.6	Confident	92.3	Very high	163 Å²	163	69.1 Å²	69.1	71%	0.709	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.2	173	-68.4	-171.1	176.3	-172.2	0	109.8	R989 N990	R989-K992 PolarHBondContact N-O 3.11Å; R989-K992 PolarHBondContact O-N 3.12Å; N990-K992 PolarHBondContact O-N 3.41Å; N990-K992 VanDerWaalsContact O-N 3.13Å
993	H	91	Very high	91.7	Very high	45 Å²	45	68.8 Å²	68.8	21%	0.208	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	147	173.1	-66	-95	0	0	0	110.6	D907 V954 H955 W986	D907-H993 IonicContact OD2-CE1 3.28Å; D907-H993 PolarHBondContact OD2-CE1 3.06Å; D907-H993 IonicContact OD2-ND1 2.7Å; D907-H993 PolarHBondContact OD2-ND1 2.86Å; D907-H993 IonicContact OD2-NE2 3.45Å; V954-H993 HydrophobicContact CG1-CB 4.49Å; H955-H993 PolarHBondContact ND1-O 2.95Å; W986-H993 AromaticContact CD1-ND1 3.76Å; W986-H993 HydrophobicContact CD2-CB 4.11Å; W986-H993 AromaticContact CE2-CG 3.76Å; W986-H993 AromaticContact CE2-ND1 3.7Å; W986-H993 HydrophobicContact CE3-CB 4.44Å; W986-H993 HydrophobicContact CH2-CB 3.58Å; W986-H993 HydrophobicContact CZ2-CB 3.13Å; W986-H993 AromaticContact CZ2-CG 3.77Å; W986-H993 HydrophobicContact CZ3-CB 4.2Å; W986-H993 AromaticContact NE1-CE1 3.93Å; W986-H993 AromaticContact NE1-CG 3.65Å; W986-H993 AromaticContact NE1-ND1 3.14Å; W986-H993 PolarHBondContact NE1-ND1 2.96Å; W986-H993 VanDerWaalsContact NE1-ND1 3.14Å
994	S	93.7	Very high	90.9	Very high	24 Å²	24	71.9 Å²	71.9	17%	0.168	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	144.2	-179.1	61.2	0	0	0	0	112	V987	V987-S994 PolarHBondContact N-O 3Å; V987-S994 PolarHBondContact O-N 3.2Å; V987-S994 PolarHBondContact O-OG 3.35Å
995	L	95.6	Very high	90.4	Very high	2 Å²	2	74.4 Å²	74.4	1%	0.01	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117.6	172.3	-71.2	167.7	0	0	0	110.4	L904 L931 V933 H955 K957 L973 F984 W986	L904-L995 HydrophobicContact CD1-CD2 4.4Å; L931-L995 HydrophobicContact CB-CD1 4.46Å; L931-L995 HydrophobicContact CD1-CD1 4.13Å; V933-L995 HydrophobicContact CG2-CD1 4.03Å; H955-L995 PolarHBondContact CD2-N 2.88Å; H955-L995 PolarHBondContact NE2-N 3.17Å; H955-L995 VanDerWaalsContact NE2-N 3.17Å; K957-L995 HydrophobicContact CB-CB 4.47Å; K957-L995 HydrophobicContact CB-CD1 4.27Å; K957-L995 HydrophobicContact CG-CB 4.37Å; K957-L995 PolarHBondContact NZ-O 3.17Å; L973-L995 HydrophobicContact CB-CD2 4.36Å; L973-L995 HydrophobicContact CD2-CD1 3.95Å; L973-L995 HydrophobicContact CD2-CD2 4.03Å; F984-L995 HydrophobicContact CB-CB 4.31Å; F984-L995 HydrophobicContact CB-CD2 3.86Å; F984-L995 HydrophobicContact CD1-CB 4.14Å; F984-L995 HydrophobicContact CG-CB 4.4Å; W986-L995 HydrophobicContact CE3-CD2 3.63Å; W986-L995 HydrophobicContact CE3-CG 3.76Å; W986-L995 HydrophobicContact CZ3-CD2 4.16Å; W986-L995 HydrophobicContact CZ3-CG 3.82Å
996	Q	94.3	Very high	90	Very high	52 Å²	52	70.9 Å²	70.9	24%	0.243	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.5	175.6	-64.6	-172.9	16.8	0	0	109.7	F984 E985 V987 R989 E998	F984-Q996 CarbonylContact C-O 3.56Å; F984-Q996 VanDerWaalsContact CA-O 3.28Å; F984-Q996 WeakPolarHBondContact CA-O 3.49Å; E985-Q996 PolarHBondContact N-O 3.43Å; E985-Q996 PolarHBondContact O-N 2.81Å; V987-Q996 HydrophobicContact CB-CG 4.4Å; V987-Q996 HydrophobicContact CG2-CB 4.18Å; V987-Q996 HydrophobicContact CG2-CG 4.14Å; R989-Q996 VanDerWaalsContact NE-NE2 3.19Å; R989-Q996 VanDerWaalsContact NH2-OE1 3.1Å; Q996-E998 PolarHBondContact O-N 3.42Å
997	L	95.1	Very high	89.8	Confident	87 Å²	87	70.4 Å²	70.4	46%	0.455	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	126.3	177.8	-179.7	68.8	0	0	0	108.4	L982 F984 C999	L982-L997 HydrophobicContact CB-CD1 3.86Å; L982-L997 HydrophobicContact CD2-CD1 3.88Å; L982-L997 HydrophobicContact CG-CD1 4.35Å; F984-L997 HydrophobicContact CD1-CB 4.13Å; F984-L997 HydrophobicContact CD1-CD1 4.34Å; F984-L997 HydrophobicContact CE1-CB 3.89Å; F984-L997 HydrophobicContact CE1-CD1 4.02Å; F984-L997 HydrophobicContact CZ-CD1 4.19Å; L997-C999 WeakPolarHBondContact CD1-O 3.49Å
998	E	93.6	Very high	89.5	Confident	50 Å²	50	70.8 Å²	70.8	23%	0.234	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-57.7	178	-178.1	178.1	166.9	0	0	110.7	K972 L983 Q996 Y1032	K972-E998 WeakPolarHBondContact CD-OE2 3.48Å; K972-E998 WeakPolarHBondContact CE-OE2 3.41Å; K972-E998 IonicContact NZ-OE1 2.9Å; K972-E998 PolarHBondContact NZ-OE1 2.94Å; K972-E998 IonicContact NZ-OE2 3.75Å; K972-E998 PolarHBondContact NZ-OE2 3.49Å; L983-E998 PolarHBondContact O-N 2.86Å; Q996-E998 PolarHBondContact O-N 3.42Å; E998-Y1032 PolarHBondContact OE1-OH 3.42Å
999	C	94.5	Very high	89.6	Confident	15 Å²	15	67.4 Å²	67.4	10%	0.101	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	170.6	178.6	63.2	0	0	0	0	111.6	L983 L997 S1037	L983-C999 PolarHBondContact N-O 2.94Å; L997-C999 WeakPolarHBondContact CD1-O 3.49Å; C999-S1037 WeakPolarHBondContact CB-O 3.4Å
1000	F	94.1	Very high	90	Very high	128 Å²	128	60.6 Å²	60.6	56%	0.561	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.1	155	178.8	68	-84.9	0	0	0	110.6	V980 V981 L982 T1002	V980-F1000 HydrophobicContact CG1-CB 4.04Å; V980-F1000 HydrophobicContact CG1-CD2 4.15Å; V980-F1000 HydrophobicContact CG1-CG 4.5Å; V981-F1000 CarbonylContact O-C 3.53Å; V981-F1000 WeakPolarHBondContact O-CA 3.47Å; L982-F1000 HydrophobicContact CD2-CB 3.64Å; F1000-T1002 HydrophobicContact CD2-CG2 4.36Å; F1000-T1002 HydrophobicContact CE2-CG2 4.33Å
1001	C	92.2	Very high	90.4	Very high	21 Å²	21	56.4 Å²	56.4	14%	0.142	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	141.2	171.2	-169.1	0	0	0	0	108.7	V981 F1030 L1039	V981-C1001 PolarHBondContact N-O 3.43Å; V981-C1001 PolarHBondContact O-N 3.06Å; C1001-F1030 HydrophobicContact CB-CD1 4.33Å; C1001-F1030 HydrophobicContact CB-CE1 3.94Å; C1001-L1039 HydrophobicContact CB-CB 4.48Å; C1001-L1039 HydrophobicContact CB-CD2 3.9Å; C1001-L1039 HydrophobicContact CB-CG 4.2Å
1002	T	90.5	Very high	90.9	Very high	93 Å²	93	50.9 Å²	50.9	57%	0.571	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	140.8	178	51.8	0	0	0	0	110	V980 F1000	V980-T1002 HydrophobicContact CG2-CG2 4.39Å; F1000-T1002 HydrophobicContact CD2-CG2 4.36Å; F1000-T1002 HydrophobicContact CE2-CG2 4.33Å
1003	C	84.4	Confident	91	Very high	18 Å²	18	44.7 Å²	44.7	12%	0.122	23%	0.234	C	C	.	.			trans	-116.2	174.5	171.3	55.9	0	0	0	0	109.8	N979 M1007	N979-C1003 WeakPolarHBondContact CA-SG 3.3Å; N979-C1003 PolarHBondContact O-N 2.95Å; N979-C1003 PolarHBondContact O-SG 2.82Å; C1003-M1007 HydrophobicContact CB-CE 3.67Å
1004	S	81.2	Confident	90.8	Very high	65 Å²	65	44.1 Å²	44.1	46%	0.455	24%	0.235	S	C	.	.	S	Bend	trans	-76.9	-50.6	-166.7	-63.8	0	0	0	0	113	D1022 E1025	S1004-D1022 PolarHBondContact N-OD2 3Å; S1004-D1022 VanDerWaalsContact N-OD2 3.13Å; S1004-E1025 WeakPolarHBondContact CB-OE2 3.49Å; S1004-E1025 VanDerWaalsContact OG-CD 3.3Å; S1004-E1025 PolarHBondContact OG-OE2 2.65Å
1005	V	85	Confident	90.4	Very high	59 Å²	59	47.2 Å²	47.2	36%	0.358	26%	0.255	S	S	.	.	S	Bend	trans	-117.8	-73.8	-174.1	-174.6	0	0	0	0	111.8	N979 D1022 I1024	N979-V1005 VanDerWaalsContact CB-O 3.25Å; N979-V1005 WeakPolarHBondContact CB-O 3.03Å; V1005-D1022 VanDerWaalsContact CB-OD1 3.29Å; V1005-D1022 WeakPolarHBondContact CB-OD1 3.05Å; V1005-D1022 PolarHBondContact N-OD2 3.25Å; V1005-I1024 HydrophobicContact CG1-CD1 4.04Å; V1005-I1024 HydrophobicContact CG1-CG1 4.25Å; V1005-I1024 HydrophobicContact CG2-CB 4.12Å; V1005-I1024 HydrophobicContact CG2-CD1 4.14Å; V1005-I1024 HydrophobicContact CG2-CG1 4.33Å
1006	A	86.9	Confident	90	Very high	11 Å²	11	49.8 Å²	49.8	9%	0.091	27%	0.273	C	S	.	.			trans	-160.9	124.1	178.4	0	0	0	0	0	110.9	N978 I1008 D1022 F1023	N978-A1006 WeakPolarHBondContact O-CA 3.31Å; A1006-I1008 PolarHBondContact O-N 3.34Å; A1006-D1022 PolarHBondContact N-OD1 2.78Å; A1006-D1022 VanDerWaalsContact O-CA 3.32Å; A1006-D1022 WeakPolarHBondContact O-CA 3.36Å; A1006-F1023 HydrophobicContact CB-CB 4.38Å; A1006-F1023 PolarHBondContact O-N 3.39Å
1007	M	91.3	Very high	89.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	104.2	177.1	-167.6	64.3	50.3	0	0	109.9	A976 N978 V981 C1003 L1010 G1020 G1021 D1022 V1028 F1030	A976-M1007 HydrophobicContact CB-CB 3.82Å; A976-M1007 HydrophobicContact CB-CG 3.66Å; A976-M1007 WeakPolarHBondContact CB-O 3.41Å; N978-M1007 PolarHBondContact O-N 2.86Å; V981-M1007 HydrophobicContact CG2-CB 4.14Å; V981-M1007 HydrophobicContact CG2-CE 4.42Å; V981-M1007 HydrophobicContact CG2-CG 3.85Å; C1003-M1007 HydrophobicContact CB-CE 3.67Å; M1007-L1010 HydrophobicContact CG-CD2 3.92Å; M1007-L1010 HydrophobicContact CG-CG 4.49Å; M1007-L1010 HydrophobicContact SD-CD2 4.28Å; M1007-G1020 VanDerWaalsContact SD-C 3.54Å; M1007-G1020 WeakPolarHBondContact SD-CA 3.45Å; M1007-G1021 PolarHBondContact SD-N 3.26Å; M1007-G1021 VanDerWaalsContact SD-O 3.36Å; M1007-D1022 HydrophobicContact CE-CB 4Å; M1007-V1028 HydrophobicContact CE-CB 4.35Å; M1007-V1028 HydrophobicContact CE-CG2 4.25Å; M1007-F1030 HydrophobicContact CE-CE2 3.79Å; M1007-F1030 HydrophobicContact CE-CZ 3.7Å; M1007-F1030 HydrophobicContact SD-CE2 4.06Å
1008	I	88.9	Confident	89.8	Confident	34 Å²	34	44.1 Å²	44.1	17%	0.174	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-33.1	-173.7	46.9	164.7	0	0	0	113.1	A1006 G1021 F1023 L1051	A1006-I1008 PolarHBondContact O-N 3.34Å; I1008-G1021 WeakPolarHBondContact CG1-O 3.2Å; I1008-G1021 PolarHBondContact N-O 3.23Å; I1008-F1023 HydrophobicContact CD1-CD2 4.29Å; I1008-F1023 HydrophobicContact CG2-CB 4.36Å; I1008-F1023 HydrophobicContact CG2-CD2 4.41Å; I1008-L1051 HydrophobicContact CD1-CB 4.05Å; I1008-L1051 HydrophobicContact CD1-CD2 4.03Å; I1008-L1051 HydrophobicContact CD1-CG 4.18Å; I1008-L1051 VanDerWaalsContact CD1-O 3.24Å; I1008-L1051 WeakPolarHBondContact CD1-O 3.34Å; I1008-L1051 HydrophobicContact CG1-CD2 4.34Å
1009	Q	91.8	Very high	89.8	Confident	30 Å²	30	41.8 Å²	41.8	14%	0.14	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	150.4	-177.2	-65	-168.8	11.5	0	0	111.6	G1020 G1021 T1052 I1054	Q1009-G1020 WeakPolarHBondContact O-CA 3.48Å; Q1009-G1021 PolarHBondContact O-N 3.24Å; Q1009-T1052 PolarHBondContact NE2-O 2.86Å; Q1009-T1052 VanDerWaalsContact NE2-O 3.09Å; Q1009-I1054 HydrophobicContact CB-CD1 3.74Å; Q1009-I1054 HydrophobicContact CB-CG1 3.75Å; Q1009-I1054 VanDerWaalsContact OE1-N 3.11Å
1010	L	94.2	Very high	89.7	Confident	9 Å²	9	41 Å²	41	5%	0.047	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	136	175.4	-66.6	173.8	0	0	0	108.6	S965 V967 L974 A976 M1007 V1018 L1019 F1030	S965-L1010 WeakPolarHBondContact OG-CB 3.35Å; S965-L1010 PolarHBondContact OG-N 2.74Å; V967-L1010 HydrophobicContact CG1-CB 4.2Å; V967-L1010 HydrophobicContact CG1-CD1 4.34Å; L974-L1010 HydrophobicContact CD2-CD1 4.21Å; L974-L1010 HydrophobicContact CG-CD1 4.25Å; A976-L1010 HydrophobicContact CB-CD1 3.76Å; A976-L1010 HydrophobicContact CB-CG 3.98Å; M1007-L1010 HydrophobicContact CG-CD2 3.92Å; M1007-L1010 HydrophobicContact CG-CG 4.49Å; M1007-L1010 HydrophobicContact SD-CD2 4.28Å; L1010-V1018 HydrophobicContact CB-CG1 4.09Å; L1010-V1018 HydrophobicContact CD2-CG1 4.05Å; L1010-L1019 CarbonylContact C-O 3.57Å; L1010-L1019 WeakPolarHBondContact CA-O 3Å; L1010-F1030 HydrophobicContact CD2-CD2 4.31Å; L1010-F1030 HydrophobicContact CD2-CE2 4.19Å
1011	R	92.2	Very high	89.5	Confident	74 Å²	74	35 Å²	35	28%	0.279	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	120.9	177	-70.2	-65.3	-177.9	165.2	-3.4	110.8	L1013 V1018 L1019 I1054 F1102	R1011-L1013 PolarHBondContact O-N 3.22Å; R1011-V1018 CarbonylContact O-C 3.56Å; R1011-V1018 WeakPolarHBondContact O-CA 3.27Å; R1011-V1018 WeakPolarHBondContact O-CG1 3.38Å; R1011-L1019 HydrophobicContact CB-CB 4.38Å; R1011-L1019 PolarHBondContact N-O 2.77Å; R1011-L1019 PolarHBondContact O-N 3.06Å; R1011-I1054 HydrophobicContact CB-CD1 4.4Å; R1011-I1054 HydrophobicContact CG-CD1 3.98Å; R1011-I1054 HydrophobicContact CG-CG1 3.73Å; R1011-F1102 PolarHBondContact NH1-O 2.96Å; R1011-F1102 PolarHBondContact NH2-O 3.35Å
1012	K	91.1	Very high	89.3	Confident	88 Å²	88	34 Å²	34	38%	0.383	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	124.9	173.5	-170.6	-178.5	-170.6	175.7	0	109.7	V967 E968 S1014	V967-K1012 HydrophobicContact CG2-CB 3.72Å; E968-K1012 WeakPolarHBondContact O-CD 3.38Å; E968-K1012 IonicContact OE1-NZ 2.74Å; E968-K1012 IonicContact OE2-NZ 3.71Å; E968-K1012 PolarHBondContact OE2-NZ 2.85Å; K1012-S1014 WeakPolarHBondContact CG-O 3.24Å
1013	L	88.5	Confident	88.9	Confident	34 Å²	34	33.3 Å²	33.3	18%	0.178	19%	0.186	C	C	.	.			trans	-100.4	-43.2	174.5	-61.1	175.4	0	0	0	110.7	R1011 S1017 L1019 L1029 A1056 F1062	R1011-L1013 PolarHBondContact O-N 3.22Å; L1013-S1017 PolarHBondContact N-O 3.45Å; L1013-S1017 VanDerWaalsContact N-O 3.08Å; L1013-L1019 HydrophobicContact CD1-CB 3.98Å; L1013-L1019 HydrophobicContact CD2-CB 4.24Å; L1013-L1019 HydrophobicContact CG-CB 4.08Å; L1013-L1029 HydrophobicContact CD1-CD1 3.65Å; L1013-A1056 HydrophobicContact CD2-CB 3.33Å; L1013-F1062 HydrophobicContact CD1-CD1 4.35Å; L1013-F1062 HydrophobicContact CD1-CE1 3.43Å; L1013-F1062 VanDerWaalsContact CD1-CE1 3.43Å; L1013-F1062 HydrophobicContact CD1-CZ 3.76Å; L1013-F1062 HydrophobicContact CD2-CD1 4.35Å; L1013-F1062 HydrophobicContact CD2-CE1 4.02Å; L1013-F1062 HydrophobicContact CG-CE1 4.37Å
1014	S	87.8	Confident	88.7	Confident	32 Å²	32	36.1 Å²	36.1	22%	0.224	20%	0.2	C	C	.	.	S	Bend	trans	-144.4	175.8	-179.6	80.4	0	0	0	0	110.3	K1012 S1016 S1017	K1012-S1014 WeakPolarHBondContact CG-O 3.24Å; S1014-S1016 PolarHBondContact O-N 3.21Å; S1014-S1016 VanDerWaalsContact O-N 3.17Å; S1014-S1016 PolarHBondContact OG-N 3.23Å; S1014-S1016 PolarHBondContact OG-OG 2.99Å; S1014-S1017 WeakPolarHBondContact CB-OG 3.43Å; S1014-S1017 PolarHBondContact N-O 3.28Å; S1014-S1017 PolarHBondContact OG-N 2.76Å; S1014-S1017 PolarHBondContact OG-OG 2.99Å
1015	P	85.4	Confident	87.8	Confident	90 Å²	90	37.6 Å²	37.6	58%	0.584	20%	0.199	S	C	*	.	S	Bend	trans	-59.1	-20.5	172.3	-24.7	35.8	0	0	0	114.6	F969	F969-P1015 WeakPolarHBondContact CE2-O 3.49Å
1016	S	87.1	Confident	87.2	Confident	56 Å²	56	35.2 Å²	35.2	39%	0.392	19%	0.186	S	C	.	.	S	Bend	trans	-123.6	-1.1	-175.5	57.2	0	0	0	0	115	F969 S1014 Y1032	F969-S1016 VanDerWaalsContact CZ-C 3.41Å; F969-S1016 WeakPolarHBondContact CZ-O 3.43Å; S1014-S1016 PolarHBondContact O-N 3.21Å; S1014-S1016 VanDerWaalsContact O-N 3.17Å; S1014-S1016 PolarHBondContact OG-N 3.23Å; S1014-S1016 PolarHBondContact OG-OG 2.99Å; S1016-Y1032 PolarHBondContact O-N 2.94Å; S1016-Y1032 VanDerWaalsContact O-N 3.09Å
1017	S	91.8	Very high	87.2	Confident	20 Å²	20	34.7 Å²	34.7	14%	0.14	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141.8	175.7	62	0	0	0	0	114	L1013 S1014 F1030	L1013-S1017 PolarHBondContact N-O 3.45Å; L1013-S1017 VanDerWaalsContact N-O 3.08Å; S1014-S1017 WeakPolarHBondContact CB-OG 3.43Å; S1014-S1017 PolarHBondContact N-O 3.28Å; S1014-S1017 PolarHBondContact OG-N 2.76Å; S1014-S1017 PolarHBondContact OG-OG 2.99Å; S1017-F1030 CarbonylContact C-O 3.51Å; S1017-F1030 VanDerWaalsContact CA-O 3.23Å; S1017-F1030 WeakPolarHBondContact CA-O 3.49Å
1018	V	94.1	Very high	87.1	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	131.2	177.5	174.4	0	0	0	0	109	V967 F969 L974 L1010 R1011 F1030	V967-V1018 HydrophobicContact CG1-CG1 4.16Å; V967-V1018 HydrophobicContact CG1-CG2 4.19Å; F969-V1018 HydrophobicContact CB-CG2 4.44Å; F969-V1018 HydrophobicContact CD1-CG2 4.24Å; F969-V1018 HydrophobicContact CD2-CG2 3.53Å; F969-V1018 HydrophobicContact CE1-CG2 4.28Å; F969-V1018 HydrophobicContact CE2-CG2 3.65Å; F969-V1018 HydrophobicContact CG-CG2 3.85Å; F969-V1018 HydrophobicContact CZ-CG2 4.02Å; L974-V1018 HydrophobicContact CD2-CB 4.04Å; L974-V1018 HydrophobicContact CD2-CG1 3.92Å; L974-V1018 HydrophobicContact CD2-CG2 3.87Å; L1010-V1018 HydrophobicContact CB-CG1 4.09Å; L1010-V1018 HydrophobicContact CD2-CG1 4.05Å; R1011-V1018 CarbonylContact O-C 3.56Å; R1011-V1018 WeakPolarHBondContact O-CA 3.27Å; R1011-V1018 WeakPolarHBondContact O-CG1 3.38Å; V1018-F1030 HydrophobicContact CB-CB 4.3Å; V1018-F1030 PolarHBondContact N-O 3.32Å; V1018-F1030 WeakPolarHBondContact O-CB 3.46Å; V1018-F1030 PolarHBondContact O-N 3.35Å
1019	L	93.1	Very high	87.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	129.1	169.1	-172.4	66.7	0	0	0	109.4	L1010 R1011 L1013 L1027 I1044 I1054 F1062	L1010-L1019 CarbonylContact C-O 3.57Å; L1010-L1019 WeakPolarHBondContact CA-O 3Å; R1011-L1019 HydrophobicContact CB-CB 4.38Å; R1011-L1019 PolarHBondContact N-O 2.77Å; R1011-L1019 PolarHBondContact O-N 3.06Å; L1013-L1019 HydrophobicContact CD1-CB 3.98Å; L1013-L1019 HydrophobicContact CD2-CB 4.24Å; L1013-L1019 HydrophobicContact CG-CB 4.08Å; L1019-L1027 HydrophobicContact CD1-CB 4.17Å; L1019-L1027 HydrophobicContact CD1-CD2 4.21Å; L1019-L1027 HydrophobicContact CD2-CD2 4.15Å; L1019-L1027 HydrophobicContact CG-CD2 4.23Å; L1019-I1044 HydrophobicContact CD1-CD1 4.04Å; L1019-I1054 HydrophobicContact CD2-CB 4.43Å; L1019-I1054 HydrophobicContact CG-CD1 4.35Å; L1019-F1062 HydrophobicContact CD1-CD1 4.38Å; L1019-F1062 HydrophobicContact CD1-CD2 3.94Å; L1019-F1062 HydrophobicContact CD1-CE2 4.17Å; L1019-F1062 HydrophobicContact CD1-CG 4.05Å; L1019-F1062 HydrophobicContact CD2-CB 4.02Å; L1019-F1062 HydrophobicContact CD2-CD1 4.04Å; L1019-F1062 HydrophobicContact CD2-CG 4Å
1020	G	92.4	Very high	87.2	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	146.2	171	0	0	0	0	0	111.4	M1007 Q1009 L1027 V1028	M1007-G1020 VanDerWaalsContact SD-C 3.54Å; M1007-G1020 WeakPolarHBondContact SD-CA 3.45Å; Q1009-G1020 WeakPolarHBondContact O-CA 3.48Å; G1020-L1027 CarbonylContact O-C 3.59Å; G1020-L1027 WeakPolarHBondContact O-CA 3.34Å; G1020-V1028 PolarHBondContact N-O 2.77Å; G1020-V1028 PolarHBondContact O-N 3.46Å
1021	G	90.7	Very high	87	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	113.6	171.2	0	0	0	0	0	109.6	M1007 I1008 Q1009	M1007-G1021 PolarHBondContact SD-N 3.26Å; M1007-G1021 VanDerWaalsContact SD-O 3.36Å; I1008-G1021 WeakPolarHBondContact CG1-O 3.2Å; I1008-G1021 PolarHBondContact N-O 3.23Å; Q1009-G1021 PolarHBondContact O-N 3.24Å
1022	D	87.4	Confident	87.1	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	151.3	169.1	-178.4	-16.5	0	0	0	109.1	S1004 V1005 A1006 M1007 I1024 E1025 L1051	S1004-D1022 PolarHBondContact N-OD2 3Å; S1004-D1022 VanDerWaalsContact N-OD2 3.13Å; V1005-D1022 VanDerWaalsContact CB-OD1 3.29Å; V1005-D1022 WeakPolarHBondContact CB-OD1 3.05Å; V1005-D1022 PolarHBondContact N-OD2 3.25Å; A1006-D1022 PolarHBondContact N-OD1 2.78Å; A1006-D1022 VanDerWaalsContact O-CA 3.32Å; A1006-D1022 WeakPolarHBondContact O-CA 3.36Å; M1007-D1022 HydrophobicContact CE-CB 4Å; D1022-I1024 PolarHBondContact O-N 3.03Å; D1022-E1025 CarbonylContact C-O 3.52Å; D1022-E1025 WeakPolarHBondContact CA-O 3.48Å; D1022-E1025 WeakPolarHBondContact CB-O 3.4Å; D1022-L1051 WeakPolarHBondContact O-CB 3.47Å; D1022-L1051 WeakPolarHBondContact O-CD2 3.1Å
1023	F	82.2	Confident	87.1	Confident	78 Å²	78	30.5 Å²	30.5	34%	0.342	17%	0.166	S	C	.	.	S	Bend	trans	-65.9	-35.2	-167.8	-173.2	-135.1	0	0	0	113.7	A1006 I1008 W1050 L1051	A1006-F1023 HydrophobicContact CB-CB 4.38Å; A1006-F1023 PolarHBondContact O-N 3.39Å; I1008-F1023 HydrophobicContact CD1-CD2 4.29Å; I1008-F1023 HydrophobicContact CG2-CB 4.36Å; I1008-F1023 HydrophobicContact CG2-CD2 4.41Å; F1023-W1050 AromaticContact CD1-CE3 3.54Å; F1023-W1050 HydrophobicContact CD1-CE3 3.54Å; F1023-W1050 AromaticContact CD1-CZ3 3.51Å; F1023-W1050 HydrophobicContact CD1-CZ3 3.51Å; F1023-W1050 HydrophobicContact CD2-CE3 4.24Å; F1023-W1050 HydrophobicContact CE1-CD2 4.47Å; F1023-W1050 AromaticContact CE1-CE3 3.14Å; F1023-W1050 HydrophobicContact CE1-CE3 3.14Å; F1023-W1050 HydrophobicContact CE1-CH2 4.33Å; F1023-W1050 AromaticContact CE1-CZ3 3.06Å; F1023-W1050 HydrophobicContact CE1-CZ3 3.06Å; F1023-W1050 AromaticContact CE2-CE3 3.86Å; F1023-W1050 HydrophobicContact CE2-CE3 3.86Å; F1023-W1050 HydrophobicContact CG-CE3 4.1Å; F1023-W1050 HydrophobicContact CG-CZ3 4.46Å; F1023-W1050 HydrophobicContact CZ-CD2 4.35Å; F1023-W1050 AromaticContact CZ-CE3 3.29Å; F1023-W1050 HydrophobicContact CZ-CE3 3.29Å; F1023-W1050 AromaticContact CZ-CZ3 3.68Å; F1023-W1050 HydrophobicContact CZ-CZ3 3.68Å; F1023-W1050 WeakPolarHBondContact O-CA 3.46Å; F1023-L1051 PolarHBondContact O-N 3.24Å; F1023-L1051 VanDerWaalsContact O-N 3.11Å
1024	I	78.6	Confident	87	Confident	78 Å²	78	32.5 Å²	32.5	40%	0.4	18%	0.181	S	C	.	.	S	Bend	trans	-118.6	-50.5	-178.9	-57.9	-179.8	0	0	0	110.7	V1005 D1022 A1026 W1050	V1005-I1024 HydrophobicContact CG1-CD1 4.04Å; V1005-I1024 HydrophobicContact CG1-CG1 4.25Å; V1005-I1024 HydrophobicContact CG2-CB 4.12Å; V1005-I1024 HydrophobicContact CG2-CD1 4.14Å; V1005-I1024 HydrophobicContact CG2-CG1 4.33Å; D1022-I1024 PolarHBondContact O-N 3.03Å; I1024-A1026 PolarHBondContact O-N 3.07Å; I1024-W1050 HydrophobicContact CD1-CE3 4.35Å; I1024-W1050 HydrophobicContact CD1-CH2 3.86Å; I1024-W1050 HydrophobicContact CD1-CZ3 3.66Å; I1024-W1050 HydrophobicContact CG1-CE3 3.82Å; I1024-W1050 HydrophobicContact CG1-CH2 4.23Å; I1024-W1050 HydrophobicContact CG1-CZ3 3.63Å
1025	E	63.4	Low	87.1	Confident	96 Å²	96	35.9 Å²	35.9	45%	0.449	21%	0.211	S	C	.	.	S	Bend	trans	-81.3	119.6	173.9	-69.3	-170.8	-176.6	0	0	107.6	S1004 D1022	S1004-E1025 WeakPolarHBondContact CB-OE2 3.49Å; S1004-E1025 VanDerWaalsContact OG-CD 3.3Å; S1004-E1025 PolarHBondContact OG-OE2 2.65Å; D1022-E1025 CarbonylContact C-O 3.52Å; D1022-E1025 WeakPolarHBondContact CA-O 3.48Å; D1022-E1025 WeakPolarHBondContact CB-O 3.4Å
1026	A	73.3	Confident	87.2	Confident	9 Å²	9	37.3 Å²	37.3	7%	0.074	21%	0.209	C	C	.	.			trans	-77.9	178.8	-170	0	0	0	0	0	112.7	I1024 Y1046 T1048	I1024-A1026 PolarHBondContact O-N 3.07Å; A1026-Y1046 HydrophobicContact CB-CD1 3.21Å; A1026-Y1046 HydrophobicContact CB-CE1 4.05Å; A1026-Y1046 HydrophobicContact CB-CG 3.95Å; A1026-T1048 WeakPolarHBondContact CB-OG1 3.41Å
1027	L	86.6	Confident	87.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.209	C	C	.	.			trans	-13	128	-166.6	-56.8	177.5	0	0	0	118.6	L1019 G1020 I1044 Y1046 I1054 F1062	L1019-L1027 HydrophobicContact CD1-CB 4.17Å; L1019-L1027 HydrophobicContact CD1-CD2 4.21Å; L1019-L1027 HydrophobicContact CD2-CD2 4.15Å; L1019-L1027 HydrophobicContact CG-CD2 4.23Å; G1020-L1027 CarbonylContact O-C 3.59Å; G1020-L1027 WeakPolarHBondContact O-CA 3.34Å; L1027-I1044 HydrophobicContact CB-CB 4.15Å; L1027-I1044 HydrophobicContact CB-CD1 4.02Å; L1027-I1044 WeakPolarHBondContact O-CB 3.28Å; L1027-I1044 PolarHBondContact O-N 3.27Å; L1027-Y1046 HydrophobicContact CD1-CD2 4.36Å; L1027-Y1046 HydrophobicContact CD1-CE1 4.25Å; L1027-Y1046 HydrophobicContact CD1-CE2 4.06Å; L1027-Y1046 HydrophobicContact CG-CE1 4.3Å; L1027-I1054 HydrophobicContact CD2-CB 4.2Å; L1027-I1054 HydrophobicContact CD2-CG2 3.53Å; L1027-F1062 HydrophobicContact CD1-CB 3.81Å
1028	V	88.8	Confident	87.4	Confident	6 Å²	6	38.8 Å²	38.8	4%	0.036	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.4	173.6	-177.5	0	0	0	0	109.8	M1007 G1020 F1030	M1007-V1028 HydrophobicContact CE-CB 4.35Å; M1007-V1028 HydrophobicContact CE-CG2 4.25Å; G1020-V1028 PolarHBondContact N-O 2.77Å; G1020-V1028 PolarHBondContact O-N 3.46Å; V1028-F1030 HydrophobicContact CB-CE2 4.23Å; V1028-F1030 HydrophobicContact CB-CZ 4.26Å; V1028-F1030 HydrophobicContact CG1-CE1 4Å; V1028-F1030 HydrophobicContact CG1-CE2 4.06Å; V1028-F1030 HydrophobicContact CG1-CZ 3.74Å
1029	L	90.1	Very high	87.3	Confident	18 Å²	18	39.4 Å²	39.4	9%	0.094	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	113.2	174.5	-175.2	63.1	0	0	0	110.6	L1013 I1031 H1042 I1044 F1062 F1086	L1013-L1029 HydrophobicContact CD1-CD1 3.65Å; L1029-I1031 HydrophobicContact CD2-CD1 4.31Å; L1029-I1031 HydrophobicContact CD2-CG1 4.45Å; L1029-I1031 HydrophobicContact CG-CG1 4.24Å; L1029-H1042 PolarHBondContact N-O 3.01Å; L1029-H1042 PolarHBondContact O-N 2.81Å; L1029-I1044 HydrophobicContact CB-CD1 4.14Å; L1029-I1044 HydrophobicContact CB-CG1 4.42Å; L1029-F1062 HydrophobicContact CD1-CZ 4.37Å; L1029-F1086 HydrophobicContact CD2-CE2 4.11Å; L1029-F1086 HydrophobicContact CD2-CZ 4.24Å
1030	F	91.8	Very high	87.2	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	124.6	174.1	-66	-71.9	0	0	0	111.2	V981 C1001 M1007 L1010 S1017 V1018 V1028 L1039 E1040	V981-F1030 HydrophobicContact CB-CE1 4.38Å; V981-F1030 HydrophobicContact CB-CZ 4.25Å; V981-F1030 HydrophobicContact CG2-CE1 4.14Å; V981-F1030 HydrophobicContact CG2-CE2 3.94Å; V981-F1030 HydrophobicContact CG2-CZ 3.55Å; C1001-F1030 HydrophobicContact CB-CD1 4.33Å; C1001-F1030 HydrophobicContact CB-CE1 3.94Å; M1007-F1030 HydrophobicContact CE-CE2 3.79Å; M1007-F1030 HydrophobicContact CE-CZ 3.7Å; M1007-F1030 HydrophobicContact SD-CE2 4.06Å; L1010-F1030 HydrophobicContact CD2-CD2 4.31Å; L1010-F1030 HydrophobicContact CD2-CE2 4.19Å; S1017-F1030 CarbonylContact C-O 3.51Å; S1017-F1030 VanDerWaalsContact CA-O 3.23Å; S1017-F1030 WeakPolarHBondContact CA-O 3.49Å; V1018-F1030 HydrophobicContact CB-CB 4.3Å; V1018-F1030 PolarHBondContact N-O 3.32Å; V1018-F1030 WeakPolarHBondContact O-CB 3.46Å; V1018-F1030 PolarHBondContact O-N 3.35Å; V1028-F1030 HydrophobicContact CB-CE2 4.23Å; V1028-F1030 HydrophobicContact CB-CZ 4.26Å; V1028-F1030 HydrophobicContact CG1-CE1 4Å; V1028-F1030 HydrophobicContact CG1-CE2 4.06Å; V1028-F1030 HydrophobicContact CG1-CZ 3.74Å; F1030-L1039 HydrophobicContact CB-CD1 4.14Å; F1030-L1039 HydrophobicContact CD1-CD2 4.22Å; F1030-L1039 HydrophobicContact CD1-CG 4.21Å; F1030-E1040 CarbonylContact C-O 3.5Å; F1030-E1040 VanDerWaalsContact CA-O 3.28Å; F1030-E1040 WeakPolarHBondContact CA-O 3.36Å
1031	I	91.6	Very high	87	Confident	40 Å²	40	43.7 Å²	43.7	21%	0.205	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.7	175.7	-56.8	178.8	0	0	0	108.4	L1029 E1040	L1029-I1031 HydrophobicContact CD2-CD1 4.31Å; L1029-I1031 HydrophobicContact CD2-CG1 4.45Å; L1029-I1031 HydrophobicContact CG-CG1 4.24Å; I1031-E1040 PolarHBondContact N-O 2.94Å; I1031-E1040 PolarHBondContact O-N 2.88Å
1032	Y	92.7	Very high	86.7	Confident	7 Å²	7	45.5 Å²	45.5	3%	0.027	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.4	175.6	174.7	-114.2	0	0	0	110.8	F969 N970 K972 L983 E998 S1016 P1034 T1038	F969-Y1032 HydrophobicContact CE1-CG 4.11Å; F969-Y1032 VanDerWaalsContact CZ-CB 3.47Å; N970-Y1032 HydrophobicContact CB-CD1 4.38Å; N970-Y1032 WeakPolarHBondContact ND2-CE1 3.5Å; K972-Y1032 PolarHBondContact NZ-OH 2.91Å; L983-Y1032 HydrophobicContact CD2-CD2 3.57Å; L983-Y1032 HydrophobicContact CD2-CE2 3.38Å; L983-Y1032 HydrophobicContact CD2-CG 4.25Å; E998-Y1032 PolarHBondContact OE1-OH 3.42Å; S1016-Y1032 PolarHBondContact O-N 2.94Å; S1016-Y1032 VanDerWaalsContact O-N 3.09Å; Y1032-P1034 HydrophobicContact CD1-CB 4.41Å; Y1032-P1034 HydrophobicContact CD1-CG 3.84Å; Y1032-P1034 HydrophobicContact CE1-CB 3.78Å; Y1032-P1034 HydrophobicContact CE1-CG 3.7Å; Y1032-P1034 WeakPolarHBondContact O-CD 3.37Å; Y1032-T1038 WeakPolarHBondContact CD2-O 3.39Å
1033	K	91.6	Very high	86.4	Confident	75 Å²	75	49 Å²	49	33%	0.326	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	98.5	175.6	-68.3	-178.9	179.9	170.2	0	109.2	A1035 E1036 S1037 T1038 E1040	K1033-A1035 VanDerWaalsContact C-N 3.28Å; K1033-A1035 PolarHBondContact O-N 3.36Å; K1033-E1036 HydrophobicContact CB-CB 4.27Å; K1033-E1036 PolarHBondContact O-N 3.15Å; K1033-E1036 VanDerWaalsContact O-N 3.14Å; K1033-S1037 PolarHBondContact O-N 2.93Å; K1033-T1038 PolarHBondContact N-O 3.18Å; K1033-E1040 VanDerWaalsContact CE-CD 3.47Å; K1033-E1040 WeakPolarHBondContact CE-OE1 3.46Å; K1033-E1040 WeakPolarHBondContact CE-OE2 3.49Å; K1033-E1040 IonicContact NZ-OE1 2.85Å; K1033-E1040 PolarHBondContact NZ-OE1 2.85Å; K1033-E1040 IonicContact NZ-OE2 2.67Å; K1033-E1040 PolarHBondContact NZ-OE2 2.96Å
1034	P	87.3	Confident	86.2	Confident	76 Å²	76	45.6 Å²	45.6	49%	0.494	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-33.2	-172.6	-21.2	32.4	0	0	0	113.7	Y1032 E1036 S1037	Y1032-P1034 HydrophobicContact CD1-CB 4.41Å; Y1032-P1034 HydrophobicContact CD1-CG 3.84Å; Y1032-P1034 HydrophobicContact CE1-CB 3.78Å; Y1032-P1034 HydrophobicContact CE1-CG 3.7Å; Y1032-P1034 WeakPolarHBondContact O-CD 3.37Å; P1034-E1036 VanDerWaalsContact C-N 3.29Å; P1034-E1036 PolarHBondContact O-N 2.82Å; P1034-S1037 PolarHBondContact O-N 2.89Å
1035	A	88.5	Confident	85.5	Confident	103 Å²	103	45.7 Å²	45.7	85%	0.851	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-32.1	179.6	0	0	0	0	0	112.8	K1033	K1033-A1035 VanDerWaalsContact C-N 3.28Å; K1033-A1035 PolarHBondContact O-N 3.36Å
1036	E	89.1	Confident	85.6	Confident	119 Å²	119	42 Å²	42	56%	0.556	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-14	-177.7	-65.5	177.9	-169.9	0	0	112.4	K1033 P1034 T1038	K1033-E1036 HydrophobicContact CB-CB 4.27Å; K1033-E1036 PolarHBondContact O-N 3.15Å; K1033-E1036 VanDerWaalsContact O-N 3.14Å; P1034-E1036 VanDerWaalsContact C-N 3.29Å; P1034-E1036 PolarHBondContact O-N 2.82Å; E1036-T1038 HydrophobicContact CB-CG2 4.06Å; E1036-T1038 VanDerWaalsContact CB-OG1 3.27Å; E1036-T1038 WeakPolarHBondContact CB-OG1 3.38Å; E1036-T1038 PolarHBondContact O-N 3.02Å; E1036-T1038 PolarHBondContact OE2-OG1 3.11Å
1037	S	89.6	Confident	85.2	Confident	56 Å²	56	48.3 Å²	48.3	39%	0.392	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	34.6	-171.2	-52.1	0	0	0	0	112.1	C999 K1033 P1034	C999-S1037 WeakPolarHBondContact CB-O 3.4Å; K1033-S1037 PolarHBondContact O-N 2.93Å; P1034-S1037 PolarHBondContact O-N 2.89Å
1038	T	91.8	Very high	84	Confident	51 Å²	51	49.3 Å²	49.3	31%	0.313	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145.4	-179.7	50.6	0	0	0	0	110.4	Y1032 K1033 E1036	Y1032-T1038 WeakPolarHBondContact CD2-O 3.39Å; K1033-T1038 PolarHBondContact N-O 3.18Å; E1036-T1038 HydrophobicContact CB-CG2 4.06Å; E1036-T1038 VanDerWaalsContact CB-OG1 3.27Å; E1036-T1038 WeakPolarHBondContact CB-OG1 3.38Å; E1036-T1038 PolarHBondContact O-N 3.02Å; E1036-T1038 PolarHBondContact OE2-OG1 3.11Å
1039	L	92.7	Very high	83.1	Confident	13 Å²	13	51.3 Å²	51.3	7%	0.068	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	111.7	172.9	-175.6	71.2	0	0	0	107.4	F969 L974 V981 C1001 F1030	F969-L1039 HydrophobicContact CE1-CD1 4.03Å; L974-L1039 HydrophobicContact CD1-CD2 3.73Å; V981-L1039 HydrophobicContact CB-CD2 4.48Å; V981-L1039 HydrophobicContact CG1-CD2 4.05Å; C1001-L1039 HydrophobicContact CB-CB 4.48Å; C1001-L1039 HydrophobicContact CB-CD2 3.9Å; C1001-L1039 HydrophobicContact CB-CG 4.2Å; F1030-L1039 HydrophobicContact CB-CD1 4.14Å; F1030-L1039 HydrophobicContact CD1-CD2 4.22Å; F1030-L1039 HydrophobicContact CD1-CG 4.21Å
1040	E	90.6	Very high	82.7	Confident	58 Å²	58	54.6 Å²	54.6	27%	0.271	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	132.3	177.7	-67.2	178.2	-178.7	0	0	108.9	F1030 I1031 K1033 H1042	F1030-E1040 CarbonylContact C-O 3.5Å; F1030-E1040 VanDerWaalsContact CA-O 3.28Å; F1030-E1040 WeakPolarHBondContact CA-O 3.36Å; I1031-E1040 PolarHBondContact N-O 2.94Å; I1031-E1040 PolarHBondContact O-N 2.88Å; K1033-E1040 VanDerWaalsContact CE-CD 3.47Å; K1033-E1040 WeakPolarHBondContact CE-OE1 3.46Å; K1033-E1040 WeakPolarHBondContact CE-OE2 3.49Å; K1033-E1040 IonicContact NZ-OE1 2.85Å; K1033-E1040 PolarHBondContact NZ-OE1 2.85Å; K1033-E1040 IonicContact NZ-OE2 2.67Å; K1033-E1040 PolarHBondContact NZ-OE2 2.96Å; E1040-H1042 IonicContact OE2-NE2 3.56Å
1041	G	87.8	Confident	82.5	Confident	32 Å²	32	54.8 Å²	54.8	33%	0.33	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.8	171.6	0	0	0	0	0	108.5
1042	H	85.8	Confident	82.4	Confident	38 Å²	38	53.4 Å²	53.4	18%	0.176	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120.1	176.3	-62	-89.3	0	0	0	109.3	L1029 E1040 F1086	L1029-H1042 PolarHBondContact N-O 3.01Å; L1029-H1042 PolarHBondContact O-N 2.81Å; E1040-H1042 IonicContact OE2-NE2 3.56Å; H1042-F1086 HydrophobicContact CB-CD2 4.09Å; H1042-F1086 HydrophobicContact CB-CE2 3.51Å; H1042-F1086 AromaticContact CG-CE2 3.89Å
1043	D	80.1	Confident	82.3	Confident	76 Å²	76	53.1 Å²	53.1	41%	0.406	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	132.7	178.6	-56.6	-30.9	0	0	0	109.8
1044	I	77.7	Confident	82.3	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.031	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-95.5	117	174.1	-59.9	175.8	0	0	0	105.6	L1019 L1027 L1029 Y1046 F1062 V1076 V1088	L1019-I1044 HydrophobicContact CD1-CD1 4.04Å; L1027-I1044 HydrophobicContact CB-CB 4.15Å; L1027-I1044 HydrophobicContact CB-CD1 4.02Å; L1027-I1044 WeakPolarHBondContact O-CB 3.28Å; L1027-I1044 PolarHBondContact O-N 3.27Å; L1029-I1044 HydrophobicContact CB-CD1 4.14Å; L1029-I1044 HydrophobicContact CB-CG1 4.42Å; I1044-Y1046 VanDerWaalsContact O-CB 3.27Å; I1044-Y1046 WeakPolarHBondContact O-CB 3.28Å; I1044-Y1046 PolarHBondContact O-N 2.83Å; I1044-F1062 HydrophobicContact CD1-CD2 3.57Å; I1044-F1062 HydrophobicContact CD1-CE2 3.45Å; I1044-F1062 VanDerWaalsContact CD1-CE2 3.45Å; I1044-V1076 HydrophobicContact CD1-CG2 4.49Å; I1044-V1076 HydrophobicContact CG2-CG2 4.5Å; I1044-V1088 HydrophobicContact CG2-CB 4.4Å; I1044-V1088 HydrophobicContact CG2-CG1 4.31Å; I1044-V1088 HydrophobicContact CG2-CG2 3.33Å
1045	D	64.2	Low	82.4	Confident	80 Å²	80	46.1 Å²	46.1	43%	0.428	26%	0.257	S	S	.	.			trans	-63	110	-178.1	-155.6	37.3	0	0	0	109.2	K1085	D1045-K1085 HydrophobicContact CB-CD 4.19Å; D1045-K1085 IonicContact OD1-NZ 3.29Å; D1045-K1085 PolarHBondContact OD1-NZ 2.6Å
1046	Y	65.1	Low	82.4	Confident	19 Å²	19	42.7 Å²	42.7	8%	0.075	23%	0.229	C	C	.	.			trans	-152	127.6	-164.4	-161.4	-97	0	0	0	110.8	A1026 L1027 I1044 T1048 S1064 Y1072 A1074 Y1090	A1026-Y1046 HydrophobicContact CB-CD1 3.21Å; A1026-Y1046 HydrophobicContact CB-CE1 4.05Å; A1026-Y1046 HydrophobicContact CB-CG 3.95Å; L1027-Y1046 HydrophobicContact CD1-CD2 4.36Å; L1027-Y1046 HydrophobicContact CD1-CE1 4.25Å; L1027-Y1046 HydrophobicContact CD1-CE2 4.06Å; L1027-Y1046 HydrophobicContact CG-CE1 4.3Å; I1044-Y1046 VanDerWaalsContact O-CB 3.27Å; I1044-Y1046 WeakPolarHBondContact O-CB 3.28Å; I1044-Y1046 PolarHBondContact O-N 2.83Å; Y1046-T1048 HydrophobicContact CD1-CG2 3.42Å; Y1046-T1048 VanDerWaalsContact CD1-CG2 3.42Å; Y1046-T1048 HydrophobicContact CE1-CG2 3.08Å; Y1046-S1064 WeakPolarHBondContact CE1-OG 3.39Å; Y1046-S1064 WeakPolarHBondContact OH-CB 3.44Å; Y1046-S1064 PolarHBondContact OH-OG 3.14Å; Y1046-Y1072 WeakPolarHBondContact OH-CB 3.45Å; Y1046-Y1072 PolarHBondContact OH-O 3.38Å; Y1046-A1074 HydrophobicContact CD2-CB 3.98Å; Y1046-A1074 HydrophobicContact CE2-CB 3.56Å; Y1046-Y1090 AromaticContact CD2-CD2 3.95Å; Y1046-Y1090 HydrophobicContact CD2-CD2 3.95Å; Y1046-Y1090 HydrophobicContact CD2-CE2 4.23Å; Y1046-Y1090 HydrophobicContact CE1-CE2 4.36Å; Y1046-Y1090 AromaticContact CE2-CD2 3.51Å; Y1046-Y1090 HydrophobicContact CE2-CD2 3.51Å; Y1046-Y1090 AromaticContact CE2-CE2 3.72Å; Y1046-Y1090 HydrophobicContact CE2-CE2 3.72Å; Y1046-Y1090 AromaticContact CZ-CE2 3.86Å
1047	H	65.1	Low	82.2	Confident	141 Å²	141	37.1 Å²	37.1	65%	0.653	20%	0.203	S	C	*	.			trans	-105.1	81.6	-173.9	-67.7	-55.7	0	0	0	110	Y1090	H1047-Y1090 PolarHBondContact O-OH 2.91Å
1048	T	62.9	Low	81.7	Confident	20 Å²	20	35.5 Å²	35.5	12%	0.123	19%	0.191	C	C	.	.			trans	-120	154.7	169	58	0	0	0	0	111.4	A1026 Y1046 Y1072 Y1090	A1026-T1048 WeakPolarHBondContact CB-OG1 3.41Å; Y1046-T1048 HydrophobicContact CD1-CG2 3.42Å; Y1046-T1048 VanDerWaalsContact CD1-CG2 3.42Å; Y1046-T1048 HydrophobicContact CE1-CG2 3.08Å; T1048-Y1072 HydrophobicContact CG2-CD2 3.16Å; T1048-Y1072 HydrophobicContact CG2-CE2 3.26Å; T1048-Y1072 HydrophobicContact CG2-CG 3.86Å; T1048-Y1090 HydrophobicContact CG2-CE2 4.45Å
1049	D	68.7	Low	81.2	Confident	48 Å²	48	37 Å²	37	26%	0.257	20%	0.202	S	C	.	.	S	Bend	trans	-62.8	-168.6	159.5	-100.7	-31.8	0	0	0	111.1	L1051 D1066 V1067 L1172	D1049-L1051 PolarHBondContact O-N 3.09Å; D1049-D1066 HydrophobicContact CB-CB 4.06Å; D1049-V1067 HydrophobicContact CB-CG2 4.29Å; D1049-L1172 WeakPolarHBondContact OD1-CD1 3.27Å; D1049-L1172 WeakPolarHBondContact OD2-CD1 3.33Å
1050	W	82.9	Confident	80.8	Confident	88 Å²	88	39.5 Å²	39.5	33%	0.333	22%	0.216	S	C	.	.	S	Bend	trans	-49.1	119.4	173.9	-49.5	78.8	0	0	0	112.2	F1023 I1024 D1066 V1067	F1023-W1050 AromaticContact CD1-CE3 3.54Å; F1023-W1050 HydrophobicContact CD1-CE3 3.54Å; F1023-W1050 AromaticContact CD1-CZ3 3.51Å; F1023-W1050 HydrophobicContact CD1-CZ3 3.51Å; F1023-W1050 HydrophobicContact CD2-CE3 4.24Å; F1023-W1050 HydrophobicContact CE1-CD2 4.47Å; F1023-W1050 AromaticContact CE1-CE3 3.14Å; F1023-W1050 HydrophobicContact CE1-CE3 3.14Å; F1023-W1050 HydrophobicContact CE1-CH2 4.33Å; F1023-W1050 AromaticContact CE1-CZ3 3.06Å; F1023-W1050 HydrophobicContact CE1-CZ3 3.06Å; F1023-W1050 AromaticContact CE2-CE3 3.86Å; F1023-W1050 HydrophobicContact CE2-CE3 3.86Å; F1023-W1050 HydrophobicContact CG-CE3 4.1Å; F1023-W1050 HydrophobicContact CG-CZ3 4.46Å; F1023-W1050 HydrophobicContact CZ-CD2 4.35Å; F1023-W1050 AromaticContact CZ-CE3 3.29Å; F1023-W1050 HydrophobicContact CZ-CE3 3.29Å; F1023-W1050 AromaticContact CZ-CZ3 3.68Å; F1023-W1050 HydrophobicContact CZ-CZ3 3.68Å; F1023-W1050 WeakPolarHBondContact O-CA 3.46Å; I1024-W1050 HydrophobicContact CD1-CE3 4.35Å; I1024-W1050 HydrophobicContact CD1-CH2 3.86Å; I1024-W1050 HydrophobicContact CD1-CZ3 3.66Å; I1024-W1050 HydrophobicContact CG1-CE3 3.82Å; I1024-W1050 HydrophobicContact CG1-CH2 4.23Å; I1024-W1050 HydrophobicContact CG1-CZ3 3.63Å; W1050-D1066 CarbonylContact O-C 3.54Å; W1050-D1066 VanDerWaalsContact O-CA 3.28Å; W1050-D1066 WeakPolarHBondContact O-CA 3.36Å; W1050-V1067 HydrophobicContact CB-CB 4.38Å; W1050-V1067 HydrophobicContact CB-CG1 3.75Å; W1050-V1067 HydrophobicContact CB-CG2 3.73Å; W1050-V1067 HydrophobicContact CG-CG2 4.13Å; W1050-V1067 PolarHBondContact O-N 3.47Å
1051	L	87.4	Confident	80.6	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	135.4	-173.8	-174.2	76.1	0	0	0	111.8	I1008 D1022 F1023 D1049 I1054 A1065	I1008-L1051 HydrophobicContact CD1-CB 4.05Å; I1008-L1051 HydrophobicContact CD1-CD2 4.03Å; I1008-L1051 HydrophobicContact CD1-CG 4.18Å; I1008-L1051 VanDerWaalsContact CD1-O 3.24Å; I1008-L1051 WeakPolarHBondContact CD1-O 3.34Å; I1008-L1051 HydrophobicContact CG1-CD2 4.34Å; D1022-L1051 WeakPolarHBondContact O-CB 3.47Å; D1022-L1051 WeakPolarHBondContact O-CD2 3.1Å; F1023-L1051 PolarHBondContact O-N 3.24Å; F1023-L1051 VanDerWaalsContact O-N 3.11Å; D1049-L1051 PolarHBondContact O-N 3.09Å; L1051-I1054 HydrophobicContact CD1-CG2 3.99Å; L1051-I1054 HydrophobicContact CD2-CG2 3.51Å; L1051-I1054 HydrophobicContact CG-CG2 4.13Å; L1051-A1065 WeakPolarHBondContact CD1-O 3.05Å
1052	T	89.1	Confident	80.6	Confident	11 Å²	11	35.3 Å²	35.3	7%	0.067	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-35.2	-179	57.9	0	0	0	0	112.7	Q1009 A1065 D1066 V1067 Y1098 V1099	Q1009-T1052 PolarHBondContact NE2-O 2.86Å; Q1009-T1052 VanDerWaalsContact NE2-O 3.09Å; T1052-A1065 PolarHBondContact N-O 3.46Å; T1052-A1065 WeakPolarHBondContact OG1-CB 2.91Å; T1052-A1065 PolarHBondContact OG1-O 2.96Å; T1052-D1066 WeakPolarHBondContact CG2-O 3.16Å; T1052-D1066 PolarHBondContact OG1-N 3.22Å; T1052-D1066 PolarHBondContact OG1-O 3.41Å; T1052-V1067 HydrophobicContact CG2-CB 4.33Å; T1052-V1067 HydrophobicContact CG2-CG1 3.58Å; T1052-Y1098 HydrophobicContact CG2-CE1 3.78Å; T1052-Y1098 HydrophobicContact CG2-CE2 3.77Å; T1052-Y1098 VanDerWaalsContact CG2-OH 3.24Å; T1052-Y1098 WeakPolarHBondContact CG2-OH 3.33Å; T1052-V1099 WeakPolarHBondContact CB-O 3.48Å; T1052-V1099 PolarHBondContact OG1-O 3.21Å; T1052-V1099 VanDerWaalsContact OG1-O 3.08Å
1053	G	89.8	Confident	80.8	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	152.6	177.7	0	0	0	0	0	113.5	S1064 A1065	G1053-S1064 CarbonylContact O-C 3.59Å; G1053-S1064 WeakPolarHBondContact O-CA 3.33Å; G1053-A1065 PolarHBondContact O-N 3.24Å
1054	I	92.2	Very high	81.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	146.2	173.4	66.5	177.1	0	0	0	112.2	Q1009 R1011 L1019 L1027 L1051 L1063 F1102	Q1009-I1054 HydrophobicContact CB-CD1 3.74Å; Q1009-I1054 HydrophobicContact CB-CG1 3.75Å; Q1009-I1054 VanDerWaalsContact OE1-N 3.11Å; R1011-I1054 HydrophobicContact CB-CD1 4.4Å; R1011-I1054 HydrophobicContact CG-CD1 3.98Å; R1011-I1054 HydrophobicContact CG-CG1 3.73Å; L1019-I1054 HydrophobicContact CD2-CB 4.43Å; L1019-I1054 HydrophobicContact CG-CD1 4.35Å; L1027-I1054 HydrophobicContact CD2-CB 4.2Å; L1027-I1054 HydrophobicContact CD2-CG2 3.53Å; L1051-I1054 HydrophobicContact CD1-CG2 3.99Å; L1051-I1054 HydrophobicContact CD2-CG2 3.51Å; L1051-I1054 HydrophobicContact CG-CG2 4.13Å; I1054-L1063 WeakPolarHBondContact CA-O 3.44Å; I1054-F1102 WeakPolarHBondContact O-CD2 3.45Å
1055	G	90.2	Very high	81.8	Confident	4 Å²	4	29.7 Å²	29.7	4%	0.041	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	177.2	176.4	0	0	0	0	0	111.8	L1063	G1055-L1063 PolarHBondContact N-O 2.92Å; G1055-L1063 PolarHBondContact O-N 3.04Å
1056	A	87.9	Confident	82.9	Confident	31 Å²	31	25.9 Å²	25.9	26%	0.256	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	138.7	172.4	0	0	0	0	0	109.1	L1013 V1061 F1062	L1013-A1056 HydrophobicContact CD2-CB 3.33Å; A1056-V1061 WeakPolarHBondContact CA-O 3.4Å; A1056-F1062 HydrophobicContact CB-CD1 4.1Å
1057	V	84	Confident	83.8	Confident	3 Å²	3	26.9 Å²	26.9	2%	0.018	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-30.4	174.1	-168.2	0	0	0	0	110.3	V1061 L1063 S1119 A1121 V1133 L1135	V1057-V1061 PolarHBondContact N-O 3.29Å; V1057-L1063 HydrophobicContact CG2-CD1 3.54Å; V1057-L1063 HydrophobicContact CG2-CD2 3.99Å; V1057-L1063 HydrophobicContact CG2-CG 3.79Å; V1057-S1119 WeakPolarHBondContact CG1-O 3.42Å; V1057-S1119 WeakPolarHBondContact O-CB 3.28Å; V1057-A1121 HydrophobicContact CG2-CB 4.01Å; V1057-V1133 HydrophobicContact CG2-CG1 4.15Å; V1057-L1135 HydrophobicContact CB-CD1 4Å; V1057-L1135 HydrophobicContact CB-CG 4.17Å; V1057-L1135 HydrophobicContact CG1-CD1 3.74Å; V1057-L1135 HydrophobicContact CG1-CG 3.7Å
1058	S	80	Confident	84.7	Confident	21 Å²	21	21.4 Å²	21.4	15%	0.147	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	167.6	171.3	79.4	0	0	0	0	109.7	N1060 V1061	S1058-N1060 PolarHBondContact O-N 2.74Å; S1058-V1061 PolarHBondContact N-O 2.84Å; S1058-V1061 PolarHBondContact O-N 2.94Å; S1058-V1061 VanDerWaalsContact O-N 3.09Å; S1058-V1061 WeakPolarHBondContact OG-CB 2.69Å; S1058-V1061 VanDerWaalsContact OG-CG2 3.3Å; S1058-V1061 WeakPolarHBondContact OG-CG2 2.8Å; S1058-V1061 PolarHBondContact OG-N 2.95Å
1059	P	80.5	Confident	85.8	Confident	84 Å²	84	23.1 Å²	23.1	55%	0.545	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-17.8	-179.7	-27.3	36.2	0	0	0	115.4	F1062	P1059-F1062 WeakPolarHBondContact O-CE1 3.39Å; P1059-F1062 WeakPolarHBondContact O-CZ 3.28Å
1060	N	83.6	Confident	86.7	Confident	64 Å²	64	21 Å²	21	34%	0.342	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-5.8	-179.2	-60.6	11.2	0	0	0	112.8	S1058 V1076	S1058-N1060 PolarHBondContact O-N 2.74Å; N1060-V1076 PolarHBondContact O-N 2.79Å
1061	V	86.5	Confident	86.9	Confident	1 Å²	1	16.8 Å²	16.8	1%	0.006	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	107.4	-178.8	-177.5	0	0	0	0	109.5	K155 A1056 V1057 S1058 I1073 A1074 D1075 L1135	K155-V1061 HydrophobicContact CD-CG2 4.37Å; A1056-V1061 WeakPolarHBondContact CA-O 3.4Å; V1057-V1061 PolarHBondContact N-O 3.29Å; S1058-V1061 PolarHBondContact N-O 2.84Å; S1058-V1061 PolarHBondContact O-N 2.94Å; S1058-V1061 VanDerWaalsContact O-N 3.09Å; S1058-V1061 WeakPolarHBondContact OG-CB 2.69Å; S1058-V1061 VanDerWaalsContact OG-CG2 3.3Å; S1058-V1061 WeakPolarHBondContact OG-CG2 2.8Å; S1058-V1061 PolarHBondContact OG-N 2.95Å; V1061-I1073 HydrophobicContact CG1-CG2 3.68Å; V1061-A1074 CarbonylContact C-O 3.49Å; V1061-A1074 VanDerWaalsContact CA-O 3.3Å; V1061-A1074 WeakPolarHBondContact CA-O 3.26Å; V1061-D1075 HydrophobicContact CG2-CB 4.38Å; V1061-L1135 HydrophobicContact CB-CD1 4.24Å; V1061-L1135 HydrophobicContact CG1-CD1 4.45Å; V1061-L1135 HydrophobicContact CG1-CD2 4.05Å; V1061-L1135 HydrophobicContact CG2-CD1 4.16Å
1062	F	88.9	Confident	86.8	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.009	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	144.5	-173.7	-51.3	-37.5	0	0	0	111.3	L1013 L1019 L1027 L1029 I1044 A1056 P1059 I1073 A1074 V1076	L1013-F1062 HydrophobicContact CD1-CD1 4.35Å; L1013-F1062 HydrophobicContact CD1-CE1 3.43Å; L1013-F1062 VanDerWaalsContact CD1-CE1 3.43Å; L1013-F1062 HydrophobicContact CD1-CZ 3.76Å; L1013-F1062 HydrophobicContact CD2-CD1 4.35Å; L1013-F1062 HydrophobicContact CD2-CE1 4.02Å; L1013-F1062 HydrophobicContact CG-CE1 4.37Å; L1019-F1062 HydrophobicContact CD1-CD1 4.38Å; L1019-F1062 HydrophobicContact CD1-CD2 3.94Å; L1019-F1062 HydrophobicContact CD1-CE2 4.17Å; L1019-F1062 HydrophobicContact CD1-CG 4.05Å; L1019-F1062 HydrophobicContact CD2-CB 4.02Å; L1019-F1062 HydrophobicContact CD2-CD1 4.04Å; L1019-F1062 HydrophobicContact CD2-CG 4Å; L1027-F1062 HydrophobicContact CD1-CB 3.81Å; L1029-F1062 HydrophobicContact CD1-CZ 4.37Å; I1044-F1062 HydrophobicContact CD1-CD2 3.57Å; I1044-F1062 HydrophobicContact CD1-CE2 3.45Å; I1044-F1062 VanDerWaalsContact CD1-CE2 3.45Å; A1056-F1062 HydrophobicContact CB-CD1 4.1Å; P1059-F1062 WeakPolarHBondContact O-CE1 3.39Å; P1059-F1062 WeakPolarHBondContact O-CZ 3.28Å; F1062-I1073 WeakPolarHBondContact O-CA 3.38Å; F1062-A1074 HydrophobicContact CB-CB 4.4Å; F1062-A1074 PolarHBondContact N-O 3.25Å; F1062-A1074 PolarHBondContact O-N 3.29Å; F1062-V1076 HydrophobicContact CD2-CG2 3.83Å; F1062-V1076 HydrophobicContact CE2-CB 4.39Å; F1062-V1076 HydrophobicContact CE2-CG2 3.48Å; F1062-V1076 VanDerWaalsContact CE2-CG2 3.48Å; F1062-V1076 HydrophobicContact CZ-CG2 4.38Å
1063	L	89.6	Confident	86.7	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	139.8	175.5	-57.8	179.1	0	0	0	109	I1054 G1055 V1057 L1071 Y1072 I1073 F1102 A1121 V1133	I1054-L1063 WeakPolarHBondContact CA-O 3.44Å; G1055-L1063 PolarHBondContact N-O 2.92Å; G1055-L1063 PolarHBondContact O-N 3.04Å; V1057-L1063 HydrophobicContact CG2-CD1 3.54Å; V1057-L1063 HydrophobicContact CG2-CD2 3.99Å; V1057-L1063 HydrophobicContact CG2-CG 3.79Å; L1063-L1071 HydrophobicContact CB-CD1 4.49Å; L1063-Y1072 WeakPolarHBondContact CA-O 3.36Å; L1063-I1073 HydrophobicContact CD2-CB 4.37Å; L1063-I1073 HydrophobicContact CD2-CD1 4.34Å; L1063-I1073 HydrophobicContact CD2-CG1 3.8Å; L1063-I1073 HydrophobicContact CD2-CG2 4.19Å; L1063-F1102 HydrophobicContact CB-CD1 4.35Å; L1063-F1102 HydrophobicContact CB-CE1 3.97Å; L1063-F1102 HydrophobicContact CB-CZ 4.17Å; L1063-F1102 HydrophobicContact CD1-CD1 3.93Å; L1063-F1102 HydrophobicContact CD1-CE1 3.88Å; L1063-A1121 HydrophobicContact CD1-CB 3.68Å; L1063-V1133 HydrophobicContact CD1-CB 4.06Å; L1063-V1133 HydrophobicContact CD1-CG1 3.98Å; L1063-V1133 HydrophobicContact CD1-CG2 4.33Å; L1063-V1133 HydrophobicContact CD2-CG1 3.92Å
1064	S	89.5	Confident	86.4	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	155.7	167.3	92.8	0	0	0	0	110.5	Y1046 G1053 L1071 Y1072	Y1046-S1064 WeakPolarHBondContact CE1-OG 3.39Å; Y1046-S1064 WeakPolarHBondContact OH-CB 3.44Å; Y1046-S1064 PolarHBondContact OH-OG 3.14Å; G1053-S1064 CarbonylContact O-C 3.59Å; G1053-S1064 WeakPolarHBondContact O-CA 3.33Å; S1064-L1071 WeakPolarHBondContact O-CA 3.38Å; S1064-L1071 WeakPolarHBondContact O-CD1 3.15Å; S1064-Y1072 PolarHBondContact N-O 2.7Å; S1064-Y1072 PolarHBondContact O-N 3.33Å
1065	A	89.6	Confident	86	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.008	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	152.1	171.3	0	0	0	0	0	110.8	L1051 T1052 G1053 N1070 V1099 F1102	L1051-A1065 WeakPolarHBondContact CD1-O 3.05Å; T1052-A1065 PolarHBondContact N-O 3.46Å; T1052-A1065 WeakPolarHBondContact OG1-CB 2.91Å; T1052-A1065 PolarHBondContact OG1-O 2.96Å; G1053-A1065 PolarHBondContact O-N 3.24Å; A1065-N1070 VanDerWaalsContact CA-O 3.25Å; A1065-N1070 WeakPolarHBondContact CA-O 3.37Å; A1065-V1099 HydrophobicContact CB-CB 3.59Å; A1065-V1099 HydrophobicContact CB-CG1 4.14Å; A1065-V1099 HydrophobicContact CB-CG2 4.08Å; A1065-F1102 HydrophobicContact CB-CE2 4.19Å; A1065-F1102 HydrophobicContact CB-CZ 4.19Å
1066	D	86.5	Confident	85.5	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	175.2	-179.8	72.6	12.5	0	0	0	113.1	D1049 W1050 T1052 A1068 Y1069 N1070 Y1072	D1049-D1066 HydrophobicContact CB-CB 4.06Å; W1050-D1066 CarbonylContact O-C 3.54Å; W1050-D1066 VanDerWaalsContact O-CA 3.28Å; W1050-D1066 WeakPolarHBondContact O-CA 3.36Å; T1052-D1066 WeakPolarHBondContact CG2-O 3.16Å; T1052-D1066 PolarHBondContact OG1-N 3.22Å; T1052-D1066 PolarHBondContact OG1-O 3.41Å; D1066-A1068 PolarHBondContact O-N 2.83Å; D1066-A1068 VanDerWaalsContact OD1-C 3.23Å; D1066-A1068 WeakPolarHBondContact OD1-CA 3.33Å; D1066-A1068 PolarHBondContact OD1-N 3.38Å; D1066-Y1069 PolarHBondContact OD1-N 2.78Å; D1066-N1070 PolarHBondContact N-O 3.19Å; D1066-N1070 VanDerWaalsContact N-O 3.12Å; D1066-N1070 WeakPolarHBondContact OD1-CB 3.41Å; D1066-N1070 PolarHBondContact OD1-N 3.5Å; D1066-N1070 PolarHBondContact OD1-ND2 2.94Å; D1066-N1070 WeakPolarHBondContact OD2-CB 3.3Å; D1066-N1070 PolarHBondContact OD2-ND2 2.85Å; D1066-Y1072 HydrophobicContact CB-CE2 4.04Å; D1066-Y1072 WeakPolarHBondContact OD2-CE2 3.44Å; D1066-Y1072 PolarHBondContact OD2-OH 3.14Å
1067	V	85.7	Confident	84.7	Confident	40 Å²	40	19.6 Å²	19.6	24%	0.242	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-15.7	175.5	-67.3	0	0	0	0	113.6	D1049 W1050 T1052 Y1069 Y1098	D1049-V1067 HydrophobicContact CB-CG2 4.29Å; W1050-V1067 HydrophobicContact CB-CB 4.38Å; W1050-V1067 HydrophobicContact CB-CG1 3.75Å; W1050-V1067 HydrophobicContact CB-CG2 3.73Å; W1050-V1067 HydrophobicContact CG-CG2 4.13Å; W1050-V1067 PolarHBondContact O-N 3.47Å; T1052-V1067 HydrophobicContact CG2-CB 4.33Å; T1052-V1067 HydrophobicContact CG2-CG1 3.58Å; V1067-Y1069 PolarHBondContact O-N 2.9Å; V1067-Y1098 HydrophobicContact CB-CE2 4.26Å; V1067-Y1098 HydrophobicContact CG1-CE2 4.05Å
1068	A	82.1	Confident	83.6	Confident	27 Å²	27	26.3 Å²	26.3	22%	0.223	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	14	177.8	0	0	0	0	0	112.6	D1066 N1070 H1094	D1066-A1068 PolarHBondContact O-N 2.83Å; D1066-A1068 VanDerWaalsContact OD1-C 3.23Å; D1066-A1068 WeakPolarHBondContact OD1-CA 3.33Å; D1066-A1068 PolarHBondContact OD1-N 3.38Å; A1068-N1070 VanDerWaalsContact C-N 3.31Å; A1068-N1070 WeakPolarHBondContact CB-ND2 3.3Å; A1068-N1070 PolarHBondContact O-N 3.32Å; A1068-H1094 PolarHBondContact O-CE1 2.89Å; A1068-H1094 PolarHBondContact O-ND1 2.78Å
1069	Y	87.6	Confident	82.4	Confident	56 Å²	56	31.8 Å²	31.8	22%	0.22	17%	0.174	C	C	.	.	S	Bend	trans	67.7	24.3	177	-43	-72.3	0	0	0	114.9	Q204 D1066 V1067 I1095 G1096 Q1097 Y1098	Q204-Y1069 PolarHBondContact NE2-OH 2.7Å; D1066-Y1069 PolarHBondContact OD1-N 2.78Å; V1067-Y1069 PolarHBondContact O-N 2.9Å; Y1069-I1095 PolarHBondContact O-N 3.37Å; Y1069-G1096 PolarHBondContact O-N 3.47Å; Y1069-Q1097 VanDerWaalsContact CD1-C 3.43Å; Y1069-Y1098 HydrophobicContact CD1-CD2 4.39Å; Y1069-Y1098 HydrophobicContact CE1-CD2 4.11Å
1070	N	86.5	Confident	80.8	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.011	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	142.7	176.2	-51.7	-59	0	0	0	110.6	A1065 D1066 A1068 Y1072 H1094 A1169	A1065-N1070 VanDerWaalsContact CA-O 3.25Å; A1065-N1070 WeakPolarHBondContact CA-O 3.37Å; D1066-N1070 PolarHBondContact N-O 3.19Å; D1066-N1070 VanDerWaalsContact N-O 3.12Å; D1066-N1070 WeakPolarHBondContact OD1-CB 3.41Å; D1066-N1070 PolarHBondContact OD1-N 3.5Å; D1066-N1070 PolarHBondContact OD1-ND2 2.94Å; D1066-N1070 WeakPolarHBondContact OD2-CB 3.3Å; D1066-N1070 PolarHBondContact OD2-ND2 2.85Å; A1068-N1070 VanDerWaalsContact C-N 3.31Å; A1068-N1070 WeakPolarHBondContact CB-ND2 3.3Å; A1068-N1070 PolarHBondContact O-N 3.32Å; N1070-Y1072 HydrophobicContact CB-CD2 4.24Å; N1070-Y1072 HydrophobicContact CB-CE1 3.77Å; N1070-Y1072 HydrophobicContact CB-CE2 3.53Å; N1070-Y1072 WeakPolarHBondContact CB-OH 3.24Å; N1070-Y1072 PolarHBondContact ND2-OH 2.65Å; N1070-Y1072 VanDerWaalsContact ND2-OH 3.15Å; N1070-H1094 PolarHBondContact OD1-ND1 2.83Å; N1070-A1169 HydrophobicContact CB-CB 4.31Å; N1070-A1169 WeakPolarHBondContact OD1-CA 3.47Å
1071	L	87.8	Confident	79.2	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136.7	165.5	174.5	75	0	0	0	108.4	V159 L1063 S1064 G1092 F1093 I1095 F1102 V1133	V159-L1071 HydrophobicContact CG1-CD2 4.1Å; V159-L1071 HydrophobicContact CG2-CD2 3.69Å; L1063-L1071 HydrophobicContact CB-CD1 4.49Å; S1064-L1071 WeakPolarHBondContact O-CA 3.38Å; S1064-L1071 WeakPolarHBondContact O-CD1 3.15Å; L1071-G1092 CarbonylContact O-C 3.34Å; L1071-G1092 WeakPolarHBondContact O-CA 3.45Å; L1071-F1093 PolarHBondContact N-O 2.8Å; L1071-F1093 PolarHBondContact O-N 3.42Å; L1071-I1095 HydrophobicContact CB-CD1 3.49Å; L1071-I1095 VanDerWaalsContact CB-CD1 3.49Å; L1071-I1095 HydrophobicContact CB-CG1 3.86Å; L1071-I1095 HydrophobicContact CD2-CD1 3.93Å; L1071-I1095 HydrophobicContact CG-CD1 4.2Å; L1071-F1102 HydrophobicContact CD1-CE1 3.77Å; L1071-F1102 HydrophobicContact CD1-CZ 3.53Å; L1071-V1133 HydrophobicContact CD2-CG2 3.86Å
1072	Y	85.8	Confident	77.3	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	140.3	-176.2	-62.2	-63.4	0	0	0	111.1	Y1046 T1048 L1063 S1064 D1066 N1070 Y1090 N1091 A1169	Y1046-Y1072 WeakPolarHBondContact OH-CB 3.45Å; Y1046-Y1072 PolarHBondContact OH-O 3.38Å; T1048-Y1072 HydrophobicContact CG2-CD2 3.16Å; T1048-Y1072 HydrophobicContact CG2-CE2 3.26Å; T1048-Y1072 HydrophobicContact CG2-CG 3.86Å; L1063-Y1072 WeakPolarHBondContact CA-O 3.36Å; S1064-Y1072 PolarHBondContact N-O 2.7Å; S1064-Y1072 PolarHBondContact O-N 3.33Å; D1066-Y1072 HydrophobicContact CB-CE2 4.04Å; D1066-Y1072 WeakPolarHBondContact OD2-CE2 3.44Å; D1066-Y1072 PolarHBondContact OD2-OH 3.14Å; N1070-Y1072 HydrophobicContact CB-CD2 4.24Å; N1070-Y1072 HydrophobicContact CB-CE1 3.77Å; N1070-Y1072 HydrophobicContact CB-CE2 3.53Å; N1070-Y1072 WeakPolarHBondContact CB-OH 3.24Å; N1070-Y1072 PolarHBondContact ND2-OH 2.65Å; N1070-Y1072 VanDerWaalsContact ND2-OH 3.15Å; Y1072-Y1090 VanDerWaalsContact CB-CE2 3.43Å; Y1072-Y1090 HydrophobicContact CD1-CD2 4.42Å; Y1072-Y1090 AromaticContact CD1-CE1 3.8Å; Y1072-Y1090 HydrophobicContact CD1-CE1 3.8Å; Y1072-Y1090 AromaticContact CD1-CE2 3.31Å; Y1072-Y1090 HydrophobicContact CD1-CE2 3.31Å; Y1072-Y1090 AromaticContact CD1-CZ 2.97Å; Y1072-Y1090 WeakPolarHBondContact CD1-OH 3.33Å; Y1072-Y1090 HydrophobicContact CD2-CE2 4.42Å; Y1072-Y1090 HydrophobicContact CE1-CE1 4.03Å; Y1072-Y1090 HydrophobicContact CE1-CE2 4.11Å; Y1072-Y1090 AromaticContact CE1-CZ 3.34Å; Y1072-Y1090 WeakPolarHBondContact CE1-OH 3.16Å; Y1072-Y1090 AromaticContact CG-CE2 3.47Å; Y1072-Y1090 HydrophobicContact CG-CE2 3.47Å; Y1072-Y1090 VanDerWaalsContact CG-CE2 3.47Å; Y1072-Y1090 AromaticContact CG-CZ 3.62Å; Y1072-N1091 WeakPolarHBondContact CA-O 3.47Å; Y1072-A1169 HydrophobicContact CE1-CB 3.75Å
1073	I	86.3	Confident	75.4	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.031	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	115.1	-176	-48.8	-177.8	0	0	0	107.9	T157 V1061 F1062 L1063 Y1090 N1091 I1185	T157-I1073 VanDerWaalsContact CB-CD1 3.5Å; T157-I1073 HydrophobicContact CG2-CD1 3.71Å; V1061-I1073 HydrophobicContact CG1-CG2 3.68Å; F1062-I1073 WeakPolarHBondContact O-CA 3.38Å; L1063-I1073 HydrophobicContact CD2-CB 4.37Å; L1063-I1073 HydrophobicContact CD2-CD1 4.34Å; L1063-I1073 HydrophobicContact CD2-CG1 3.8Å; L1063-I1073 HydrophobicContact CD2-CG2 4.19Å; I1073-Y1090 WeakPolarHBondContact O-CA 3.23Å; I1073-N1091 PolarHBondContact N-O 2.93Å; I1073-N1091 PolarHBondContact O-N 2.91Å; I1073-I1185 HydrophobicContact CD1-CD1 3.69Å; I1073-I1185 HydrophobicContact CD1-CG1 3.98Å; I1073-I1185 HydrophobicContact CG1-CD1 4.22Å
1074	A	83.7	Confident	73.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.7	173.2	0	0	0	0	0	109.6	Y1046 V1061 F1062 V1088 Q1089	Y1046-A1074 HydrophobicContact CD2-CB 3.98Å; Y1046-A1074 HydrophobicContact CE2-CB 3.56Å; V1061-A1074 CarbonylContact C-O 3.49Å; V1061-A1074 VanDerWaalsContact CA-O 3.3Å; V1061-A1074 WeakPolarHBondContact CA-O 3.26Å; F1062-A1074 HydrophobicContact CB-CB 4.4Å; F1062-A1074 PolarHBondContact N-O 3.25Å; F1062-A1074 PolarHBondContact O-N 3.29Å; A1074-V1088 HydrophobicContact CB-CG1 3.43Å; A1074-V1088 VanDerWaalsContact CB-CG1 3.43Å; A1074-Q1089 WeakPolarHBondContact CA-O 3.46Å
1075	D	83.9	Confident	72.5	Confident	23 Å²	23	56 Å²	56	12%	0.123	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.9	166	-165.8	3.1	0	0	0	108.8	V1061 Q1089	V1061-D1075 HydrophobicContact CG2-CB 4.38Å; D1075-Q1089 PolarHBondContact N-O 2.79Å; D1075-Q1089 PolarHBondContact O-N 2.8Å; D1075-Q1089 VanDerWaalsContact O-N 3.08Å
1076	V	79.1	Confident	71.3	Confident	10 Å²	10	56.8 Å²	56.8	6%	0.061	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	111.9	179.1	179.8	0	0	0	0	108.9	I1044 N1060 F1062 F1086 V1088	I1044-V1076 HydrophobicContact CD1-CG2 4.49Å; I1044-V1076 HydrophobicContact CG2-CG2 4.5Å; N1060-V1076 PolarHBondContact O-N 2.79Å; F1062-V1076 HydrophobicContact CD2-CG2 3.83Å; F1062-V1076 HydrophobicContact CE2-CB 4.39Å; F1062-V1076 HydrophobicContact CE2-CG2 3.48Å; F1062-V1076 VanDerWaalsContact CE2-CG2 3.48Å; F1062-V1076 HydrophobicContact CZ-CG2 4.38Å; V1076-F1086 HydrophobicContact CG1-CB 3.85Å; V1076-F1086 HydrophobicContact CG1-CD1 3.58Å; V1076-F1086 HydrophobicContact CG1-CE1 4.31Å; V1076-F1086 HydrophobicContact CG1-CG 3.83Å; V1076-V1088 HydrophobicContact CG2-CG2 4.26Å
1077	T	70.6	Confident	70	Confident	68 Å²	68	59.1 Å²	59.1	42%	0.417	34%	0.339	S	S	.	.			trans	-83.6	146.4	170.9	53.4	0	0	0	0	110.4	P1087	T1077-P1087 PolarHBondContact OG1-O 3.47Å
1078	D	61.3	Low	69.1	Low	143 Å²	143	59 Å²	59	77%	0.765	34%	0.338	S	S	*	.	S	Bend	trans	-52.4	146.8	-174.3	-72.8	-30.1	0	0	0	113.4
1079	E	54.4	Low	68.6	Low	136 Å²	136	61.1 Å²	61.1	64%	0.636	34%	0.343	S	S	*	.			trans	-41.4	128.3	-167.6	-68.2	177.5	174.9	0	0	115.6	F1086	E1079-F1086 HydrophobicContact CG-CD1 4.22Å; E1079-F1086 HydrophobicContact CG-CE1 3.38Å; E1079-F1086 HydrophobicContact CG-CZ 4.03Å
1080	T	47.5	Very low	68	Low	77 Å²	77	60.8 Å²	60.8	47%	0.472	34%	0.342	S	S	.	.			trans	-74	139.2	152.9	48.1	0	0	0	0	109.5	N1082 P1087	T1080-N1082 PolarHBondContact O-N 2.8Å; T1080-P1087 HydrophobicContact CG2-CG 4.12Å
1081	E	51	Low	67.6	Low	202 Å²	202	62 Å²	62	94%	0.944	35%	0.349	S	S	*	.	S	Bend	trans	-54.5	-7.9	-178.1	-65.9	-178	150.9	0	0	115.9	G1083	E1081-G1083 PolarHBondContact O-N 2.83Å
1082	N	45.3	Very low	67.3	Low	137 Å²	137	62.6 Å²	62.6	73%	0.733	35%	0.354	S	S	*	.	S	Bend	trans	-96.4	93.5	178.7	-73	-26.3	0	0	0	110.8	T1080 G1084	T1080-N1082 PolarHBondContact O-N 2.8Å; N1082-G1084 VanDerWaalsContact C-N 3.3Å; N1082-G1084 PolarHBondContact O-N 3.09Å
1083	G	48.7	Very low	67.3	Low	83 Å²	83	62.5 Å²	62.5	86%	0.856	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	71	-174.3	0	0	0	0	0	116.5	E1081	E1081-G1083 PolarHBondContact O-N 2.83Å
1084	G	56.9	Low	67.4	Low	45 Å²	45	63.7 Å²	63.7	46%	0.464	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.9	-36.6	171.7	0	0	0	0	0	115.2	N1082	N1082-G1084 VanDerWaalsContact C-N 3.3Å; N1082-G1084 PolarHBondContact O-N 3.09Å
1085	K	62.4	Low	67.7	Low	115 Å²	115	64 Å²	64	50%	0.5	36%	0.361	S	S	.	.			trans	-149.3	138.6	-177	-69.3	-172.7	168.5	-161.5	0	110.6	D1045	D1045-K1085 HydrophobicContact CB-CD 4.19Å; D1045-K1085 IonicContact OD1-NZ 3.29Å; D1045-K1085 PolarHBondContact OD1-NZ 2.6Å
1086	F	65.2	Low	67.8	Low	18 Å²	18	64.4 Å²	64.4	8%	0.079	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-77.3	136.1	171	-73.8	-85.5	0	0	0	110.2	L1029 H1042 V1076 E1079 V1088	L1029-F1086 HydrophobicContact CD2-CE2 4.11Å; L1029-F1086 HydrophobicContact CD2-CZ 4.24Å; H1042-F1086 HydrophobicContact CB-CD2 4.09Å; H1042-F1086 HydrophobicContact CB-CE2 3.51Å; H1042-F1086 AromaticContact CG-CE2 3.89Å; V1076-F1086 HydrophobicContact CG1-CB 3.85Å; V1076-F1086 HydrophobicContact CG1-CD1 3.58Å; V1076-F1086 HydrophobicContact CG1-CE1 4.31Å; V1076-F1086 HydrophobicContact CG1-CG 3.83Å; E1079-F1086 HydrophobicContact CG-CD1 4.22Å; E1079-F1086 HydrophobicContact CG-CE1 3.38Å; E1079-F1086 HydrophobicContact CG-CZ 4.03Å; F1086-V1088 HydrophobicContact CB-CG2 4.33Å; F1086-V1088 WeakPolarHBondContact O-CG2 3.45Å; F1086-V1088 PolarHBondContact O-N 3.35Å
1087	P	58	Low	68.3	Low	49 Å²	49	65.3 Å²	65.3	32%	0.318	37%	0.374	S	S	.	.			trans	-67.8	124.8	165.9	27.4	-31.1	0	0	0	109.1	T1077 T1080	T1077-P1087 PolarHBondContact OG1-O 3.47Å; T1080-P1087 HydrophobicContact CG2-CG 4.12Å
1088	V	67.4	Low	69.2	Low	38 Å²	38	65.4 Å²	65.4	23%	0.23	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.8	-172.4	179.9	0	0	0	0	108.9	I1044 A1074 V1076 F1086	I1044-V1088 HydrophobicContact CG2-CB 4.4Å; I1044-V1088 HydrophobicContact CG2-CG1 4.31Å; I1044-V1088 HydrophobicContact CG2-CG2 3.33Å; A1074-V1088 HydrophobicContact CB-CG1 3.43Å; A1074-V1088 VanDerWaalsContact CB-CG1 3.43Å; V1076-V1088 HydrophobicContact CG2-CG2 4.26Å; F1086-V1088 HydrophobicContact CB-CG2 4.33Å; F1086-V1088 WeakPolarHBondContact O-CG2 3.45Å; F1086-V1088 PolarHBondContact O-N 3.35Å
1089	Q	70.3	Confident	70.8	Confident	71 Å²	71	58.7 Å²	58.7	33%	0.332	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	123.7	164.1	-176.3	158.9	30	0	0	109.5	A1074 D1075 K1184	A1074-Q1089 WeakPolarHBondContact CA-O 3.46Å; D1075-Q1089 PolarHBondContact N-O 2.79Å; D1075-Q1089 PolarHBondContact O-N 2.8Å; D1075-Q1089 VanDerWaalsContact O-N 3.08Å; Q1089-K1184 VanDerWaalsContact NE2-CE 3.25Å
1090	Y	75.3	Confident	72.5	Confident	49 Å²	49	54 Å²	54	19%	0.192	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	141.8	-177	172.5	-96.8	0	0	0	112	Y1046 H1047 T1048 Y1072 I1073	Y1046-Y1090 AromaticContact CD2-CD2 3.95Å; Y1046-Y1090 HydrophobicContact CD2-CD2 3.95Å; Y1046-Y1090 HydrophobicContact CD2-CE2 4.23Å; Y1046-Y1090 HydrophobicContact CE1-CE2 4.36Å; Y1046-Y1090 AromaticContact CE2-CD2 3.51Å; Y1046-Y1090 HydrophobicContact CE2-CD2 3.51Å; Y1046-Y1090 AromaticContact CE2-CE2 3.72Å; Y1046-Y1090 HydrophobicContact CE2-CE2 3.72Å; Y1046-Y1090 AromaticContact CZ-CE2 3.86Å; H1047-Y1090 PolarHBondContact O-OH 2.91Å; T1048-Y1090 HydrophobicContact CG2-CE2 4.45Å; Y1072-Y1090 VanDerWaalsContact CB-CE2 3.43Å; Y1072-Y1090 HydrophobicContact CD1-CD2 4.42Å; Y1072-Y1090 AromaticContact CD1-CE1 3.8Å; Y1072-Y1090 HydrophobicContact CD1-CE1 3.8Å; Y1072-Y1090 AromaticContact CD1-CE2 3.31Å; Y1072-Y1090 HydrophobicContact CD1-CE2 3.31Å; Y1072-Y1090 AromaticContact CD1-CZ 2.97Å; Y1072-Y1090 WeakPolarHBondContact CD1-OH 3.33Å; Y1072-Y1090 HydrophobicContact CD2-CE2 4.42Å; Y1072-Y1090 HydrophobicContact CE1-CE1 4.03Å; Y1072-Y1090 HydrophobicContact CE1-CE2 4.11Å; Y1072-Y1090 AromaticContact CE1-CZ 3.34Å; Y1072-Y1090 WeakPolarHBondContact CE1-OH 3.16Å; Y1072-Y1090 AromaticContact CG-CE2 3.47Å; Y1072-Y1090 HydrophobicContact CG-CE2 3.47Å; Y1072-Y1090 VanDerWaalsContact CG-CE2 3.47Å; Y1072-Y1090 AromaticContact CG-CZ 3.62Å; I1073-Y1090 WeakPolarHBondContact O-CA 3.23Å
1091	N	79.1	Confident	74.7	Confident	29 Å²	29	50.6 Å²	50.6	16%	0.155	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	130.5	165.9	-58.4	-82.2	0	0	0	109.4	Y1072 I1073 I1185	Y1072-N1091 WeakPolarHBondContact CA-O 3.47Å; I1073-N1091 PolarHBondContact N-O 2.93Å; I1073-N1091 PolarHBondContact O-N 2.91Å; N1091-I1185 HydrophobicContact CB-CD1 3.88Å; N1091-I1185 HydrophobicContact CB-CG1 4.24Å
1092	G	81.1	Confident	76.7	Confident	11 Å²	11	41.1 Å²	41.1	11%	0.113	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	151	171.2	0	0	0	0	0	112.8	L1071 C1182	L1071-G1092 CarbonylContact O-C 3.34Å; L1071-G1092 WeakPolarHBondContact O-CA 3.45Å; G1092-C1182 PolarHBondContact O-SG 2.91Å
1093	F	86.4	Confident	78.7	Confident	3 Å²	3	35.1 Å²	35.1	1%	0.013	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	119.3	176.1	-176.7	-99.8	0	0	0	109.4	V159 L1071 I1095 R1167 I1185 D1187	V159-F1093 HydrophobicContact CB-CD1 4.23Å; V159-F1093 HydrophobicContact CB-CE1 4.04Å; V159-F1093 HydrophobicContact CG1-CD1 4.08Å; V159-F1093 HydrophobicContact CG1-CE1 3.88Å; V159-F1093 HydrophobicContact CG2-CD1 4.31Å; L1071-F1093 PolarHBondContact N-O 2.8Å; L1071-F1093 PolarHBondContact O-N 3.42Å; F1093-I1095 HydrophobicContact CD1-CG1 3.81Å; F1093-I1095 HydrophobicContact CE1-CG1 4.17Å; F1093-I1095 PolarHBondContact O-N 3.37Å; F1093-R1167 HydrophobicContact CD2-CB 4.26Å; F1093-R1167 HydrophobicContact CE2-CB 3.94Å; F1093-R1167 HydrophobicContact CE2-CG 3.8Å; F1093-R1167 HydrophobicContact CZ-CG 4.04Å; F1093-R1167 VanDerWaalsContact CZ-NE 3.27Å; F1093-I1185 HydrophobicContact CB-CD1 3.66Å; F1093-I1185 HydrophobicContact CB-CG2 4.34Å; F1093-I1185 HydrophobicContact CD2-CB 4.37Å; F1093-I1185 HydrophobicContact CD2-CG2 3.72Å; F1093-I1185 HydrophobicContact CE2-CG2 4.15Å; F1093-I1185 HydrophobicContact CG-CG2 4.08Å; F1093-D1187 HydrophobicContact CE2-CB 4.18Å; F1093-D1187 HydrophobicContact CZ-CB 4.03Å
1094	H	88.5	Confident	80.2	Confident	31 Å²	31	35.1 Å²	35.1	14%	0.144	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	108.9	177.3	-172	75.4	0	0	0	110.3	A1068 N1070 F1166 R1167	A1068-H1094 PolarHBondContact O-CE1 2.89Å; A1068-H1094 PolarHBondContact O-ND1 2.78Å; N1070-H1094 PolarHBondContact OD1-ND1 2.83Å; H1094-F1166 WeakPolarHBondContact CB-O 3.03Å; H1094-F1166 AromaticContact CD2-CE2 3.88Å; H1094-F1166 PolarHBondContact CD2-O 2.78Å; H1094-R1167 PolarHBondContact N-O 2.65Å; H1094-R1167 WeakPolarHBondContact O-CD 3.4Å; H1094-R1167 PolarHBondContact O-NH1 2.97Å
1095	I	88.4	Confident	81.1	Confident	6 Å²	6	33.9 Å²	33.9	3%	0.031	18%	0.18	C	C	.	.			trans	-76.9	-36.8	178.1	-66.7	-175.4	0	0	0	110	V159 Y1069 L1071 F1093 Q1097 V1099 Y1123 R1167	V159-I1095 HydrophobicContact CG1-CD1 4.3Å; V159-I1095 HydrophobicContact CG1-CG1 4.49Å; Y1069-I1095 PolarHBondContact O-N 3.37Å; L1071-I1095 HydrophobicContact CB-CD1 3.49Å; L1071-I1095 VanDerWaalsContact CB-CD1 3.49Å; L1071-I1095 HydrophobicContact CB-CG1 3.86Å; L1071-I1095 HydrophobicContact CD2-CD1 3.93Å; L1071-I1095 HydrophobicContact CG-CD1 4.2Å; F1093-I1095 HydrophobicContact CD1-CG1 3.81Å; F1093-I1095 HydrophobicContact CE1-CG1 4.17Å; F1093-I1095 PolarHBondContact O-N 3.37Å; I1095-Q1097 VanDerWaalsContact C-N 3.31Å; I1095-Q1097 HydrophobicContact CG2-CB 3.87Å; I1095-Q1097 HydrophobicContact CG2-CG 4.15Å; I1095-V1099 HydrophobicContact CD1-CG2 4.17Å; I1095-Y1123 HydrophobicContact CD1-CD2 4.47Å; I1095-Y1123 HydrophobicContact CD1-CE2 3.86Å; I1095-Y1123 HydrophobicContact CG2-CE2 4.49Å; I1095-R1167 PolarHBondContact O-NH1 3.34Å
1096	G	87.3	Confident	81.2	Confident	31 Å²	31	33 Å²	33	32%	0.32	18%	0.181	S	C	.	.	S	Bend	trans	78.5	15.9	-171.7	0	0	0	0	0	113.5	Y1069	Y1069-G1096 PolarHBondContact O-N 3.47Å
1097	Q	88.8	Confident	81.1	Confident	29 Å²	29	32.6 Å²	32.6	14%	0.136	18%	0.18	C	C	.	.	S	Bend	trans	-137.7	154.6	176.3	-58	-167.3	12	0	0	111.5	Y1069 I1095 V1099 T1125 S1129	Y1069-Q1097 VanDerWaalsContact CD1-C 3.43Å; I1095-Q1097 VanDerWaalsContact C-N 3.31Å; I1095-Q1097 HydrophobicContact CG2-CB 3.87Å; I1095-Q1097 HydrophobicContact CG2-CG 4.15Å; Q1097-V1099 PolarHBondContact O-N 3.17Å; Q1097-T1125 HydrophobicContact CB-CG2 3.8Å; Q1097-T1125 PolarHBondContact OE1-OG1 3.07Å; Q1097-S1129 VanDerWaalsContact CD-OG 3.27Å; Q1097-S1129 PolarHBondContact NE2-OG 3.44Å; Q1097-S1129 PolarHBondContact OE1-OG 2.93Å
1098	Y	90.8	Very high	80.7	Confident	70 Å²	70	35.7 Å²	35.7	28%	0.275	19%	0.193	S	C	.	.			trans	-91.2	103.2	-173.5	-165.3	-80.6	0	0	0	110.4	T1052 V1067 Y1069 N1100 T1125 A1126 E1127	T1052-Y1098 HydrophobicContact CG2-CE1 3.78Å; T1052-Y1098 HydrophobicContact CG2-CE2 3.77Å; T1052-Y1098 VanDerWaalsContact CG2-OH 3.24Å; T1052-Y1098 WeakPolarHBondContact CG2-OH 3.33Å; V1067-Y1098 HydrophobicContact CB-CE2 4.26Å; V1067-Y1098 HydrophobicContact CG1-CE2 4.05Å; Y1069-Y1098 HydrophobicContact CD1-CD2 4.39Å; Y1069-Y1098 HydrophobicContact CE1-CD2 4.11Å; Y1098-N1100 WeakPolarHBondContact CD1-OD1 3.46Å; Y1098-N1100 VanDerWaalsContact CE1-OD1 3.26Å; Y1098-N1100 WeakPolarHBondContact CE1-OD1 3.35Å; Y1098-N1100 PolarHBondContact O-N 2.97Å; Y1098-T1125 CarbonylContact O-C 3.6Å; Y1098-T1125 WeakPolarHBondContact O-CA 3.17Å; Y1098-T1125 WeakPolarHBondContact O-CB 3.44Å; Y1098-A1126 HydrophobicContact CD1-CB 4.16Å; Y1098-A1126 HydrophobicContact CG-CB 4.42Å; Y1098-A1126 PolarHBondContact O-N 3.15Å; Y1098-E1127 PolarHBondContact N-OE2 3.26Å
1099	V	93	Very high	79.6	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.018	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	119.3	-177.4	-178.6	0	0	0	0	110.8	T1052 A1065 I1095 Q1097 F1102 Y1123 T1125	T1052-V1099 WeakPolarHBondContact CB-O 3.48Å; T1052-V1099 PolarHBondContact OG1-O 3.21Å; T1052-V1099 VanDerWaalsContact OG1-O 3.08Å; A1065-V1099 HydrophobicContact CB-CB 3.59Å; A1065-V1099 HydrophobicContact CB-CG1 4.14Å; A1065-V1099 HydrophobicContact CB-CG2 4.08Å; I1095-V1099 HydrophobicContact CD1-CG2 4.17Å; Q1097-V1099 PolarHBondContact O-N 3.17Å; V1099-F1102 HydrophobicContact CG1-CD2 4.31Å; V1099-F1102 HydrophobicContact CG1-CE1 4.27Å; V1099-F1102 HydrophobicContact CG1-CE2 3.75Å; V1099-F1102 HydrophobicContact CG1-CZ 3.73Å; V1099-Y1123 HydrophobicContact CG1-CD2 4.49Å; V1099-Y1123 HydrophobicContact CG2-CD2 3.97Å; V1099-T1125 HydrophobicContact CG2-CG2 4.19Å
1100	N	91.9	Very high	78.5	Confident	38 Å²	38	40.1 Å²	40.1	20%	0.203	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-36.5	177	-80.4	-31.2	0	0	0	112.8	I438 Y1098 A1124	I438-N1100 WeakPolarHBondContact O-CB 3.38Å; I438-N1100 PolarHBondContact O-ND2 3.23Å; Y1098-N1100 WeakPolarHBondContact CD1-OD1 3.46Å; Y1098-N1100 VanDerWaalsContact CE1-OD1 3.26Å; Y1098-N1100 WeakPolarHBondContact CE1-OD1 3.35Å; Y1098-N1100 PolarHBondContact O-N 2.97Å; N1100-A1124 PolarHBondContact N-O 3.44Å
1101	V	92.6	Very high	77.3	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.024	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	133.9	-166.6	-167.9	0	0	0	0	110.6	V439 L441 Y1123 A1124	V439-V1101 WeakPolarHBondContact O-CG2 3.45Å; L441-V1101 HydrophobicContact CB-CB 4.32Å; L441-V1101 HydrophobicContact CB-CG1 3.98Å; V1101-Y1123 CarbonylContact O-C 3.57Å; V1101-Y1123 VanDerWaalsContact O-CA 3.25Å; V1101-Y1123 WeakPolarHBondContact O-CA 3.39Å; V1101-A1124 PolarHBondContact N-O 2.97Å; V1101-A1124 PolarHBondContact O-N 3.41Å
1102	F	92.4	Very high	76.1	Confident	3 Å²	3	40.4 Å²	40.4	1%	0.013	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	143.3	160.9	-66.7	-87.2	0	0	0	110.3	R1011 I1054 L1063 A1065 L1071 V1099 L1122 Y1123	R1011-F1102 PolarHBondContact NH1-O 2.96Å; R1011-F1102 PolarHBondContact NH2-O 3.35Å; I1054-F1102 WeakPolarHBondContact O-CD2 3.45Å; L1063-F1102 HydrophobicContact CB-CD1 4.35Å; L1063-F1102 HydrophobicContact CB-CE1 3.97Å; L1063-F1102 HydrophobicContact CB-CZ 4.17Å; L1063-F1102 HydrophobicContact CD1-CD1 3.93Å; L1063-F1102 HydrophobicContact CD1-CE1 3.88Å; A1065-F1102 HydrophobicContact CB-CE2 4.19Å; A1065-F1102 HydrophobicContact CB-CZ 4.19Å; L1071-F1102 HydrophobicContact CD1-CE1 3.77Å; L1071-F1102 HydrophobicContact CD1-CZ 3.53Å; V1099-F1102 HydrophobicContact CG1-CD2 4.31Å; V1099-F1102 HydrophobicContact CG1-CE1 4.27Å; V1099-F1102 HydrophobicContact CG1-CE2 3.75Å; V1099-F1102 HydrophobicContact CG1-CZ 3.73Å; F1102-L1122 CarbonylContact C-O 3.58Å; F1102-L1122 VanDerWaalsContact CA-O 3.31Å; F1102-L1122 WeakPolarHBondContact CA-O 3.21Å; F1102-Y1123 HydrophobicContact CE1-CG 4.48Å
1103	C	88.2	Confident	75.2	Confident	11 Å²	11	45.2 Å²	45.2	7%	0.074	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.8	174.7	-173.7	0	0	0	0	108.7	L441 A1121 L1122	L441-C1103 HydrophobicContact CD2-CB 4.38Å; C1103-A1121 CarbonylContact O-C 3.4Å; C1103-A1121 WeakPolarHBondContact O-CA 3.21Å; C1103-L1122 HydrophobicContact CB-CD2 4.38Å; C1103-L1122 PolarHBondContact N-O 3.34Å; C1103-L1122 PolarHBondContact O-N 3.49Å
1104	P	80.9	Confident	74.6	Confident	84 Å²	84	49.6 Å²	49.6	55%	0.545	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	147.6	167.7	-21.3	32.3	0	0	0	110.4	Q443	Q443-P1104 PolarHBondContact OE1-O 3.01Å
1105	R	74.3	Confident	73.9	Confident	18 Å²	18	48.6 Å²	48.6	7%	0.068	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	125.2	172.1	-175.4	174.9	-174.4	168.6	6.5	109	A1120 L1122 T1132 T1239 I1240 N1242	R1105-A1120 HydrophobicContact CB-CB 4.15Å; R1105-A1120 PolarHBondContact N-O 3.18Å; R1105-A1120 PolarHBondContact O-N 2.7Å; R1105-L1122 HydrophobicContact CB-CB 4.2Å; R1105-T1132 PolarHBondContact NH1-OG1 3.48Å; R1105-T1239 PolarHBondContact NH2-O 2.89Å; R1105-I1240 PolarHBondContact NH1-O 3.24Å; R1105-I1240 VanDerWaalsContact NH2-C 3.33Å; R1105-I1240 PolarHBondContact NH2-O 3.04Å; R1105-N1242 PolarHBondContact NH2-OXT 3.46Å
1106	N	66.1	Low	73.2	Confident	96 Å²	96	48.8 Å²	48.8	51%	0.513	28%	0.277	S	S	.	.			trans	-91	117	176.2	-137.7	6.9	0	0	0	108.7	N1108	N1106-N1108 VanDerWaalsContact C-N 3.33Å; N1106-N1108 PolarHBondContact ND2-ND2 3.12Å; N1106-N1108 VanDerWaalsContact OD1-CG 3.28Å; N1106-N1108 PolarHBondContact OD1-ND2 2.73Å; N1106-N1108 VanDerWaalsContact OD1-ND2 3.14Å; N1106-N1108 PolarHBondContact OD1-OD1 2.78Å
1107	M	61.8	Low	72.4	Confident	11 Å²	11	50.6 Å²	50.6	5%	0.054	28%	0.279	C	S	.	.			trans	-94.4	14.8	-178.4	-71.8	-80.6	-71	0	0	112.7	F1109 M1111 A1120 T1239 I1240	M1107-F1109 VanDerWaalsContact C-N 3.25Å; M1107-F1109 PolarHBondContact O-N 3.04Å; M1107-M1111 HydrophobicContact CE-CG 3.93Å; M1107-M1111 HydrophobicContact CE-SD 3.62Å; M1107-A1120 HydrophobicContact CG-CB 3.6Å; M1107-A1120 HydrophobicContact SD-CB 4.48Å; M1107-T1239 HydrophobicContact CE-CG2 3.85Å; M1107-T1239 HydrophobicContact SD-CG2 3.97Å; M1107-I1240 HydrophobicContact CE-CG1 4.19Å
1108	N	50.6	Low	71.5	Confident	113 Å²	113	51.9 Å²	51.9	60%	0.604	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	2.1	-154.9	-78.6	2	0	0	0	118.4	N1106	N1106-N1108 VanDerWaalsContact C-N 3.33Å; N1106-N1108 PolarHBondContact ND2-ND2 3.12Å; N1106-N1108 VanDerWaalsContact OD1-CG 3.28Å; N1106-N1108 PolarHBondContact OD1-ND2 2.73Å; N1106-N1108 VanDerWaalsContact OD1-ND2 3.14Å; N1106-N1108 PolarHBondContact OD1-OD1 2.78Å
1109	F	44.9	Very low	70.5	Confident	152 Å²	152	51.6 Å²	51.6	67%	0.667	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-8.2	-176.4	-91.1	-82.5	0	0	0	116.7	E451 M1107	E451-F1109 VanDerWaalsContact OE2-CE2 3.29Å; E451-F1109 WeakPolarHBondContact OE2-CE2 3.43Å; M1107-F1109 VanDerWaalsContact C-N 3.25Å; M1107-F1109 PolarHBondContact O-N 3.04Å
1110	A	45.5	Very low	70	Confident	50 Å²	50	51.5 Å²	51.5	41%	0.413	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.3	-3.9	-172	0	0	0	0	0	116	T1239	A1110-T1239 HydrophobicContact CB-CG2 3.78Å; A1110-T1239 WeakPolarHBondContact CB-OG1 3.46Å
1111	M	50.3	Low	69.8	Low	24 Å²	24	49.7 Å²	49.7	12%	0.118	30%	0.298	C	S	.	.	S	Bend	trans	-120.2	121.4	170.4	-59.2	-151.6	87.6	0	0	109.7	M1107 I1115 V1116 M1236	M1107-M1111 HydrophobicContact CE-CG 3.93Å; M1107-M1111 HydrophobicContact CE-SD 3.62Å; M1111-I1115 HydrophobicContact CE-CB 4.01Å; M1111-I1115 HydrophobicContact CE-CD1 3.63Å; M1111-I1115 HydrophobicContact CE-CG1 4.4Å; M1111-I1115 HydrophobicContact CE-CG2 3.62Å; M1111-V1116 HydrophobicContact CB-CG2 4.35Å; M1111-V1116 HydrophobicContact CE-CG2 4.44Å; M1111-V1116 HydrophobicContact SD-CG2 3.62Å; M1111-M1236 HydrophobicContact CE-CB 3.39Å; M1111-M1236 HydrophobicContact CE-CG 3.56Å; M1111-M1236 HydrophobicContact CE-SD 3.93Å; M1111-M1236 HydrophobicContact SD-CB 3.96Å; M1111-M1236 HydrophobicContact SD-CG 3.63Å; M1111-M1236 HydrophobicContact SD-SD 4.32Å
1112	S	53.9	Low	69.7	Low	60 Å²	60	49.7 Å²	49.7	42%	0.42	30%	0.298	S	S	.	.			trans	-57.4	147.2	169.3	59.1	0	0	0	0	109	E1114 I1115	S1112-E1114 PolarHBondContact O-N 2.86Å; S1112-E1114 VanDerWaalsContact OG-CB 3.3Å; S1112-E1114 WeakPolarHBondContact OG-CB 3.45Å; S1112-I1115 PolarHBondContact O-N 2.73Å
1113	S	62.3	Low	69.7	Low	113 Å²	113	49.6 Å²	49.6	79%	0.79	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-7.7	170.9	55.4	0	0	0	0	113.5
1114	E	73.6	Confident	70	Confident	94 Å²	94	49 Å²	49	44%	0.439	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-35.6	173.4	-154	-163.3	142.3	0	0	112.9	S1112 T1137 R1139 Y1140	S1112-E1114 PolarHBondContact O-N 2.86Å; S1112-E1114 VanDerWaalsContact OG-CB 3.3Å; S1112-E1114 WeakPolarHBondContact OG-CB 3.45Å; E1114-T1137 WeakPolarHBondContact O-CG2 3.35Å; E1114-T1137 PolarHBondContact O-OG1 3.3Å; E1114-R1139 IonicContact OE1-NH1 3.61Å; E1114-Y1140 HydrophobicContact CB-CE2 4.48Å; E1114-Y1140 HydrophobicContact CG-CE2 3.99Å; E1114-Y1140 VanDerWaalsContact O-CD2 3.32Å; E1114-Y1140 WeakPolarHBondContact O-CD2 3.25Å; E1114-Y1140 WeakPolarHBondContact O-CE2 3.35Å; E1114-Y1140 PolarHBondContact OE1-OH 2.89Å
1115	I	75.4	Confident	70.6	Confident	10 Å²	10	45 Å²	45	5%	0.051	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-53.3	-172	-56.7	158.2	0	0	0	110.8	M1111 S1112 L1136 T1137 Y1140 F1144 V1232	M1111-I1115 HydrophobicContact CE-CB 4.01Å; M1111-I1115 HydrophobicContact CE-CD1 3.63Å; M1111-I1115 HydrophobicContact CE-CG1 4.4Å; M1111-I1115 HydrophobicContact CE-CG2 3.62Å; S1112-I1115 PolarHBondContact O-N 2.73Å; I1115-L1136 HydrophobicContact CG2-CD2 4.14Å; I1115-L1136 WeakPolarHBondContact O-CA 3.4Å; I1115-T1137 PolarHBondContact O-N 3.31Å; I1115-Y1140 HydrophobicContact CB-CD2 4.34Å; I1115-Y1140 HydrophobicContact CB-CE2 4.44Å; I1115-Y1140 HydrophobicContact CB-CG 4.4Å; I1115-Y1140 HydrophobicContact CG1-CD1 4.15Å; I1115-Y1140 HydrophobicContact CG1-CD2 4.16Å; I1115-Y1140 HydrophobicContact CG1-CE1 3.81Å; I1115-Y1140 HydrophobicContact CG1-CE2 3.81Å; I1115-Y1140 HydrophobicContact CG1-CG 4.32Å; I1115-Y1140 HydrophobicContact CG2-CD1 4.1Å; I1115-Y1140 HydrophobicContact CG2-CD2 4.48Å; I1115-Y1140 HydrophobicContact CG2-CG 4.04Å; I1115-F1144 HydrophobicContact CG2-CE2 4.35Å; I1115-V1232 HydrophobicContact CD1-CB 4.45Å; I1115-V1232 HydrophobicContact CD1-CG1 3.65Å; I1115-V1232 HydrophobicContact CD1-CG2 4.06Å; I1115-V1232 HydrophobicContact CG1-CG1 4.26Å
1116	V	73.6	Confident	71.4	Confident	10 Å²	10	45.3 Å²	45.3	6%	0.061	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.5	-176.2	179.6	0	0	0	0	109.3	M1111 G1118 C1134 L1135	M1111-V1116 HydrophobicContact CB-CG2 4.35Å; M1111-V1116 HydrophobicContact CE-CG2 4.44Å; M1111-V1116 HydrophobicContact SD-CG2 3.62Å; V1116-G1118 PolarHBondContact O-N 2.99Å; V1116-C1134 HydrophobicContact CG1-CB 4.07Å; V1116-L1135 CarbonylContact C-O 3.32Å; V1116-L1135 VanDerWaalsContact CA-O 3.29Å; V1116-L1135 WeakPolarHBondContact CA-O 3.4Å; V1116-L1135 WeakPolarHBondContact CG1-O 3.21Å
1117	N	70.5	Confident	72.6	Confident	70 Å²	70	43 Å²	43	37%	0.374	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	93.7	179.4	-160.1	2.7	0	0	0	110.3	L1135 T1137	N1117-L1135 HydrophobicContact CB-CB 4.46Å; N1117-L1135 PolarHBondContact N-O 2.9Å; N1117-T1137 HydrophobicContact CB-CG2 4.2Å
1118	G	68.5	Low	73.9	Confident	56 Å²	56	42.5 Å²	42.5	58%	0.577	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	89.3	-139.3	175.6	0	0	0	0	0	114	V1116	V1116-G1118 PolarHBondContact O-N 2.99Å
1119	S	70.8	Confident	75.8	Confident	63 Å²	63	37.2 Å²	37.2	44%	0.441	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	165.7	-174.4	-35.8	0	0	0	0	112.1	V1057	V1057-S1119 WeakPolarHBondContact CG1-O 3.42Å; V1057-S1119 WeakPolarHBondContact O-CB 3.28Å
1120	A	81.6	Confident	77.9	Confident	1 Å²	1	31 Å²	31	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	160.5	163.8	0	0	0	0	0	109.9	R1105 M1107 T1132 V1133 C1134	R1105-A1120 HydrophobicContact CB-CB 4.15Å; R1105-A1120 PolarHBondContact N-O 3.18Å; R1105-A1120 PolarHBondContact O-N 2.7Å; M1107-A1120 HydrophobicContact CG-CB 3.6Å; M1107-A1120 HydrophobicContact SD-CB 4.48Å; A1120-T1132 HydrophobicContact CB-CG2 4.09Å; A1120-V1133 CarbonylContact C-O 3.57Å; A1120-V1133 WeakPolarHBondContact CA-O 3.49Å; A1120-C1134 HydrophobicContact CB-CB 3.97Å
1121	A	87.5	Confident	80	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.008	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.9	169.7	0	0	0	0	0	109.2	V1057 L1063 C1103 T1132 V1133	V1057-A1121 HydrophobicContact CG2-CB 4.01Å; L1063-A1121 HydrophobicContact CD1-CB 3.68Å; C1103-A1121 CarbonylContact O-C 3.4Å; C1103-A1121 WeakPolarHBondContact O-CA 3.21Å; A1121-T1132 CarbonylContact O-C 3.44Å; A1121-T1132 WeakPolarHBondContact O-CA 3.27Å; A1121-V1133 PolarHBondContact N-O 2.89Å; A1121-V1133 PolarHBondContact O-N 2.99Å
1122	L	90.2	Very high	81.9	Confident	4 Å²	4	27.6 Å²	27.6	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	141.5	170	-179.8	151.3	0	0	0	108.5	L441 Y455 F1102 C1103 R1105 V1130 G1131	L441-L1122 HydrophobicContact CD2-CD2 3.28Å; Y455-L1122 HydrophobicContact CD1-CD1 4.48Å; Y455-L1122 HydrophobicContact CE1-CD1 3.84Å; Y455-L1122 HydrophobicContact CE2-CD1 4.19Å; F1102-L1122 CarbonylContact C-O 3.58Å; F1102-L1122 VanDerWaalsContact CA-O 3.31Å; F1102-L1122 WeakPolarHBondContact CA-O 3.21Å; C1103-L1122 HydrophobicContact CB-CD2 4.38Å; C1103-L1122 PolarHBondContact N-O 3.34Å; C1103-L1122 PolarHBondContact O-N 3.49Å; R1105-L1122 HydrophobicContact CB-CB 4.2Å; L1122-V1130 HydrophobicContact CD1-CG1 3.55Å; L1122-V1130 HydrophobicContact CD2-CG1 3.58Å; L1122-V1130 HydrophobicContact CG-CG1 3.53Å; L1122-G1131 CarbonylContact C-O 3.51Å; L1122-G1131 VanDerWaalsContact CA-O 3.28Å; L1122-G1131 WeakPolarHBondContact CA-O 3.4Å
1123	Y	93	Very high	83.6	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	149.5	171	62.2	-87.6	0	0	0	110.6	V159 H160 D161 I1095 V1099 V1101 F1102 T1125 V1130 G1131 V1133	V159-Y1123 HydrophobicContact CG1-CE1 4.08Å; V159-Y1123 WeakPolarHBondContact CG1-OH 3.47Å; H160-Y1123 PolarHBondContact O-OH 2.94Å; D161-Y1123 WeakPolarHBondContact OD1-CE2 3.26Å; D161-Y1123 PolarHBondContact OD1-OH 3.47Å; I1095-Y1123 HydrophobicContact CD1-CD2 4.47Å; I1095-Y1123 HydrophobicContact CD1-CE2 3.86Å; I1095-Y1123 HydrophobicContact CG2-CE2 4.49Å; V1099-Y1123 HydrophobicContact CG1-CD2 4.49Å; V1099-Y1123 HydrophobicContact CG2-CD2 3.97Å; V1101-Y1123 CarbonylContact O-C 3.57Å; V1101-Y1123 VanDerWaalsContact O-CA 3.25Å; V1101-Y1123 WeakPolarHBondContact O-CA 3.39Å; F1102-Y1123 HydrophobicContact CE1-CG 4.48Å; Y1123-T1125 HydrophobicContact CD2-CG2 4.08Å; Y1123-T1125 HydrophobicContact CE2-CG2 4.3Å; Y1123-V1130 CarbonylContact O-C 3.54Å; Y1123-V1130 WeakPolarHBondContact O-CA 3.01Å; Y1123-G1131 VanDerWaalsContact CD1-C 3.47Å; Y1123-G1131 WeakPolarHBondContact CD1-O 3.19Å; Y1123-G1131 VanDerWaalsContact CE1-CA 3.48Å; Y1123-G1131 VanDerWaalsContact CZ-CA 3.44Å; Y1123-G1131 PolarHBondContact N-O 2.96Å; Y1123-G1131 PolarHBondContact O-N 3.21Å; Y1123-V1133 HydrophobicContact CD1-CG2 3.66Å; Y1123-V1133 HydrophobicContact CE1-CG2 3.64Å
1124	A	93.8	Very high	84.7	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.8	178.1	0	0	0	0	0	111.2	I438 L441 N1100 V1101 S1129 V1130	I438-A1124 HydrophobicContact CB-CB 4.1Å; I438-A1124 HydrophobicContact CD1-CB 3.86Å; I438-A1124 HydrophobicContact CG2-CB 3.64Å; L441-A1124 HydrophobicContact CD2-CB 4.1Å; N1100-A1124 PolarHBondContact N-O 3.44Å; V1101-A1124 PolarHBondContact N-O 2.97Å; V1101-A1124 PolarHBondContact O-N 3.41Å; A1124-S1129 WeakPolarHBondContact CA-O 3.41Å; A1124-V1130 HydrophobicContact CB-CG2 4.5Å
1125	T	93.8	Very high	85.3	Confident	0 Å²	0	15 Å²	15	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	157.8	-169.9	69.9	0	0	0	0	113.2	I438 Q1097 Y1098 V1099 Y1123 E1127 G1128 S1129	I438-T1125 WeakPolarHBondContact CB-O 3.42Å; I438-T1125 PolarHBondContact N-O 3.48Å; Q1097-T1125 HydrophobicContact CB-CG2 3.8Å; Q1097-T1125 PolarHBondContact OE1-OG1 3.07Å; Y1098-T1125 CarbonylContact O-C 3.6Å; Y1098-T1125 WeakPolarHBondContact O-CA 3.17Å; Y1098-T1125 WeakPolarHBondContact O-CB 3.44Å; V1099-T1125 HydrophobicContact CG2-CG2 4.19Å; Y1123-T1125 HydrophobicContact CD2-CG2 4.08Å; Y1123-T1125 HydrophobicContact CE2-CG2 4.3Å; T1125-E1127 PolarHBondContact O-N 3.33Å; T1125-G1128 PolarHBondContact O-N 3.27Å; T1125-S1129 PolarHBondContact N-O 3.36Å; T1125-S1129 WeakPolarHBondContact OG1-CB 3.35Å; T1125-S1129 PolarHBondContact OG1-N 3.5Å; T1125-S1129 PolarHBondContact OG1-O 3.07Å
1126	A	91.6	Very high	85.8	Confident	23 Å²	23	14.5 Å²	14.5	19%	0.19	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.3	173.2	0	0	0	0	0	112.1	P437 Y1098 G1128	P437-A1126 WeakPolarHBondContact CA-O 3.44Å; P437-A1126 HydrophobicContact CB-CB 4.41Å; P437-A1126 WeakPolarHBondContact CB-O 3.41Å; Y1098-A1126 HydrophobicContact CD1-CB 4.16Å; Y1098-A1126 HydrophobicContact CG-CB 4.42Å; Y1098-A1126 PolarHBondContact O-N 3.15Å; A1126-G1128 VanDerWaalsContact C-N 3.27Å
1127	E	91	Very high	86.3	Confident	48 Å²	48	15.1 Å²	15.1	22%	0.224	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-4.9	174	-66.8	69.1	-150.1	0	0	113.1	R406 A436 Y1098 T1125	R406-E1127 IonicContact NH2-OE1 3.38Å; R406-E1127 PolarHBondContact NH2-OE1 3.01Å; A436-E1127 WeakPolarHBondContact CB-O 3.44Å; Y1098-E1127 PolarHBondContact N-OE2 3.26Å; T1125-E1127 PolarHBondContact O-N 3.33Å
1128	G	89.6	Confident	87	Confident	1 Å²	1	14.5 Å²	14.5	1%	0.01	10%	0.103	C	C	.	.	S	Bend	trans	87.4	13.1	178.3	0	0	0	0	0	114.8	T1125 A1126	T1125-G1128 PolarHBondContact O-N 3.27Å; A1126-G1128 VanDerWaalsContact C-N 3.27Å
1129	S	90.3	Very high	87.8	Confident	1 Å²	1	14.1 Å²	14.1	1%	0.007	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	151.7	172	-45.3	0	0	0	0	110.9	H162 T163 Q1097 A1124 T1125	H162-S1129 WeakPolarHBondContact O-CA 3.3Å; H162-S1129 WeakPolarHBondContact O-CB 3.37Å; T163-S1129 VanDerWaalsContact CG2-OG 3.23Å; T163-S1129 WeakPolarHBondContact CG2-OG 3.41Å; Q1097-S1129 VanDerWaalsContact CD-OG 3.27Å; Q1097-S1129 PolarHBondContact NE2-OG 3.44Å; Q1097-S1129 PolarHBondContact OE1-OG 2.93Å; A1124-S1129 WeakPolarHBondContact CA-O 3.41Å; T1125-S1129 PolarHBondContact N-O 3.36Å; T1125-S1129 WeakPolarHBondContact OG1-CB 3.35Å; T1125-S1129 PolarHBondContact OG1-N 3.5Å; T1125-S1129 PolarHBondContact OG1-O 3.07Å
1130	V	90	Very high	88.6	Confident	21 Å²	21	11.8 Å²	11.8	13%	0.127	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	119.6	174.5	178	0	0	0	0	107.6	H162 L435 I438 L1122 Y1123 A1124	H162-V1130 WeakPolarHBondContact CA-O 3.39Å; H162-V1130 VanDerWaalsContact CB-O 3.3Å; H162-V1130 WeakPolarHBondContact CB-O 3.28Å; H162-V1130 PolarHBondContact N-O 3.02Å; H162-V1130 PolarHBondContact O-N 2.64Å; L435-V1130 HydrophobicContact CD1-CG2 4.33Å; I438-V1130 HydrophobicContact CD1-CG2 3.82Å; L1122-V1130 HydrophobicContact CD1-CG1 3.55Å; L1122-V1130 HydrophobicContact CD2-CG1 3.58Å; L1122-V1130 HydrophobicContact CG-CG1 3.53Å; Y1123-V1130 CarbonylContact O-C 3.54Å; Y1123-V1130 WeakPolarHBondContact O-CA 3.01Å; A1124-V1130 HydrophobicContact CB-CG2 4.5Å
1131	G	89.7	Confident	88.9	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	170	179.8	0	0	0	0	0	112.7	H160 L1122 Y1123	H160-G1131 CarbonylContact O-C 3.59Å; H160-G1131 WeakPolarHBondContact O-CA 3.06Å; L1122-G1131 CarbonylContact C-O 3.51Å; L1122-G1131 VanDerWaalsContact CA-O 3.28Å; L1122-G1131 WeakPolarHBondContact CA-O 3.4Å; Y1123-G1131 VanDerWaalsContact CD1-C 3.47Å; Y1123-G1131 WeakPolarHBondContact CD1-O 3.19Å; Y1123-G1131 VanDerWaalsContact CE1-CA 3.48Å; Y1123-G1131 VanDerWaalsContact CZ-CA 3.44Å; Y1123-G1131 PolarHBondContact N-O 2.96Å; Y1123-G1131 PolarHBondContact O-N 3.21Å
1132	T	88.5	Confident	88.9	Confident	4 Å²	4	13.3 Å²	13.3	3%	0.025	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	140.7	178.7	-63.9	0	0	0	0	110.9	H160 R1105 A1120 A1121	H160-T1132 PolarHBondContact N-O 3.49Å; H160-T1132 PolarHBondContact O-N 3.08Å; R1105-T1132 PolarHBondContact NH1-OG1 3.48Å; A1120-T1132 HydrophobicContact CB-CG2 4.09Å; A1121-T1132 CarbonylContact O-C 3.44Å; A1121-T1132 WeakPolarHBondContact O-CA 3.27Å
1133	V	89.7	Confident	88.9	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.5	176.6	-177.1	0	0	0	0	107.5	T157 V158 V159 V1057 L1063 L1071 A1120 A1121 Y1123	T157-V1133 HydrophobicContact CG2-CG1 3.21Å; V158-V1133 WeakPolarHBondContact O-CA 3.25Å; V159-V1133 HydrophobicContact CG2-CG2 4.32Å; V1057-V1133 HydrophobicContact CG2-CG1 4.15Å; L1063-V1133 HydrophobicContact CD1-CB 4.06Å; L1063-V1133 HydrophobicContact CD1-CG1 3.98Å; L1063-V1133 HydrophobicContact CD1-CG2 4.33Å; L1063-V1133 HydrophobicContact CD2-CG1 3.92Å; L1071-V1133 HydrophobicContact CD2-CG2 3.86Å; A1120-V1133 CarbonylContact C-O 3.57Å; A1120-V1133 WeakPolarHBondContact CA-O 3.49Å; A1121-V1133 PolarHBondContact N-O 2.89Å; A1121-V1133 PolarHBondContact O-N 2.99Å; Y1123-V1133 HydrophobicContact CD1-CG2 3.66Å; Y1123-V1133 HydrophobicContact CE1-CG2 3.64Å
1134	C	86.5	Confident	88.8	Confident	1 Å²	1	13.3 Å²	13.3	1%	0.007	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.4	178.9	62.5	0	0	0	0	111.5	T157 V158 V1116 A1120 M1236	T157-C1134 CarbonylContact C-O 3.5Å; T157-C1134 WeakPolarHBondContact CA-O 3.1Å; T157-C1134 VanDerWaalsContact CG2-O 3.24Å; T157-C1134 WeakPolarHBondContact CG2-O 3.46Å; V158-C1134 PolarHBondContact N-O 3.13Å; V158-C1134 PolarHBondContact O-N 2.89Å; V1116-C1134 HydrophobicContact CG1-CB 4.07Å; A1120-C1134 HydrophobicContact CB-CB 3.97Å; C1134-M1236 VanDerWaalsContact SG-CE 3.56Å
1135	L	85.4	Confident	88.6	Confident	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	120.3	176.2	-66.5	167.9	0	0	0	109.7	K155 A156 T157 V1057 V1061 V1116 N1117	K155-L1135 HydrophobicContact CB-CD2 4.22Å; K155-L1135 HydrophobicContact CD-CD1 4.44Å; A156-L1135 CarbonylContact O-C 3.59Å; A156-L1135 VanDerWaalsContact O-CA 3.32Å; A156-L1135 WeakPolarHBondContact O-CA 3.25Å; T157-L1135 HydrophobicContact CG2-CD2 4.26Å; T157-L1135 VanDerWaalsContact OG1-CD2 3.3Å; T157-L1135 WeakPolarHBondContact OG1-CD2 3.05Å; V1057-L1135 HydrophobicContact CB-CD1 4Å; V1057-L1135 HydrophobicContact CB-CG 4.17Å; V1057-L1135 HydrophobicContact CG1-CD1 3.74Å; V1057-L1135 HydrophobicContact CG1-CG 3.7Å; V1061-L1135 HydrophobicContact CB-CD1 4.24Å; V1061-L1135 HydrophobicContact CG1-CD1 4.45Å; V1061-L1135 HydrophobicContact CG1-CD2 4.05Å; V1061-L1135 HydrophobicContact CG2-CD1 4.16Å; V1116-L1135 CarbonylContact C-O 3.32Å; V1116-L1135 VanDerWaalsContact CA-O 3.29Å; V1116-L1135 WeakPolarHBondContact CA-O 3.4Å; V1116-L1135 WeakPolarHBondContact CG1-O 3.21Å; N1117-L1135 HydrophobicContact CB-CB 4.46Å; N1117-L1135 PolarHBondContact N-O 2.9Å
1136	L	85.7	Confident	88.5	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	151.6	171.6	-67.3	-178.8	0	0	0	111.4	A156 V158 I1115 F1141 F1144 M1236	A156-L1136 PolarHBondContact O-N 2.87Å; V158-L1136 HydrophobicContact CG2-CD1 3.21Å; V158-L1136 HydrophobicContact CG2-CD2 3.95Å; V158-L1136 HydrophobicContact CG2-CG 3.5Å; V158-L1136 VanDerWaalsContact CG2-CG 3.5Å; I1115-L1136 HydrophobicContact CG2-CD2 4.14Å; I1115-L1136 WeakPolarHBondContact O-CA 3.4Å; L1136-F1141 HydrophobicContact CB-CB 4.21Å; L1136-F1141 HydrophobicContact CD1-CB 4.27Å; L1136-F1144 HydrophobicContact CD1-CB 4.21Å; L1136-F1144 HydrophobicContact CD1-CD2 3.54Å; L1136-F1144 HydrophobicContact CD1-CE2 4.31Å; L1136-F1144 HydrophobicContact CD1-CG 4.22Å; L1136-F1144 HydrophobicContact CD2-CD2 4.15Å; L1136-F1144 HydrophobicContact CD2-CE2 4.08Å; L1136-M1236 HydrophobicContact CD2-CE 4.28Å
1137	T	85.2	Confident	88.4	Confident	22 Å²	22	15.8 Å²	15.8	14%	0.135	8%	0.084	C	C	.	.	P	Polyproline II helix	trans	-67.8	149.8	162.9	63.1	0	0	0	0	110.1	E1114 I1115 N1117 R1139 Y1140 F1141	E1114-T1137 WeakPolarHBondContact O-CG2 3.35Å; E1114-T1137 PolarHBondContact O-OG1 3.3Å; I1115-T1137 PolarHBondContact O-N 3.31Å; N1117-T1137 HydrophobicContact CB-CG2 4.2Å; T1137-R1139 PolarHBondContact O-N 3.5Å; T1137-R1139 VanDerWaalsContact O-N 3.09Å; T1137-Y1140 PolarHBondContact O-N 2.92Å; T1137-Y1140 VanDerWaalsContact O-N 3.11Å; T1137-Y1140 WeakPolarHBondContact OG1-CD2 3.29Å; T1137-F1141 PolarHBondContact O-N 3.18Å
1138	P	84	Confident	88.3	Confident	58 Å²	58	13.8 Å²	13.8	38%	0.377	8%	0.075	S	C	.	.	H	α-helix	trans	-54.2	-35.1	-176.7	-28	35	0	0	0	113.7	F1141 S1142 Y1217	P1138-F1141 PolarHBondContact O-N 2.82Å; P1138-S1142 PolarHBondContact O-N 2.86Å; P1138-S1142 PolarHBondContact O-OG 2.82Å; P1138-Y1217 PolarHBondContact O-OH 3.13Å
1139	R	85.4	Confident	88.2	Confident	47 Å²	47	17.3 Å²	17.3	18%	0.177	9%	0.093	C	C	.	.	H	α-helix	trans	-62.4	-50.3	178.5	-163.5	-158.4	166.5	-178.5	-6.8	111.8	E1114 T1137 L1143 Y1217 S1223 F1224	E1114-R1139 IonicContact OE1-NH1 3.61Å; T1137-R1139 PolarHBondContact O-N 3.5Å; T1137-R1139 VanDerWaalsContact O-N 3.09Å; R1139-L1143 PolarHBondContact O-N 2.88Å; R1139-Y1217 HydrophobicContact CG-CE1 4.36Å; R1139-Y1217 HydrophobicContact CG-CE2 4.5Å; R1139-S1223 PolarHBondContact NH2-O 2.98Å; R1139-F1224 HydrophobicContact CG-CE2 3.89Å; R1139-F1224 HydrophobicContact CG-CZ 3.54Å
1140	Y	87.7	Confident	88.2	Confident	14 Å²	14	17.7 Å²	17.7	6%	0.055	10%	0.096	C	C	.	.	H	α-helix	trans	-74.2	-30.1	179.6	-78.7	-87.4	0	0	0	111.9	E1114 I1115 T1137 L1143 F1144 F1224 V1232	E1114-Y1140 HydrophobicContact CB-CE2 4.48Å; E1114-Y1140 HydrophobicContact CG-CE2 3.99Å; E1114-Y1140 VanDerWaalsContact O-CD2 3.32Å; E1114-Y1140 WeakPolarHBondContact O-CD2 3.25Å; E1114-Y1140 WeakPolarHBondContact O-CE2 3.35Å; E1114-Y1140 PolarHBondContact OE1-OH 2.89Å; I1115-Y1140 HydrophobicContact CB-CD2 4.34Å; I1115-Y1140 HydrophobicContact CB-CE2 4.44Å; I1115-Y1140 HydrophobicContact CB-CG 4.4Å; I1115-Y1140 HydrophobicContact CG1-CD1 4.15Å; I1115-Y1140 HydrophobicContact CG1-CD2 4.16Å; I1115-Y1140 HydrophobicContact CG1-CE1 3.81Å; I1115-Y1140 HydrophobicContact CG1-CE2 3.81Å; I1115-Y1140 HydrophobicContact CG1-CG 4.32Å; I1115-Y1140 HydrophobicContact CG2-CD1 4.1Å; I1115-Y1140 HydrophobicContact CG2-CD2 4.48Å; I1115-Y1140 HydrophobicContact CG2-CG 4.04Å; T1137-Y1140 PolarHBondContact O-N 2.92Å; T1137-Y1140 VanDerWaalsContact O-N 3.11Å; T1137-Y1140 WeakPolarHBondContact OG1-CD2 3.29Å; Y1140-L1143 HydrophobicContact CD1-CD2 4.17Å; Y1140-L1143 HydrophobicContact CE1-CD2 4.47Å; Y1140-L1143 PolarHBondContact O-N 2.92Å; Y1140-F1144 HydrophobicContact CD1-CE2 4.15Å; Y1140-F1144 WeakPolarHBondContact O-CB 3.32Å; Y1140-F1144 WeakPolarHBondContact O-CD2 3.22Å; Y1140-F1144 PolarHBondContact O-N 3.23Å; Y1140-F1224 HydrophobicContact CD1-CE1 4.34Å; Y1140-F1224 AromaticContact CE1-CE1 3.89Å; Y1140-F1224 HydrophobicContact CE1-CE1 3.89Å; Y1140-F1224 HydrophobicContact CE2-CE1 4.46Å; Y1140-F1224 AromaticContact CZ-CE1 3.98Å; Y1140-V1232 HydrophobicContact CD1-CG1 4.41Å; Y1140-V1232 HydrophobicContact CE1-CG1 4.01Å; Y1140-V1232 HydrophobicContact CE1-CG2 4.45Å
1141	F	88.4	Confident	88.1	Confident	13 Å²	13	16.7 Å²	16.7	6%	0.057	9%	0.09	C	C	.	.	H	α-helix	trans	-57.9	-49.7	172.5	173.6	-104.1	0	0	0	112.3	A156 L1136 T1137 P1138 L1143 F1144 K1145 S1183 V1186	A156-F1141 HydrophobicContact CB-CB 3.7Å; A156-F1141 HydrophobicContact CB-CD1 3.79Å; A156-F1141 HydrophobicContact CB-CD2 3.13Å; A156-F1141 HydrophobicContact CB-CE1 4.23Å; A156-F1141 HydrophobicContact CB-CE2 3.62Å; A156-F1141 HydrophobicContact CB-CG 3.21Å; A156-F1141 HydrophobicContact CB-CZ 4.15Å; L1136-F1141 HydrophobicContact CB-CB 4.21Å; L1136-F1141 HydrophobicContact CD1-CB 4.27Å; T1137-F1141 PolarHBondContact O-N 3.18Å; P1138-F1141 PolarHBondContact O-N 2.82Å; F1141-L1143 VanDerWaalsContact C-N 3.3Å; F1141-L1143 PolarHBondContact O-N 3.05Å; F1141-F1144 PolarHBondContact O-N 2.6Å; F1141-K1145 HydrophobicContact CE2-CD 4.43Å; F1141-K1145 HydrophobicContact CZ-CB 4.39Å; F1141-K1145 HydrophobicContact CZ-CD 4.25Å; F1141-K1145 HydrophobicContact CZ-CG 4.37Å; F1141-K1145 VanDerWaalsContact O-CB 3.31Å; F1141-K1145 WeakPolarHBondContact O-CB 3.5Å; F1141-K1145 PolarHBondContact O-N 3.48Å; F1141-S1183 WeakPolarHBondContact CZ-O 3.34Å; F1141-V1186 HydrophobicContact CD2-CG2 3.73Å; F1141-V1186 HydrophobicContact CE2-CG2 3.68Å
1142	S	88.4	Confident	87.8	Confident	22 Å²	22	18.8 Å²	18.8	15%	0.154	10%	0.1	C	C	.	.	H	α-helix	trans	-58.2	-43.6	177.5	-58.6	0	0	0	0	111.9	P1138 T1146 Y1217	P1138-S1142 PolarHBondContact O-N 2.86Å; P1138-S1142 PolarHBondContact O-OG 2.82Å; S1142-T1146 WeakPolarHBondContact O-CB 3.28Å; S1142-T1146 PolarHBondContact O-N 2.89Å; S1142-T1146 PolarHBondContact O-OG1 3.38Å; S1142-Y1217 PolarHBondContact OG-OH 2.8Å; S1142-Y1217 VanDerWaalsContact OG-OH 3.07Å
1143	L	90.2	Very high	87.5	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-53	175.9	177.2	67	0	0	0	111.7	R1139 Y1140 F1141 K1145 T1146 L1147 V1210 T1213 F1224 V1229	R1139-L1143 PolarHBondContact O-N 2.88Å; Y1140-L1143 HydrophobicContact CD1-CD2 4.17Å; Y1140-L1143 HydrophobicContact CE1-CD2 4.47Å; Y1140-L1143 PolarHBondContact O-N 2.92Å; F1141-L1143 VanDerWaalsContact C-N 3.3Å; F1141-L1143 PolarHBondContact O-N 3.05Å; L1143-K1145 VanDerWaalsContact C-N 3.33Å; L1143-K1145 PolarHBondContact O-N 2.98Å; L1143-T1146 PolarHBondContact O-N 3.14Å; L1143-L1147 HydrophobicContact CD1-CD1 4.45Å; L1143-L1147 HydrophobicContact CG-CD1 4.18Å; L1143-L1147 PolarHBondContact O-N 2.89Å; L1143-V1210 HydrophobicContact CD1-CG2 4.37Å; L1143-T1213 HydrophobicContact CB-CG2 4.11Å; L1143-T1213 HydrophobicContact CD1-CG2 4.25Å; L1143-F1224 HydrophobicContact CB-CE2 4.3Å; L1143-F1224 HydrophobicContact CB-CZ 4.24Å; L1143-F1224 HydrophobicContact CD2-CD1 4.04Å; L1143-F1224 HydrophobicContact CD2-CE1 3.85Å; L1143-F1224 HydrophobicContact CD2-CE2 4.48Å; L1143-F1224 HydrophobicContact CD2-CG 4.4Å; L1143-F1224 HydrophobicContact CD2-CZ 4.03Å; L1143-V1229 HydrophobicContact CD1-CG2 4.34Å; L1143-V1229 HydrophobicContact CD2-CB 4.47Å; L1143-V1229 HydrophobicContact CD2-CG1 3.96Å; L1143-V1229 HydrophobicContact CD2-CG2 3.64Å
1144	F	90.5	Very high	87.2	Confident	3 Å²	3	28.1 Å²	28.1	1%	0.013	15%	0.152	C	C	.	.	H	α-helix	trans	-65.4	-35.6	-177.9	-81.5	-63.3	0	0	0	112.5	I1115 L1136 Y1140 F1141 L1147 E1148 V1186 I1191 V1232 V1233 M1236	I1115-F1144 HydrophobicContact CG2-CE2 4.35Å; L1136-F1144 HydrophobicContact CD1-CB 4.21Å; L1136-F1144 HydrophobicContact CD1-CD2 3.54Å; L1136-F1144 HydrophobicContact CD1-CE2 4.31Å; L1136-F1144 HydrophobicContact CD1-CG 4.22Å; L1136-F1144 HydrophobicContact CD2-CD2 4.15Å; L1136-F1144 HydrophobicContact CD2-CE2 4.08Å; Y1140-F1144 HydrophobicContact CD1-CE2 4.15Å; Y1140-F1144 WeakPolarHBondContact O-CB 3.32Å; Y1140-F1144 WeakPolarHBondContact O-CD2 3.22Å; Y1140-F1144 PolarHBondContact O-N 3.23Å; F1141-F1144 PolarHBondContact O-N 2.6Å; F1144-L1147 HydrophobicContact CD1-CD1 4.26Å; F1144-L1147 PolarHBondContact O-N 2.89Å; F1144-E1148 WeakPolarHBondContact O-CB 3.45Å; F1144-E1148 PolarHBondContact O-N 2.77Å; F1144-V1186 HydrophobicContact CB-CG1 3.97Å; F1144-V1186 HydrophobicContact CB-CG2 4.05Å; F1144-I1191 HydrophobicContact CD1-CD1 4.35Å; F1144-I1191 HydrophobicContact CD1-CG1 4.2Å; F1144-I1191 HydrophobicContact CD1-CG2 3.91Å; F1144-I1191 HydrophobicContact CE1-CG2 3.9Å; F1144-I1191 WeakPolarHBondContact O-CD1 3.36Å; F1144-V1232 HydrophobicContact CZ-CG1 4.36Å; F1144-V1233 HydrophobicContact CE1-CG2 3.96Å; F1144-M1236 HydrophobicContact CE1-SD 4.43Å; F1144-M1236 HydrophobicContact CE2-SD 4.19Å; F1144-M1236 HydrophobicContact CZ-SD 3.75Å
1145	K	89.5	Confident	86.7	Confident	40 Å²	40	29.1 Å²	29.1	17%	0.174	16%	0.159	C	C	.	.	H	α-helix	trans	-66.8	-39.3	175.1	-164.2	69.6	-177.4	167.1	0	111.7	F1141 L1143 E1148 L1149 C1182 I1185 V1186	F1141-K1145 HydrophobicContact CE2-CD 4.43Å; F1141-K1145 HydrophobicContact CZ-CB 4.39Å; F1141-K1145 HydrophobicContact CZ-CD 4.25Å; F1141-K1145 HydrophobicContact CZ-CG 4.37Å; F1141-K1145 VanDerWaalsContact O-CB 3.31Å; F1141-K1145 WeakPolarHBondContact O-CB 3.5Å; F1141-K1145 PolarHBondContact O-N 3.48Å; L1143-K1145 VanDerWaalsContact C-N 3.33Å; L1143-K1145 PolarHBondContact O-N 2.98Å; K1145-E1148 VanDerWaalsContact CD-OE2 3.31Å; K1145-E1148 WeakPolarHBondContact CD-OE2 3.17Å; K1145-E1148 VanDerWaalsContact CE-OE2 3.31Å; K1145-E1148 WeakPolarHBondContact CE-OE2 3.33Å; K1145-E1148 IonicContact NZ-OE2 3.14Å; K1145-E1148 PolarHBondContact NZ-OE2 2.86Å; K1145-E1148 PolarHBondContact O-N 3.15Å; K1145-L1149 WeakPolarHBondContact O-CG 3.45Å; K1145-L1149 PolarHBondContact O-N 3.47Å; K1145-L1149 VanDerWaalsContact O-N 3.15Å; K1145-C1182 PolarHBondContact NZ-O 3.43Å; K1145-I1185 PolarHBondContact NZ-O 3.46Å; K1145-V1186 HydrophobicContact CB-CG2 4.38Å; K1145-V1186 HydrophobicContact CD-CG2 4.22Å
1146	T	90.4	Very high	85.9	Confident	34 Å²	34	34.2 Å²	34.2	21%	0.209	19%	0.194	C	C	.	.	H	α-helix	trans	-65.6	-41.3	174.6	-52.5	0	0	0	0	111.1	S1142 L1143 L1149 A1150 A1209 L1212	S1142-T1146 WeakPolarHBondContact O-CB 3.28Å; S1142-T1146 PolarHBondContact O-N 2.89Å; S1142-T1146 PolarHBondContact O-OG1 3.38Å; L1143-T1146 PolarHBondContact O-N 3.14Å; T1146-L1149 PolarHBondContact O-N 3.19Å; T1146-A1150 WeakPolarHBondContact O-CB 3.21Å; T1146-A1150 PolarHBondContact O-N 2.99Å; T1146-A1209 HydrophobicContact CG2-CB 4.05Å; T1146-L1212 HydrophobicContact CG2-CB 4.04Å
1147	L	90.6	Very high	85	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.3	-45	173.4	-79.3	167.2	0	0	0	112.2	L1143 F1144 L1149 A1150 I1151 I1191 L1194 I1205 L1206 A1209 V1229	L1143-L1147 HydrophobicContact CD1-CD1 4.45Å; L1143-L1147 HydrophobicContact CG-CD1 4.18Å; L1143-L1147 PolarHBondContact O-N 2.89Å; F1144-L1147 HydrophobicContact CD1-CD1 4.26Å; F1144-L1147 PolarHBondContact O-N 2.89Å; L1147-L1149 PolarHBondContact O-N 3.4Å; L1147-A1150 PolarHBondContact O-N 3.39Å; L1147-I1151 WeakPolarHBondContact O-CB 3.22Å; L1147-I1151 WeakPolarHBondContact O-CD1 3.38Å; L1147-I1151 WeakPolarHBondContact O-CG1 3.39Å; L1147-I1151 PolarHBondContact O-N 3.33Å; L1147-I1191 HydrophobicContact CB-CD1 3.89Å; L1147-L1194 HydrophobicContact CD2-CD2 4.28Å; L1147-I1205 HydrophobicContact CD2-CG2 4.43Å; L1147-L1206 HydrophobicContact CD2-CD2 4.16Å; L1147-A1209 HydrophobicContact CD2-CB 3.54Å; L1147-A1209 HydrophobicContact CG-CB 3.84Å; L1147-V1229 HydrophobicContact CD1-CG1 4.08Å
1148	E	89.3	Confident	84.1	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-55.4	-50.4	177.4	-173.2	-171.6	-138.2	0	0	111	F1144 K1145 I1151 M1152 D1187 V1190 I1191	F1144-E1148 WeakPolarHBondContact O-CB 3.45Å; F1144-E1148 PolarHBondContact O-N 2.77Å; K1145-E1148 VanDerWaalsContact CD-OE2 3.31Å; K1145-E1148 WeakPolarHBondContact CD-OE2 3.17Å; K1145-E1148 VanDerWaalsContact CE-OE2 3.31Å; K1145-E1148 WeakPolarHBondContact CE-OE2 3.33Å; K1145-E1148 IonicContact NZ-OE2 3.14Å; K1145-E1148 PolarHBondContact NZ-OE2 2.86Å; K1145-E1148 PolarHBondContact O-N 3.15Å; E1148-I1151 PolarHBondContact O-N 2.54Å; E1148-M1152 HydrophobicContact CG-CE 4.02Å; E1148-M1152 WeakPolarHBondContact O-CG 3.16Å; E1148-M1152 PolarHBondContact O-N 2.72Å; E1148-D1187 VanDerWaalsContact OE1-CB 3.29Å; E1148-D1187 WeakPolarHBondContact OE1-CB 3.39Å; E1148-D1187 PolarHBondContact OE1-N 3.48Å; E1148-V1190 HydrophobicContact CG-CB 4.25Å; E1148-V1190 HydrophobicContact CG-CG1 4.04Å; E1148-I1191 HydrophobicContact CB-CD1 3.92Å
1149	L	87.5	Confident	83.2	Confident	75 Å²	75	45.1 Å²	45.1	39%	0.393	26%	0.256	S	S	.	.	H	α-helix	trans	-61.4	-46.1	177.8	-68.7	170.6	0	0	0	111.7	K1145 T1146 L1147 I1151 M1152 M1153	K1145-L1149 WeakPolarHBondContact O-CG 3.45Å; K1145-L1149 PolarHBondContact O-N 3.47Å; K1145-L1149 VanDerWaalsContact O-N 3.15Å; T1146-L1149 PolarHBondContact O-N 3.19Å; L1147-L1149 PolarHBondContact O-N 3.4Å; L1149-I1151 VanDerWaalsContact C-N 3.34Å; L1149-I1151 PolarHBondContact O-N 2.98Å; L1149-M1152 HydrophobicContact CD2-CE 3.81Å; L1149-M1152 PolarHBondContact O-N 3.4Å; L1149-M1153 WeakPolarHBondContact O-CG 3.39Å; L1149-M1153 PolarHBondContact O-N 2.73Å
1150	A	88.8	Confident	82.4	Confident	8 Å²	8	50 Å²	50	7%	0.066	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-40.4	179.5	0	0	0	0	0	112.1	T1146 L1147 M1153 A1154 I1205	T1146-A1150 WeakPolarHBondContact O-CB 3.21Å; T1146-A1150 PolarHBondContact O-N 2.99Å; L1147-A1150 PolarHBondContact O-N 3.39Å; A1150-M1153 PolarHBondContact O-N 3.26Å; A1150-A1154 WeakPolarHBondContact O-CB 3.22Å; A1150-A1154 PolarHBondContact O-N 2.94Å; A1150-I1205 HydrophobicContact CB-CG2 3.91Å
1151	I	88.2	Confident	81.4	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-66.2	-43.7	176.3	-66.5	162.4	0	0	0	110.7	L1147 E1148 L1149 M1153 A1154 C1155 V1190 I1191 L1194 I1205	L1147-I1151 WeakPolarHBondContact O-CB 3.22Å; L1147-I1151 WeakPolarHBondContact O-CD1 3.38Å; L1147-I1151 WeakPolarHBondContact O-CG1 3.39Å; L1147-I1151 PolarHBondContact O-N 3.33Å; E1148-I1151 PolarHBondContact O-N 2.54Å; L1149-I1151 VanDerWaalsContact C-N 3.34Å; L1149-I1151 PolarHBondContact O-N 2.98Å; I1151-M1153 VanDerWaalsContact C-N 3.29Å; I1151-M1153 PolarHBondContact O-N 3.33Å; I1151-A1154 PolarHBondContact O-N 3.17Å; I1151-C1155 VanDerWaalsContact O-CB 3.32Å; I1151-C1155 WeakPolarHBondContact O-CB 3.29Å; I1151-C1155 PolarHBondContact O-N 3.49Å; I1151-C1155 PolarHBondContact O-SG 2.82Å; I1151-C1155 VanDerWaalsContact O-SG 3.38Å; I1151-V1190 HydrophobicContact CB-CG1 3.96Å; I1151-V1190 HydrophobicContact CG2-CG1 3.69Å; I1151-I1191 HydrophobicContact CD1-CD1 4.2Å; I1151-L1194 HydrophobicContact CD1-CB 3.84Å; I1151-L1194 HydrophobicContact CD1-CD1 4.24Å; I1151-L1194 HydrophobicContact CD1-CG 4.47Å; I1151-L1194 HydrophobicContact CG1-CD1 4.22Å; I1151-I1205 HydrophobicContact CG1-CG2 3.9Å
1152	M	84	Confident	80.7	Confident	44 Å²	44	60.2 Å²	60.2	22%	0.217	34%	0.339	C	S	.	.	H	α-helix	trans	-64	-33.6	177.7	-73.6	-168.8	-63	0	0	112.8	E1148 L1149 H1163 V1190	E1148-M1152 HydrophobicContact CG-CE 4.02Å; E1148-M1152 WeakPolarHBondContact O-CG 3.16Å; E1148-M1152 PolarHBondContact O-N 2.72Å; L1149-M1152 HydrophobicContact CD2-CE 3.81Å; L1149-M1152 PolarHBondContact O-N 3.4Å; M1152-H1163 HydrophobicContact SD-CB 3.97Å; M1152-H1163 PolarHBondContact SD-CD2 3.44Å; M1152-V1190 HydrophobicContact CG-CG1 4.05Å
1153	M	82.8	Confident	80.3	Confident	160 Å²	160	60.6 Å²	60.6	79%	0.788	34%	0.339	S	S	*	.	H	α-helix	trans	-73	-35.7	174.4	-67.9	-176.9	95.2	0	0	112.1	L1149 A1150 I1151	L1149-M1153 WeakPolarHBondContact O-CG 3.39Å; L1149-M1153 PolarHBondContact O-N 2.73Å; A1150-M1153 PolarHBondContact O-N 3.26Å; I1151-M1153 VanDerWaalsContact C-N 3.29Å; I1151-M1153 PolarHBondContact O-N 3.33Å
1154	A	82.4	Confident	79.7	Confident	39 Å²	39	62.9 Å²	62.9	32%	0.322	36%	0.355	S	S	.	.	H	α-helix	trans	-81.2	-28.5	-177.5	0	0	0	0	0	113.8	A1150 I1151 Q1201 I1205	A1150-A1154 WeakPolarHBondContact O-CB 3.22Å; A1150-A1154 PolarHBondContact O-N 2.94Å; I1151-A1154 PolarHBondContact O-N 3.17Å; A1154-Q1201 PolarHBondContact O-NE2 3.34Å; A1154-I1205 HydrophobicContact CB-CD1 3.55Å; A1154-I1205 HydrophobicContact CB-CG1 3.87Å
1155	C	75.9	Confident	79.2	Confident	23 Å²	23	69.9 Å²	69.9	16%	0.155	38%	0.382	C	S	.	.	S	Bend	trans	-105.7	123.7	-176.8	-58.2	0	0	0	0	110.7	I1151 N1157	I1151-C1155 VanDerWaalsContact O-CB 3.32Å; I1151-C1155 WeakPolarHBondContact O-CB 3.29Å; I1151-C1155 PolarHBondContact O-N 3.49Å; I1151-C1155 PolarHBondContact O-SG 2.82Å; I1151-C1155 VanDerWaalsContact O-SG 3.38Å; C1155-N1157 PolarHBondContact O-N 3.29Å
1156	S	68.8	Low	78.7	Confident	107 Å²	107	72.6 Å²	72.6	75%	0.748	39%	0.394	S	S	*	.			trans	-64.4	134.4	173.6	56.7	0	0	0	0	111.2
1157	N	67.7	Low	78.4	Confident	60 Å²	60	71.9 Å²	71.9	32%	0.321	39%	0.388	S	S	.	.			trans	-61.9	147.9	170.6	-68.3	-22.6	0	0	0	110.7	C1155 G1159 F1161	C1155-N1157 PolarHBondContact O-N 3.29Å; N1157-G1159 PolarHBondContact O-N 2.91Å; N1157-F1161 WeakPolarHBondContact CB-O 3.17Å; N1157-F1161 PolarHBondContact ND2-O 3.19Å
1158	F	64.8	Low	77.7	Confident	184 Å²	184	76.9 Å²	76.9	81%	0.807	41%	0.407	S	S	*	.	S	Bend	trans	-73	112.9	171.1	-78.2	-83.8	0	0	0	109.3
1159	G	67	Low	76.7	Confident	66 Å²	66	77.3 Å²	77.3	68%	0.68	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	-145.5	-177.7	0	0	0	0	0	112.9	N1157	N1157-G1159 PolarHBondContact O-N 2.91Å
1160	V	67.2	Low	75.5	Confident	148 Å²	148	77.2 Å²	77.2	90%	0.897	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	6.9	-173.7	-134.6	0	0	0	0	112.7
1161	F	67.2	Low	74	Confident	159 Å²	159	80.6 Å²	80.6	70%	0.697	43%	0.428	S	S	*	.			trans	-83.7	127.2	-173.5	-59.1	-72.8	0	0	0	110.8	N1157	N1157-F1161 WeakPolarHBondContact CB-O 3.17Å; N1157-F1161 PolarHBondContact ND2-O 3.19Å
1162	D	74.7	Confident	72	Confident	83 Å²	83	84.9 Å²	84.9	44%	0.444	45%	0.451	S	S	.	.			trans	-76.9	128.7	169.9	178.4	20.2	0	0	0	109.9	S1164 Y1165 F1166	D1162-S1164 VanDerWaalsContact C-N 3.33Å; D1162-S1164 PolarHBondContact O-N 2.97Å; D1162-S1164 PolarHBondContact OD1-N 2.9Å; D1162-Y1165 WeakPolarHBondContact O-CB 3.24Å; D1162-Y1165 PolarHBondContact O-N 2.79Å; D1162-F1166 PolarHBondContact O-N 3.33Å
1163	H	78.9	Confident	69.9	Low	30 Å²	30	90.1 Å²	90.1	14%	0.139	48%	0.48	C	S	.	.	H	α-helix	trans	-61.7	-42.8	179.2	179.1	82.4	0	0	0	111.4	M1152 Y1165 F1166 R1167 D1187	M1152-H1163 HydrophobicContact SD-CB 3.97Å; M1152-H1163 PolarHBondContact SD-CD2 3.44Å; H1163-Y1165 PolarHBondContact O-N 3.24Å; H1163-F1166 PolarHBondContact O-N 2.94Å; H1163-R1167 WeakPolarHBondContact NE2-CG 3.06Å; H1163-R1167 PolarHBondContact O-N 3.4Å; H1163-D1187 IonicContact CE1-OD2 2.65Å; H1163-D1187 PolarHBondContact CE1-OD2 2.75Å; H1163-D1187 IonicContact NE2-OD2 2.83Å
1164	S	77.9	Confident	68.3	Low	49 Å²	49	89.8 Å²	89.8	34%	0.343	47%	0.474	S	S	.	.	H	α-helix	trans	-65.2	-30.5	179.2	-57.8	0	0	0	0	111.9	D1162 R1168	D1162-S1164 VanDerWaalsContact C-N 3.33Å; D1162-S1164 PolarHBondContact O-N 2.97Å; D1162-S1164 PolarHBondContact OD1-N 2.9Å; S1164-R1168 PolarHBondContact O-N 3.01Å
1165	Y	78.8	Confident	66.3	Low	150 Å²	150	98.2 Å²	98.2	59%	0.588	50%	0.497	S	S	*	.	H	α-helix	trans	-70.8	-44.3	172.6	-173.9	-96.7	0	0	0	111.9	D1162 H1163 R1168	D1162-Y1165 WeakPolarHBondContact O-CB 3.24Å; D1162-Y1165 PolarHBondContact O-N 2.79Å; H1163-Y1165 PolarHBondContact O-N 3.24Å; Y1165-R1168 WeakPolarHBondContact O-CB 3.37Å; Y1165-R1168 PolarHBondContact O-N 2.88Å
1166	F	79.5	Confident	64.4	Low	97 Å²	97	104 Å²	104	43%	0.425	52%	0.522	S	S	.	.	H	α-helix	trans	-64.1	-43.7	178.8	174.8	-105.2	0	0	0	112.7	H1094 D1162 H1163 R1168	H1094-F1166 WeakPolarHBondContact CB-O 3.03Å; H1094-F1166 AromaticContact CD2-CE2 3.88Å; H1094-F1166 PolarHBondContact CD2-O 2.78Å; D1162-F1166 PolarHBondContact O-N 3.33Å; H1163-F1166 PolarHBondContact O-N 2.94Å; F1166-R1168 PolarHBondContact O-N 2.77Å
1167	R	83.9	Confident	62.8	Low	19 Å²	19	105.1 Å²	105.1	7%	0.072	52%	0.524	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.6	-178.5	-67.6	-53.3	-164.1	-178.6	7.2	114.4	F1093 H1094 I1095 H1163 A1169 C1182 D1187 N1189	F1093-R1167 HydrophobicContact CD2-CB 4.26Å; F1093-R1167 HydrophobicContact CE2-CB 3.94Å; F1093-R1167 HydrophobicContact CE2-CG 3.8Å; F1093-R1167 HydrophobicContact CZ-CG 4.04Å; F1093-R1167 VanDerWaalsContact CZ-NE 3.27Å; H1094-R1167 PolarHBondContact N-O 2.65Å; H1094-R1167 WeakPolarHBondContact O-CD 3.4Å; H1094-R1167 PolarHBondContact O-NH1 2.97Å; I1095-R1167 PolarHBondContact O-NH1 3.34Å; H1163-R1167 WeakPolarHBondContact NE2-CG 3.06Å; H1163-R1167 PolarHBondContact O-N 3.4Å; R1167-A1169 PolarHBondContact O-N 3.34Å; R1167-C1182 PolarHBondContact O-SG 2.81Å; R1167-D1187 IonicContact CZ-OD2 3.5Å; R1167-D1187 IonicContact NE-OD2 2.84Å; R1167-D1187 PolarHBondContact NE-OD2 3.43Å; R1167-D1187 IonicContact NH2-OD1 3.31Å; R1167-D1187 IonicContact NH2-OD2 3.01Å; R1167-D1187 PolarHBondContact NH2-OD2 3.07Å; R1167-N1189 PolarHBondContact NH2-ND2 3.45Å
1168	R	77.2	Confident	61.5	Low	105 Å²	105	109 Å²	109	40%	0.396	55%	0.545	S	S	.	.	S	Bend	trans	-66.8	118.2	177.1	-173.8	-176.8	-58.6	169.8	2	110	S1164 Y1165 F1166 V1170 C1181	S1164-R1168 PolarHBondContact O-N 3.01Å; Y1165-R1168 WeakPolarHBondContact O-CB 3.37Å; Y1165-R1168 PolarHBondContact O-N 2.88Å; F1166-R1168 PolarHBondContact O-N 2.77Å; R1168-V1170 PolarHBondContact O-N 3.15Å; R1168-C1181 VanDerWaalsContact CZ-SG 3.55Å; R1168-C1181 PolarHBondContact NE-SG 3.4Å; R1168-C1181 PolarHBondContact NH2-SG 2.89Å
1169	A	67.3	Low	60.4	Low	16 Å²	16	106.7 Å²	106.7	13%	0.132	55%	0.546	C	S	.	.			trans	-63.3	133	169.4	0	0	0	0	0	109.9	N1070 Y1072 R1167 E1171	N1070-A1169 HydrophobicContact CB-CB 4.31Å; N1070-A1169 WeakPolarHBondContact OD1-CA 3.47Å; Y1072-A1169 HydrophobicContact CE1-CB 3.75Å; R1167-A1169 PolarHBondContact O-N 3.34Å; A1169-E1171 PolarHBondContact O-N 3.18Å
1170	V	62.9	Low	59.2	Low	73 Å²	73	107 Å²	107	44%	0.442	54%	0.538	S	S	.	.			trans	-82.1	102.2	177.7	-179.4	0	0	0	0	107.7	R1168 L1172	R1168-V1170 PolarHBondContact O-N 3.15Å; V1170-L1172 PolarHBondContact O-N 3.07Å
1171	E	57.4	Low	58.2	Low	79 Å²	79	101.5 Å²	101.5	37%	0.369	51%	0.506	S	S	.	.			trans	-79	117.5	167.8	-72.3	-177.2	-175.9	0	0	109.1	A1169 N1173	A1169-E1171 PolarHBondContact O-N 3.18Å; E1171-N1173 PolarHBondContact O-N 3.21Å
1172	L	45.4	Very low	57.6	Low	91 Å²	91	94.9 Å²	94.9	48%	0.476	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	121	164.4	-89.3	138.1	0	0	0	108.4	D1049 V1170	D1049-L1172 WeakPolarHBondContact OD1-CD1 3.27Å; D1049-L1172 WeakPolarHBondContact OD2-CD1 3.33Å; V1170-L1172 PolarHBondContact O-N 3.07Å
1173	N	40.6	Very low	57.1	Low	155 Å²	155	92.9 Å²	92.9	83%	0.829	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	8	172	-47.1	-45.7	0	0	0	118.9	E1171	E1171-N1173 PolarHBondContact O-N 3.21Å
1174	K	48.8	Very low	57.1	Low	152 Å²	152	93 Å²	93	66%	0.661	47%	0.472	S	S	*	.			trans	-128.2	82.9	165.2	-76.6	-176.7	-178.2	171.3	0	111.5	E1176	K1174-E1176 PolarHBondContact O-N 3.08Å
1175	W	40.7	Very low	57.4	Low	217 Å²	217	90.8 Å²	90.8	82%	0.822	46%	0.456	S	S	*	.			trans	-78.9	-6.8	172.1	-142.7	-86	0	0	0	113
1176	E	34.9	Very low	57.9	Low	145 Å²	145	83.6 Å²	83.6	68%	0.678	43%	0.428	S	S	*	.	S	Bend	trans	-146.6	114.5	-170.9	-56.1	174.5	166.7	0	0	103	K1174	K1174-E1176 PolarHBondContact O-N 3.08Å
1177	T	36.4	Very low	58.4	Low	129 Å²	129	79 Å²	79	79%	0.791	41%	0.408	S	S	*	.	S	Bend		-176.5	9.2	62.9	39	0	0	0	0	113.8
1178	D	40.3	Very low	58.6	Low	142 Å²	142	78.1 Å²	78.1	76%	0.759	40%	0.404	S	S	*	.			trans	-109.2	108.2	-178	-89.2	-35.5	0	0	0	113.3	S1180	D1178-S1180 PolarHBondContact O-N 2.94Å; D1178-S1180 VanDerWaalsContact O-N 3.15Å
1179	T	41.6	Very low	59.1	Low	136 Å²	136	75 Å²	75	83%	0.834	40%	0.396	S	S	*	.			trans	-66.5	-3.2	175	30.2	0	0	0	0	114.6	C1181	T1179-C1181 VanDerWaalsContact C-N 3.35Å; T1179-C1181 PolarHBondContact O-N 3.37Å; T1179-C1181 PolarHBondContact O-SG 3.43Å
1180	S	42.5	Very low	60	Low	72 Å²	72	74.5 Å²	74.5	50%	0.503	39%	0.391	S	S	.	.			trans	-84.9	74.6	-176.4	74.9	0	0	0	0	112.4	D1178 C1182	D1178-S1180 PolarHBondContact O-N 2.94Å; D1178-S1180 VanDerWaalsContact O-N 3.15Å; S1180-C1182 PolarHBondContact O-N 3.29Å
1181	C	44.6	Very low	61.3	Low	33 Å²	33	71.1 Å²	71.1	22%	0.223	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	128.7	175.3	-44.4	0	0	0	0	109.6	R1168 T1179 S1183	R1168-C1181 VanDerWaalsContact CZ-SG 3.55Å; R1168-C1181 PolarHBondContact NE-SG 3.4Å; R1168-C1181 PolarHBondContact NH2-SG 2.89Å; T1179-C1181 VanDerWaalsContact C-N 3.35Å; T1179-C1181 PolarHBondContact O-N 3.37Å; T1179-C1181 PolarHBondContact O-SG 3.43Å; C1181-S1183 VanDerWaalsContact C-N 3.3Å; C1181-S1183 PolarHBondContact O-N 2.83Å
1182	C	56.4	Low	62.6	Low	19 Å²	19	68.3 Å²	68.3	13%	0.128	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	47	40	167	-56.9	0	0	0	0	116	G1092 K1145 R1167 S1180 K1184 I1185	G1092-C1182 PolarHBondContact O-SG 2.91Å; K1145-C1182 PolarHBondContact NZ-O 3.43Å; R1167-C1182 PolarHBondContact O-SG 2.81Å; S1180-C1182 PolarHBondContact O-N 3.29Å; C1182-K1184 PolarHBondContact O-N 2.85Å; C1182-I1185 PolarHBondContact O-N 3.32Å
1183	S	63.1	Low	64.5	Low	42 Å²	42	69 Å²	69	29%	0.294	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.3	-171	65.2	0	0	0	0	113.8	F1141 C1181	F1141-S1183 WeakPolarHBondContact CZ-O 3.34Å; C1181-S1183 VanDerWaalsContact C-N 3.3Å; C1181-S1183 PolarHBondContact O-N 2.83Å
1184	K	78.5	Confident	66.6	Low	32 Å²	32	61.7 Å²	61.7	14%	0.139	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	10.1	-176.1	-57.8	-167.8	171.2	-162.2	0	115.8	T157 Q1089 C1182	T157-K1184 PolarHBondContact N-O 3.48Å; Q1089-K1184 VanDerWaalsContact NE2-CE 3.25Å; C1182-K1184 PolarHBondContact O-N 2.85Å
1185	I	85.5	Confident	68.1	Low	2 Å²	2	55.6 Å²	55.6	1%	0.01	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.5	177.9	-61.6	173.1	0	0	0	109.1	T157 V159 I1073 N1091 F1093 K1145 C1182	T157-I1185 WeakPolarHBondContact O-CA 3.48Å; V159-I1185 HydrophobicContact CB-CG2 4.47Å; V159-I1185 HydrophobicContact CG2-CG2 3.81Å; I1073-I1185 HydrophobicContact CD1-CD1 3.69Å; I1073-I1185 HydrophobicContact CD1-CG1 3.98Å; I1073-I1185 HydrophobicContact CG1-CD1 4.22Å; N1091-I1185 HydrophobicContact CB-CD1 3.88Å; N1091-I1185 HydrophobicContact CB-CG1 4.24Å; F1093-I1185 HydrophobicContact CB-CD1 3.66Å; F1093-I1185 HydrophobicContact CB-CG2 4.34Å; F1093-I1185 HydrophobicContact CD2-CB 4.37Å; F1093-I1185 HydrophobicContact CD2-CG2 3.72Å; F1093-I1185 HydrophobicContact CE2-CG2 4.15Å; F1093-I1185 HydrophobicContact CG-CG2 4.08Å; K1145-I1185 PolarHBondContact NZ-O 3.46Å; C1182-I1185 PolarHBondContact O-N 3.32Å
1186	V	89.1	Confident	70	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.6	171.9	175.8	0	0	0	0	108.6	T157 V158 V159 F1141 F1144 K1145 G1188 I1191	T157-V1186 PolarHBondContact O-N 3.18Å; T157-V1186 VanDerWaalsContact O-N 3.08Å; V158-V1186 WeakPolarHBondContact CA-O 3.5Å; V158-V1186 HydrophobicContact CG2-CB 3.87Å; V158-V1186 HydrophobicContact CG2-CG1 4.25Å; V158-V1186 HydrophobicContact CG2-CG2 4.48Å; V159-V1186 PolarHBondContact N-O 3.34Å; F1141-V1186 HydrophobicContact CD2-CG2 3.73Å; F1141-V1186 HydrophobicContact CE2-CG2 3.68Å; F1144-V1186 HydrophobicContact CB-CG1 3.97Å; F1144-V1186 HydrophobicContact CB-CG2 4.05Å; K1145-V1186 HydrophobicContact CB-CG2 4.38Å; K1145-V1186 HydrophobicContact CD-CG2 4.22Å; V1186-G1188 PolarHBondContact O-N 3.48Å; V1186-I1191 HydrophobicContact CG1-CD1 4.15Å; V1186-I1191 HydrophobicContact CG1-CG1 3.76Å
1187	D	89.4	Confident	72.3	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	104.6	170.9	-169.2	-20.6	0	0	0	110.7	F1093 E1148 H1163 R1167 N1189 V1190 I1191	F1093-D1187 HydrophobicContact CE2-CB 4.18Å; F1093-D1187 HydrophobicContact CZ-CB 4.03Å; E1148-D1187 VanDerWaalsContact OE1-CB 3.29Å; E1148-D1187 WeakPolarHBondContact OE1-CB 3.39Å; E1148-D1187 PolarHBondContact OE1-N 3.48Å; H1163-D1187 IonicContact CE1-OD2 2.65Å; H1163-D1187 PolarHBondContact CE1-OD2 2.75Å; H1163-D1187 IonicContact NE2-OD2 2.83Å; R1167-D1187 IonicContact CZ-OD2 3.5Å; R1167-D1187 IonicContact NE-OD2 2.84Å; R1167-D1187 PolarHBondContact NE-OD2 3.43Å; R1167-D1187 IonicContact NH2-OD1 3.31Å; R1167-D1187 IonicContact NH2-OD2 3.01Å; R1167-D1187 PolarHBondContact NH2-OD2 3.07Å; D1187-N1189 PolarHBondContact O-N 3.49Å; D1187-N1189 WeakPolarHBondContact OD1-CA 3.45Å; D1187-N1189 WeakPolarHBondContact OD1-CB 3.39Å; D1187-N1189 PolarHBondContact OD1-N 3.09Å; D1187-V1190 HydrophobicContact CB-CB 4.34Å; D1187-V1190 HydrophobicContact CB-CG2 3.93Å; D1187-V1190 PolarHBondContact O-N 2.87Å; D1187-V1190 VanDerWaalsContact O-N 3.12Å; D1187-I1191 PolarHBondContact O-N 2.89Å
1188	G	89.2	Confident	74.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-24.9	176.5	0	0	0	0	0	113.2	V159 H160 V1186 V1190 I1191 A1192 F1237	V159-G1188 PolarHBondContact O-N 3.18Å; H160-G1188 PolarHBondContact ND1-O 2.9Å; V1186-G1188 PolarHBondContact O-N 3.48Å; G1188-V1190 VanDerWaalsContact C-N 3.31Å; G1188-V1190 PolarHBondContact O-N 3.24Å; G1188-I1191 PolarHBondContact O-N 3.13Å; G1188-A1192 VanDerWaalsContact O-CB 3.3Å; G1188-A1192 WeakPolarHBondContact O-CB 3.29Å; G1188-A1192 PolarHBondContact O-N 3.31Å; G1188-F1237 WeakPolarHBondContact O-CE1 3.43Å; G1188-F1237 WeakPolarHBondContact O-CZ 3.48Å
1189	N	86	Confident	76.5	Confident	40 Å²	40	38.4 Å²	38.4	21%	0.214	23%	0.229	C	C	.	.	H	α-helix	trans	-67.7	-34.8	175.4	-58.9	-14	0	0	0	111.1	H160 D161 R1167 D1187 R1193	H160-N1189 PolarHBondContact CE1-OD1 3.48Å; H160-N1189 VanDerWaalsContact CE1-OD1 3.26Å; H160-N1189 PolarHBondContact ND1-N 3.5Å; H160-N1189 PolarHBondContact ND1-OD1 2.95Å; D161-N1189 PolarHBondContact N-OD1 3.36Å; D161-N1189 PolarHBondContact O-OD1 2.86Å; R1167-N1189 PolarHBondContact NH2-ND2 3.45Å; D1187-N1189 PolarHBondContact O-N 3.49Å; D1187-N1189 WeakPolarHBondContact OD1-CA 3.45Å; D1187-N1189 WeakPolarHBondContact OD1-CB 3.39Å; D1187-N1189 PolarHBondContact OD1-N 3.09Å; N1189-R1193 WeakPolarHBondContact O-CG 3.29Å; N1189-R1193 PolarHBondContact O-N 3.27Å
1190	V	88	Confident	78.5	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.024	23%	0.226	C	C	.	.	H	α-helix	trans	-69.8	-45.9	175	177.8	0	0	0	0	109.8	E1148 I1151 M1152 D1187 G1188 A1192 R1193	E1148-V1190 HydrophobicContact CG-CB 4.25Å; E1148-V1190 HydrophobicContact CG-CG1 4.04Å; I1151-V1190 HydrophobicContact CB-CG1 3.96Å; I1151-V1190 HydrophobicContact CG2-CG1 3.69Å; M1152-V1190 HydrophobicContact CG-CG1 4.05Å; D1187-V1190 HydrophobicContact CB-CB 4.34Å; D1187-V1190 HydrophobicContact CB-CG2 3.93Å; D1187-V1190 PolarHBondContact O-N 2.87Å; D1187-V1190 VanDerWaalsContact O-N 3.12Å; G1188-V1190 VanDerWaalsContact C-N 3.31Å; G1188-V1190 PolarHBondContact O-N 3.24Å; V1190-A1192 VanDerWaalsContact C-N 3.31Å; V1190-A1192 PolarHBondContact O-N 3.41Å; V1190-R1193 WeakPolarHBondContact O-CB 3.47Å; V1190-R1193 PolarHBondContact O-N 3.41Å; V1190-R1193 VanDerWaalsContact O-N 3.1Å
1191	I	89.3	Confident	80.5	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-40.6	176.9	-53.5	-55.9	0	0	0	111.2	F1144 L1147 E1148 I1151 V1186 D1187 G1188 R1193 L1194 V1233 F1237	F1144-I1191 HydrophobicContact CD1-CD1 4.35Å; F1144-I1191 HydrophobicContact CD1-CG1 4.2Å; F1144-I1191 HydrophobicContact CD1-CG2 3.91Å; F1144-I1191 HydrophobicContact CE1-CG2 3.9Å; F1144-I1191 WeakPolarHBondContact O-CD1 3.36Å; L1147-I1191 HydrophobicContact CB-CD1 3.89Å; E1148-I1191 HydrophobicContact CB-CD1 3.92Å; I1151-I1191 HydrophobicContact CD1-CD1 4.2Å; V1186-I1191 HydrophobicContact CG1-CD1 4.15Å; V1186-I1191 HydrophobicContact CG1-CG1 3.76Å; D1187-I1191 PolarHBondContact O-N 2.89Å; G1188-I1191 PolarHBondContact O-N 3.13Å; I1191-R1193 PolarHBondContact O-N 3.01Å; I1191-L1194 WeakPolarHBondContact O-CB 3.5Å; I1191-L1194 PolarHBondContact O-N 3.07Å; I1191-V1233 HydrophobicContact CG2-CG1 3.95Å; I1191-V1233 HydrophobicContact CG2-CG2 4.47Å; I1191-F1237 HydrophobicContact CB-CE2 4.12Å; I1191-F1237 HydrophobicContact CB-CZ 4.02Å; I1191-F1237 HydrophobicContact CG2-CE2 3.74Å; I1191-F1237 HydrophobicContact CG2-CZ 4.14Å
1192	A	84.6	Confident	82.6	Confident	21 Å²	21	39.4 Å²	39.4	17%	0.174	21%	0.213	C	C	.	.	H	α-helix	trans	-59.8	-29.2	177.3	0	0	0	0	0	112.6	G1188 V1190 L1194 L1195 F1237	G1188-A1192 VanDerWaalsContact O-CB 3.3Å; G1188-A1192 WeakPolarHBondContact O-CB 3.29Å; G1188-A1192 PolarHBondContact O-N 3.31Å; V1190-A1192 VanDerWaalsContact C-N 3.31Å; V1190-A1192 PolarHBondContact O-N 3.41Å; A1192-L1194 PolarHBondContact O-N 2.88Å; A1192-L1195 VanDerWaalsContact O-CB 3.25Å; A1192-L1195 WeakPolarHBondContact O-CB 3.4Å; A1192-L1195 PolarHBondContact O-N 3.14Å; A1192-F1237 HydrophobicContact CB-CD1 4.07Å; A1192-F1237 HydrophobicContact CB-CE1 3.73Å; A1192-F1237 HydrophobicContact CB-CE2 4.34Å; A1192-F1237 HydrophobicContact CB-CZ 3.9Å
1193	R	84.3	Confident	84.1	Confident	106 Å²	106	41.6 Å²	41.6	40%	0.4	22%	0.223	S	C	.	.	H	α-helix	trans	-63.6	-27.7	175.1	-69.2	177.5	-179.6	178.6	0.9	112.8	N1189 V1190 I1191 L1195 D1196 L1197	N1189-R1193 WeakPolarHBondContact O-CG 3.29Å; N1189-R1193 PolarHBondContact O-N 3.27Å; V1190-R1193 WeakPolarHBondContact O-CB 3.47Å; V1190-R1193 PolarHBondContact O-N 3.41Å; V1190-R1193 VanDerWaalsContact O-N 3.1Å; I1191-R1193 PolarHBondContact O-N 3.01Å; R1193-L1195 PolarHBondContact O-N 3.29Å; R1193-L1195 VanDerWaalsContact O-N 3.09Å; R1193-D1196 PolarHBondContact O-N 2.85Å; R1193-L1197 WeakPolarHBondContact O-CG 3.4Å; R1193-L1197 PolarHBondContact O-N 3.29Å
1194	L	86.2	Confident	85.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-52.4	-33.8	172.9	-171.3	67.3	0	0	0	111	L1147 I1151 I1191 A1192 L1197 K1202 I1205 L1206 V1233	L1147-L1194 HydrophobicContact CD2-CD2 4.28Å; I1151-L1194 HydrophobicContact CD1-CB 3.84Å; I1151-L1194 HydrophobicContact CD1-CD1 4.24Å; I1151-L1194 HydrophobicContact CD1-CG 4.47Å; I1151-L1194 HydrophobicContact CG1-CD1 4.22Å; I1191-L1194 WeakPolarHBondContact O-CB 3.5Å; I1191-L1194 PolarHBondContact O-N 3.07Å; A1192-L1194 PolarHBondContact O-N 2.88Å; L1194-L1197 HydrophobicContact CD1-CD1 4.46Å; L1194-K1202 HydrophobicContact CD1-CG 3.89Å; L1194-K1202 HydrophobicContact CG-CG 4.07Å; L1194-I1205 HydrophobicContact CD1-CB 4.3Å; L1194-I1205 HydrophobicContact CD1-CG2 3.91Å; L1194-L1206 HydrophobicContact CD2-CD2 3.97Å; L1194-L1206 HydrophobicContact CD2-CG 4.33Å; L1194-V1233 HydrophobicContact CD2-CG2 4.5Å
1195	L	80.1	Confident	85.9	Confident	24 Å²	24	42.3 Å²	42.3	13%	0.126	23%	0.228	C	C	.	.	H	α-helix	trans	-72	-32.2	179.5	-56.1	-174.8	0	0	0	112.1	R747 A1192 R1193 V1233 E1234 F1237	R747-L1195 VanDerWaalsContact CZ-CA 3.47Å; R747-L1195 VanDerWaalsContact CZ-CB 3.41Å; R747-L1195 PolarHBondContact NE-O 3.38Å; R747-L1195 VanDerWaalsContact NH2-C 3.28Å; R747-L1195 PolarHBondContact NH2-O 2.67Å; A1192-L1195 VanDerWaalsContact O-CB 3.25Å; A1192-L1195 WeakPolarHBondContact O-CB 3.4Å; A1192-L1195 PolarHBondContact O-N 3.14Å; R1193-L1195 PolarHBondContact O-N 3.29Å; R1193-L1195 VanDerWaalsContact O-N 3.09Å; L1195-V1233 HydrophobicContact CD1-CG1 4.44Å; L1195-V1233 HydrophobicContact CD2-CB 4.44Å; L1195-V1233 HydrophobicContact CD2-CG1 3.77Å; L1195-V1233 HydrophobicContact CG-CG1 4.18Å; L1195-E1234 HydrophobicContact CD2-CG 3.79Å; L1195-F1237 HydrophobicContact CD1-CB 4.02Å; L1195-F1237 HydrophobicContact CD1-CD2 3.96Å; L1195-F1237 HydrophobicContact CD1-CG 4.22Å
1196	D	81	Confident	86.1	Confident	96 Å²	96	42.3 Å²	42.3	51%	0.513	23%	0.228	S	C	.	.	H	α-helix	trans	-86.2	-6.5	-179.6	-75.2	-17.9	0	0	0	113.1	K745 R1193	K745-D1196 IonicContact NZ-OD1 3.78Å; K745-D1196 IonicContact NZ-OD2 3.65Å; K745-D1196 PolarHBondContact NZ-OD2 2.63Å; R1193-D1196 PolarHBondContact O-N 2.85Å
1197	L	83.4	Confident	86.1	Confident	32 Å²	32	49.7 Å²	49.7	17%	0.168	26%	0.256	C	S	.	.	S	Bend	trans	-75.4	150.4	-179.6	-71.8	177	0	0	0	113.9	R1193 L1194 K1202 I1205	R1193-L1197 WeakPolarHBondContact O-CG 3.4Å; R1193-L1197 PolarHBondContact O-N 3.29Å; L1194-L1197 HydrophobicContact CD1-CD1 4.46Å; L1197-K1202 HydrophobicContact CB-CB 4.33Å; L1197-I1205 HydrophobicContact CD1-CD1 3.51Å
1198	P	82.7	Confident	86.1	Confident	83 Å²	83	54.3 Å²	54.3	54%	0.539	28%	0.278	S	S	.	.			trans	-57.2	145.9	170.2	-21.3	32.5	0	0	0	112.1	E1200 Q1201 K1202	P1198-E1200 VanDerWaalsContact C-N 3.29Å; P1198-E1200 PolarHBondContact O-N 2.96Å; P1198-Q1201 PolarHBondContact O-N 2.8Å; P1198-K1202 WeakPolarHBondContact O-CB 3.47Å; P1198-K1202 PolarHBondContact O-N 2.89Å
1199	A	80.5	Confident	86	Confident	61 Å²	61	54.3 Å²	54.3	50%	0.504	28%	0.278	S	S	.	.	H	α-helix	trans	-55.8	-38.9	-172.9	0	0	0	0	0	113.9	N1203	A1199-N1203 WeakPolarHBondContact O-CB 3.4Å; A1199-N1203 PolarHBondContact O-N 2.89Å; A1199-N1203 PolarHBondContact O-ND2 3.3Å; A1199-N1203 PolarHBondContact O-OD1 3.49Å
1200	E	83.7	Confident	86.1	Confident	164 Å²	164	52.5 Å²	52.5	77%	0.766	27%	0.268	S	S	*	.	H	α-helix	trans	-65.1	-51.9	-180	-166.9	175.4	-168.6	0	0	111.5	P1198 K1202 N1203 T1204	P1198-E1200 VanDerWaalsContact C-N 3.29Å; P1198-E1200 PolarHBondContact O-N 2.96Å; E1200-K1202 VanDerWaalsContact C-N 3.34Å; E1200-K1202 PolarHBondContact O-N 2.94Å; E1200-N1203 PolarHBondContact O-N 3.28Å; E1200-T1204 PolarHBondContact O-N 3.36Å; E1200-T1204 PolarHBondContact O-OG1 3.46Å; E1200-T1204 VanDerWaalsContact O-OG1 3.13Å
1201	Q	85.5	Confident	86.1	Confident	76 Å²	76	56.8 Å²	56.8	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-63.4	-40.8	178.3	-167.5	173.3	11.4	0	0	111.8	A1154 P1198 T1204 I1205	A1154-Q1201 PolarHBondContact O-NE2 3.34Å; P1198-Q1201 PolarHBondContact O-N 2.8Å; Q1201-T1204 PolarHBondContact O-N 2.96Å; Q1201-I1205 HydrophobicContact CG-CD1 4.16Å; Q1201-I1205 VanDerWaalsContact O-CG1 3.29Å; Q1201-I1205 WeakPolarHBondContact O-CG1 3.48Å; Q1201-I1205 PolarHBondContact O-N 2.88Å
1202	K	87.6	Confident	86	Confident	23 Å²	23	59.2 Å²	59.2	10%	0.1	30%	0.304	C	S	.	.	H	α-helix	trans	-58.8	-47.5	174.7	-175.2	-168.3	71.5	-179.1	0	111.7	L1194 L1197 P1198 E1200 T1204 I1205 L1206 E1230	L1194-K1202 HydrophobicContact CD1-CG 3.89Å; L1194-K1202 HydrophobicContact CG-CG 4.07Å; L1197-K1202 HydrophobicContact CB-CB 4.33Å; P1198-K1202 WeakPolarHBondContact O-CB 3.47Å; P1198-K1202 PolarHBondContact O-N 2.89Å; E1200-K1202 VanDerWaalsContact C-N 3.34Å; E1200-K1202 PolarHBondContact O-N 2.94Å; K1202-T1204 VanDerWaalsContact C-N 3.34Å; K1202-T1204 PolarHBondContact O-N 3.33Å; K1202-I1205 PolarHBondContact O-N 3.45Å; K1202-L1206 HydrophobicContact CG-CD1 4.03Å; K1202-L1206 WeakPolarHBondContact O-CB 3.32Å; K1202-L1206 WeakPolarHBondContact O-CG 3.29Å; K1202-L1206 PolarHBondContact O-N 3.01Å; K1202-E1230 WeakPolarHBondContact CE-OE1 3.49Å; K1202-E1230 WeakPolarHBondContact CE-OE2 3.47Å; K1202-E1230 IonicContact NZ-OE1 3.66Å; K1202-E1230 PolarHBondContact NZ-OE1 3.02Å; K1202-E1230 IonicContact NZ-OE2 2.75Å; K1202-E1230 PolarHBondContact NZ-OE2 3.42Å
1203	N	87.6	Confident	86	Confident	64 Å²	64	58.2 Å²	58.2	34%	0.342	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-37.6	179.7	-71.9	-11	0	0	0	112.1	A1199 E1200 R1207	A1199-N1203 WeakPolarHBondContact O-CB 3.4Å; A1199-N1203 PolarHBondContact O-N 2.89Å; A1199-N1203 PolarHBondContact O-ND2 3.3Å; A1199-N1203 PolarHBondContact O-OD1 3.49Å; E1200-N1203 PolarHBondContact O-N 3.28Å; N1203-R1207 WeakPolarHBondContact O-CB 3.42Å; N1203-R1207 WeakPolarHBondContact O-CG 3.46Å; N1203-R1207 PolarHBondContact O-N 3.04Å
1204	T	90.2	Very high	86.2	Confident	84 Å²	84	54.7 Å²	54.7	52%	0.515	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-47.3	174.7	-57.4	0	0	0	0	111.5	E1200 Q1201 K1202 R1207 Q1208	E1200-T1204 PolarHBondContact O-N 3.36Å; E1200-T1204 PolarHBondContact O-OG1 3.46Å; E1200-T1204 VanDerWaalsContact O-OG1 3.13Å; Q1201-T1204 PolarHBondContact O-N 2.96Å; K1202-T1204 VanDerWaalsContact C-N 3.34Å; K1202-T1204 PolarHBondContact O-N 3.33Å; T1204-R1207 PolarHBondContact O-N 3.42Å; T1204-Q1208 WeakPolarHBondContact O-CB 3.38Å; T1204-Q1208 PolarHBondContact O-N 3.05Å
1205	I	90.3	Very high	86.1	Confident	5 Å²	5	61.2 Å²	61.2	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-45.8	178.1	-67.9	165.5	0	0	0	110.8	L1147 A1150 I1151 A1154 L1194 L1197 Q1201 K1202 Q1208 A1209	L1147-I1205 HydrophobicContact CD2-CG2 4.43Å; A1150-I1205 HydrophobicContact CB-CG2 3.91Å; I1151-I1205 HydrophobicContact CG1-CG2 3.9Å; A1154-I1205 HydrophobicContact CB-CD1 3.55Å; A1154-I1205 HydrophobicContact CB-CG1 3.87Å; L1194-I1205 HydrophobicContact CD1-CB 4.3Å; L1194-I1205 HydrophobicContact CD1-CG2 3.91Å; L1197-I1205 HydrophobicContact CD1-CD1 3.51Å; Q1201-I1205 HydrophobicContact CG-CD1 4.16Å; Q1201-I1205 VanDerWaalsContact O-CG1 3.29Å; Q1201-I1205 WeakPolarHBondContact O-CG1 3.48Å; Q1201-I1205 PolarHBondContact O-N 2.88Å; K1202-I1205 PolarHBondContact O-N 3.45Å; I1205-Q1208 PolarHBondContact O-N 2.97Å; I1205-A1209 WeakPolarHBondContact O-CB 3.49Å; I1205-A1209 PolarHBondContact O-N 3.42Å
1206	L	89.4	Confident	86.1	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-59.2	-50.8	178.6	-82.1	168.2	0	0	0	111.5	L1147 L1194 K1202 Q1208 A1209 V1210 V1229 E1230	L1147-L1206 HydrophobicContact CD2-CD2 4.16Å; L1194-L1206 HydrophobicContact CD2-CD2 3.97Å; L1194-L1206 HydrophobicContact CD2-CG 4.33Å; K1202-L1206 HydrophobicContact CG-CD1 4.03Å; K1202-L1206 WeakPolarHBondContact O-CB 3.32Å; K1202-L1206 WeakPolarHBondContact O-CG 3.29Å; K1202-L1206 PolarHBondContact O-N 3.01Å; L1206-Q1208 PolarHBondContact O-N 3.4Å; L1206-A1209 PolarHBondContact O-N 3.06Å; L1206-V1210 VanDerWaalsContact O-CB 3.3Å; L1206-V1210 WeakPolarHBondContact O-CB 3.38Å; L1206-V1210 VanDerWaalsContact O-CG2 3.24Å; L1206-V1210 WeakPolarHBondContact O-CG2 3.49Å; L1206-V1210 PolarHBondContact O-N 3.4Å; L1206-V1229 HydrophobicContact CD2-CB 4.47Å; L1206-V1229 HydrophobicContact CD2-CG1 3.87Å; L1206-E1230 HydrophobicContact CD1-CB 4.03Å; L1206-E1230 HydrophobicContact CD1-CG 4.45Å
1207	R	89.7	Confident	86	Confident	155 Å²	155	60.8 Å²	60.8	59%	0.585	31%	0.312	S	S	*	.	H	α-helix	trans	-58.3	-50	178.5	-75.6	177.1	-176.3	165.9	1.5	111.5	N1203 T1204 A1209 V1210 D1211	N1203-R1207 WeakPolarHBondContact O-CB 3.42Å; N1203-R1207 WeakPolarHBondContact O-CG 3.46Å; N1203-R1207 PolarHBondContact O-N 3.04Å; T1204-R1207 PolarHBondContact O-N 3.42Å; R1207-A1209 VanDerWaalsContact C-N 3.33Å; R1207-A1209 PolarHBondContact O-N 2.94Å; R1207-V1210 PolarHBondContact O-N 3.01Å; R1207-D1211 VanDerWaalsContact O-CB 3.32Å; R1207-D1211 WeakPolarHBondContact O-CB 3.39Å; R1207-D1211 PolarHBondContact O-N 3.23Å
1208	Q	88.5	Confident	85.7	Confident	98 Å²	98	62.4 Å²	62.4	46%	0.458	33%	0.33	S	S	.	.	H	α-helix	trans	-57.6	-46.6	179.6	-174.4	179.3	-1.4	0	0	111.7	T1204 I1205 L1206 L1212	T1204-Q1208 WeakPolarHBondContact O-CB 3.38Å; T1204-Q1208 PolarHBondContact O-N 3.05Å; I1205-Q1208 PolarHBondContact O-N 2.97Å; L1206-Q1208 PolarHBondContact O-N 3.4Å; Q1208-L1212 HydrophobicContact CG-CD1 3.92Å; Q1208-L1212 WeakPolarHBondContact O-CB 3.45Å; Q1208-L1212 WeakPolarHBondContact O-CD1 3.29Å; Q1208-L1212 PolarHBondContact O-N 3.03Å; Q1208-L1212 VanDerWaalsContact O-N 3.16Å
1209	A	88.1	Confident	85.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-69.7	-40.2	-179.1	0	0	0	0	0	112.9	T1146 L1147 I1205 L1206 R1207 T1213	T1146-A1209 HydrophobicContact CG2-CB 4.05Å; L1147-A1209 HydrophobicContact CD2-CB 3.54Å; L1147-A1209 HydrophobicContact CG-CB 3.84Å; I1205-A1209 WeakPolarHBondContact O-CB 3.49Å; I1205-A1209 PolarHBondContact O-N 3.42Å; L1206-A1209 PolarHBondContact O-N 3.06Å; R1207-A1209 VanDerWaalsContact C-N 3.33Å; R1207-A1209 PolarHBondContact O-N 2.94Å; A1209-T1213 WeakPolarHBondContact O-CB 3.34Å; A1209-T1213 PolarHBondContact O-N 3.42Å; A1209-T1213 PolarHBondContact O-OG1 2.96Å
1210	V	88.4	Confident	84.9	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.018	34%	0.34	C	S	.	.	H	α-helix	trans	-66	-45.1	178	168	0	0	0	0	110.9	L1143 L1206 R1207 T1213 N1214 F1224 V1229	L1143-V1210 HydrophobicContact CD1-CG2 4.37Å; L1206-V1210 VanDerWaalsContact O-CB 3.3Å; L1206-V1210 WeakPolarHBondContact O-CB 3.38Å; L1206-V1210 VanDerWaalsContact O-CG2 3.24Å; L1206-V1210 WeakPolarHBondContact O-CG2 3.49Å; L1206-V1210 PolarHBondContact O-N 3.4Å; R1207-V1210 PolarHBondContact O-N 3.01Å; V1210-T1213 PolarHBondContact O-N 3.47Å; V1210-N1214 WeakPolarHBondContact CG1-ND2 3.33Å; V1210-N1214 VanDerWaalsContact O-CB 3.31Å; V1210-N1214 WeakPolarHBondContact O-CB 3.48Å; V1210-N1214 PolarHBondContact O-N 3Å; V1210-N1214 PolarHBondContact O-ND2 3Å; V1210-F1224 HydrophobicContact CG1-CB 4.06Å; V1210-F1224 VanDerWaalsContact CG1-O 3.25Å; V1210-F1224 WeakPolarHBondContact CG1-O 3.49Å; V1210-V1229 HydrophobicContact CG2-CB 4.39Å; V1210-V1229 HydrophobicContact CG2-CG2 4.05Å
1211	D	87.9	Confident	84.5	Confident	93 Å²	93	60 Å²	60	50%	0.497	34%	0.338	S	S	.	.	H	α-helix	trans	-61.3	-49.7	179.1	-68.9	-21.3	0	0	0	110.8	R1207 T1213 N1214 E1215	R1207-D1211 VanDerWaalsContact O-CB 3.32Å; R1207-D1211 WeakPolarHBondContact O-CB 3.39Å; R1207-D1211 PolarHBondContact O-N 3.23Å; D1211-T1213 VanDerWaalsContact C-N 3.31Å; D1211-T1213 PolarHBondContact O-N 3.49Å; D1211-N1214 PolarHBondContact O-N 2.98Å; D1211-E1215 WeakPolarHBondContact O-CG 3.21Å; D1211-E1215 PolarHBondContact O-N 3.28Å
1212	L	86.6	Confident	83.9	Confident	53 Å²	53	62.1 Å²	62.1	28%	0.277	35%	0.346	S	S	.	.	H	α-helix	trans	-58.4	-41.5	175.2	-98	119.5	0	0	0	112.5	T1146 Q1208	T1146-L1212 HydrophobicContact CG2-CB 4.04Å; Q1208-L1212 HydrophobicContact CG-CD1 3.92Å; Q1208-L1212 WeakPolarHBondContact O-CB 3.45Å; Q1208-L1212 WeakPolarHBondContact O-CD1 3.29Å; Q1208-L1212 PolarHBondContact O-N 3.03Å; Q1208-L1212 VanDerWaalsContact O-N 3.16Å
1213	T	85.3	Confident	83.6	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-69.7	-39	179.9	-53.8	0	0	0	0	111.1	L1143 A1209 V1210 D1211 E1215 V1216 Y1217 F1224	L1143-T1213 HydrophobicContact CB-CG2 4.11Å; L1143-T1213 HydrophobicContact CD1-CG2 4.25Å; A1209-T1213 WeakPolarHBondContact O-CB 3.34Å; A1209-T1213 PolarHBondContact O-N 3.42Å; A1209-T1213 PolarHBondContact O-OG1 2.96Å; V1210-T1213 PolarHBondContact O-N 3.47Å; D1211-T1213 VanDerWaalsContact C-N 3.31Å; D1211-T1213 PolarHBondContact O-N 3.49Å; T1213-E1215 VanDerWaalsContact C-N 3.33Å; T1213-E1215 PolarHBondContact O-N 2.74Å; T1213-V1216 PolarHBondContact O-N 3.09Å; T1213-Y1217 HydrophobicContact CG2-CD2 3.97Å; T1213-Y1217 HydrophobicContact CG2-CE2 4.15Å; T1213-Y1217 WeakPolarHBondContact O-CD2 3.24Å; T1213-Y1217 PolarHBondContact O-N 3.42Å; T1213-F1224 HydrophobicContact CG2-CD2 3.89Å; T1213-F1224 HydrophobicContact CG2-CE2 3.75Å
1214	N	86.8	Confident	83.4	Confident	32 Å²	32	63 Å²	63	17%	0.171	36%	0.358	C	S	.	.	H	α-helix	trans	-66.2	-34	178.3	-76.7	-18.6	0	0	0	112.2	V1210 D1211 V1216 Y1217 A1218 S1223 F1224	V1210-N1214 WeakPolarHBondContact CG1-ND2 3.33Å; V1210-N1214 VanDerWaalsContact O-CB 3.31Å; V1210-N1214 WeakPolarHBondContact O-CB 3.48Å; V1210-N1214 PolarHBondContact O-N 3Å; V1210-N1214 PolarHBondContact O-ND2 3Å; D1211-N1214 PolarHBondContact O-N 2.98Å; N1214-V1216 VanDerWaalsContact C-N 3.28Å; N1214-V1216 PolarHBondContact O-N 3.11Å; N1214-Y1217 CarbonylContact O-C 3.52Å; N1214-Y1217 PolarHBondContact O-N 3.44Å; N1214-A1218 WeakPolarHBondContact O-CB 3.48Å; N1214-A1218 PolarHBondContact O-N 3.26Å; N1214-S1223 WeakPolarHBondContact OD1-CA 3.44Å; N1214-F1224 PolarHBondContact ND2-O 3.03Å; N1214-F1224 PolarHBondContact OD1-N 2.96Å
1215	E	85	Confident	83.1	Confident	136 Å²	136	62.5 Å²	62.5	64%	0.636	35%	0.353	S	S	*	.	H	α-helix	trans	-59.4	-39.5	172.4	-74.3	-179.1	176.6	0	0	112	D1211 T1213	D1211-E1215 WeakPolarHBondContact O-CG 3.21Å; D1211-E1215 PolarHBondContact O-N 3.28Å; T1213-E1215 VanDerWaalsContact C-N 3.33Å; T1213-E1215 PolarHBondContact O-N 2.74Å
1216	V	79.3	Confident	82.7	Confident	65 Å²	65	63.6 Å²	63.6	39%	0.394	36%	0.36	S	S	.	.	H	α-helix	trans	-69	-38.8	178.1	178.6	0	0	0	0	111.7	T1213 N1214 P1219	T1213-V1216 PolarHBondContact O-N 3.09Å; N1214-V1216 VanDerWaalsContact C-N 3.28Å; N1214-V1216 PolarHBondContact O-N 3.11Å; V1216-P1219 WeakPolarHBondContact O-CD 3.44Å
1217	Y	80.1	Confident	81.9	Confident	46 Å²	46	69 Å²	69	18%	0.18	39%	0.39	C	S	.	.	H	α-helix	trans	-95.2	-2.5	-176.9	-74.2	-79.2	0	0	0	114.9	P1138 R1139 S1142 T1213 N1214 P1219 S1220	P1138-Y1217 PolarHBondContact O-OH 3.13Å; R1139-Y1217 HydrophobicContact CG-CE1 4.36Å; R1139-Y1217 HydrophobicContact CG-CE2 4.5Å; S1142-Y1217 PolarHBondContact OG-OH 2.8Å; S1142-Y1217 VanDerWaalsContact OG-OH 3.07Å; T1213-Y1217 HydrophobicContact CG2-CD2 3.97Å; T1213-Y1217 HydrophobicContact CG2-CE2 4.15Å; T1213-Y1217 WeakPolarHBondContact O-CD2 3.24Å; T1213-Y1217 PolarHBondContact O-N 3.42Å; N1214-Y1217 CarbonylContact O-C 3.52Å; N1214-Y1217 PolarHBondContact O-N 3.44Å; Y1217-P1219 VanDerWaalsContact C-N 3.27Å; Y1217-P1219 VanDerWaalsContact O-N 3.14Å; Y1217-S1220 WeakPolarHBondContact O-CA 3.47Å; Y1217-S1220 PolarHBondContact O-N 3.38Å; Y1217-S1220 PolarHBondContact O-OG 3.35Å
1218	A	76.1	Confident	81.4	Confident	67 Å²	67	64.9 Å²	64.9	55%	0.554	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-47.6	-40.7	175.7	0	0	0	0	0	114	N1214 S1220 G1221	N1214-A1218 WeakPolarHBondContact O-CB 3.48Å; N1214-A1218 PolarHBondContact O-N 3.26Å; A1218-S1220 PolarHBondContact O-N 3.39Å; A1218-G1221 PolarHBondContact O-N 3.02Å
1219	P	73.9	Confident	81.2	Confident	123 Å²	123	60.4 Å²	60.4	80%	0.799	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-65.7	-21.9	177.9	-19.6	32.3	0	0	0	114.3	V1216 Y1217	V1216-P1219 WeakPolarHBondContact O-CD 3.44Å; Y1217-P1219 VanDerWaalsContact C-N 3.27Å; Y1217-P1219 VanDerWaalsContact O-N 3.14Å
1220	S	73.4	Confident	80.9	Confident	63 Å²	63	61.9 Å²	61.9	44%	0.441	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-93.3	-2.1	-176.8	64.6	0	0	0	0	113.9	Y1217 A1218 F1222	Y1217-S1220 WeakPolarHBondContact O-CA 3.47Å; Y1217-S1220 PolarHBondContact O-N 3.38Å; Y1217-S1220 PolarHBondContact O-OG 3.35Å; A1218-S1220 PolarHBondContact O-N 3.39Å; S1220-F1222 WeakPolarHBondContact O-CD2 3.49Å; S1220-F1222 PolarHBondContact O-N 3.16Å
1221	G	75.2	Confident	80.3	Confident	72 Å²	72	65.6 Å²	65.6	74%	0.742	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	5.9	179	0	0	0	0	0	114.9	A1218	A1218-G1221 PolarHBondContact O-N 3.02Å
1222	F	72.2	Confident	80	Confident	119 Å²	119	62.2 Å²	62.2	52%	0.522	37%	0.37	S	S	.	.			trans	-97.9	135.5	177.2	-80.1	-84.2	0	0	0	110.9	S1220	S1220-F1222 WeakPolarHBondContact O-CD2 3.49Å; S1220-F1222 PolarHBondContact O-N 3.16Å
1223	S	81.7	Confident	79.8	Confident	89 Å²	89	59.7 Å²	59.7	62%	0.622	36%	0.357	S	S	*	.			trans	-129	150.6	170.2	61.8	0	0	0	0	110.6	R1139 N1214	R1139-S1223 PolarHBondContact NH2-O 2.98Å; N1214-S1223 WeakPolarHBondContact OD1-CA 3.44Å
1224	F	83.4	Confident	79.4	Confident	16 Å²	16	60.9 Å²	60.9	7%	0.07	36%	0.362	C	S	.	.			trans	-100.9	146.8	169.6	-69.5	-75.8	0	0	0	109.7	R1139 Y1140 L1143 V1210 T1213 N1214 V1229	R1139-F1224 HydrophobicContact CG-CE2 3.89Å; R1139-F1224 HydrophobicContact CG-CZ 3.54Å; Y1140-F1224 HydrophobicContact CD1-CE1 4.34Å; Y1140-F1224 AromaticContact CE1-CE1 3.89Å; Y1140-F1224 HydrophobicContact CE1-CE1 3.89Å; Y1140-F1224 HydrophobicContact CE2-CE1 4.46Å; Y1140-F1224 AromaticContact CZ-CE1 3.98Å; L1143-F1224 HydrophobicContact CB-CE2 4.3Å; L1143-F1224 HydrophobicContact CB-CZ 4.24Å; L1143-F1224 HydrophobicContact CD2-CD1 4.04Å; L1143-F1224 HydrophobicContact CD2-CE1 3.85Å; L1143-F1224 HydrophobicContact CD2-CE2 4.48Å; L1143-F1224 HydrophobicContact CD2-CG 4.4Å; L1143-F1224 HydrophobicContact CD2-CZ 4.03Å; V1210-F1224 HydrophobicContact CG1-CB 4.06Å; V1210-F1224 VanDerWaalsContact CG1-O 3.25Å; V1210-F1224 WeakPolarHBondContact CG1-O 3.49Å; T1213-F1224 HydrophobicContact CG2-CD2 3.89Å; T1213-F1224 HydrophobicContact CG2-CE2 3.75Å; N1214-F1224 PolarHBondContact ND2-O 3.03Å; N1214-F1224 PolarHBondContact OD1-N 2.96Å; F1224-V1229 HydrophobicContact CB-CG2 4.06Å; F1224-V1229 HydrophobicContact CD1-CG2 4.09Å; F1224-V1229 HydrophobicContact CG-CG2 4.39Å
1225	D	84.3	Confident	78.7	Confident	75 Å²	75	61.8 Å²	61.8	40%	0.401	37%	0.367	S	S	.	.			trans	-110.2	145.5	171.5	154.3	60.5	0	0	0	109.5	D1227 S1228 V1229	D1225-D1227 PolarHBondContact O-N 2.92Å; D1225-D1227 PolarHBondContact OD1-N 3.43Å; D1225-D1227 PolarHBondContact OD2-N 3.03Å; D1225-S1228 PolarHBondContact O-N 3.47Å; D1225-S1228 WeakPolarHBondContact OD2-CB 3.35Å; D1225-S1228 PolarHBondContact OD2-N 3.07Å; D1225-S1228 PolarHBondContact OD2-OG 3.36Å; D1225-V1229 VanDerWaalsContact O-CG2 3.27Å; D1225-V1229 WeakPolarHBondContact O-CG2 3.5Å; D1225-V1229 PolarHBondContact O-N 3.04Å
1226	C	81.2	Confident	78.4	Confident	27 Å²	27	55.4 Å²	55.4	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-43.3	-176.9	-70.6	0	0	0	0	112.6	V1229 E1230	C1226-V1229 PolarHBondContact O-N 3.16Å; C1226-E1230 PolarHBondContact O-N 2.87Å
1227	D	73.7	Confident	78.2	Confident	117 Å²	117	53.1 Å²	53.1	63%	0.626	32%	0.322	S	S	*	.	H	α-helix	trans	-68.9	-40.3	-177	-67.1	-23.2	0	0	0	110.4	D1225 E1230 H1231	D1225-D1227 PolarHBondContact O-N 2.92Å; D1225-D1227 PolarHBondContact OD1-N 3.43Å; D1225-D1227 PolarHBondContact OD2-N 3.03Å; D1227-E1230 PolarHBondContact O-N 2.87Å; D1227-H1231 WeakPolarHBondContact O-CB 3.35Å; D1227-H1231 PolarHBondContact O-N 3.49Å
1228	S	78.9	Confident	77.6	Confident	68 Å²	68	52.7 Å²	52.7	48%	0.476	33%	0.326	S	S	.	.	H	α-helix	trans	-60.7	-44.6	174	-58	0	0	0	0	111.6	D1225 H1231 V1232	D1225-S1228 PolarHBondContact O-N 3.47Å; D1225-S1228 WeakPolarHBondContact OD2-CB 3.35Å; D1225-S1228 PolarHBondContact OD2-N 3.07Å; D1225-S1228 PolarHBondContact OD2-OG 3.36Å; S1228-H1231 PolarHBondContact O-N 3.22Å; S1228-V1232 VanDerWaalsContact O-CG2 3.31Å; S1228-V1232 WeakPolarHBondContact O-CG2 3.49Å; S1228-V1232 PolarHBondContact O-N 3.39Å
1229	V	83.6	Confident	77.3	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-65.5	-45.1	178.1	170.3	0	0	0	0	111.2	L1143 L1147 L1206 V1210 F1224 D1225 C1226 H1231 V1232 V1233	L1143-V1229 HydrophobicContact CD1-CG2 4.34Å; L1143-V1229 HydrophobicContact CD2-CB 4.47Å; L1143-V1229 HydrophobicContact CD2-CG1 3.96Å; L1143-V1229 HydrophobicContact CD2-CG2 3.64Å; L1147-V1229 HydrophobicContact CD1-CG1 4.08Å; L1206-V1229 HydrophobicContact CD2-CB 4.47Å; L1206-V1229 HydrophobicContact CD2-CG1 3.87Å; V1210-V1229 HydrophobicContact CG2-CB 4.39Å; V1210-V1229 HydrophobicContact CG2-CG2 4.05Å; F1224-V1229 HydrophobicContact CB-CG2 4.06Å; F1224-V1229 HydrophobicContact CD1-CG2 4.09Å; F1224-V1229 HydrophobicContact CG-CG2 4.39Å; D1225-V1229 VanDerWaalsContact O-CG2 3.27Å; D1225-V1229 WeakPolarHBondContact O-CG2 3.5Å; D1225-V1229 PolarHBondContact O-N 3.04Å; C1226-V1229 PolarHBondContact O-N 3.16Å; V1229-H1231 VanDerWaalsContact C-N 3.3Å; V1229-H1231 PolarHBondContact O-N 2.9Å; V1229-V1232 WeakPolarHBondContact O-CB 3.33Å; V1229-V1232 PolarHBondContact O-N 2.97Å; V1229-V1233 HydrophobicContact CG1-CG2 4.42Å; V1229-V1233 WeakPolarHBondContact O-CG2 3.46Å; V1229-V1233 PolarHBondContact O-N 3.14Å
1230	E	81.6	Confident	77.1	Confident	32 Å²	32	44.9 Å²	44.9	15%	0.15	27%	0.269	C	S	.	.	H	α-helix	trans	-57.2	-46.1	176.1	-175.1	176	167.5	0	0	111.2	K1202 L1206 C1226 D1227 V1232 V1233 E1234	K1202-E1230 WeakPolarHBondContact CE-OE1 3.49Å; K1202-E1230 WeakPolarHBondContact CE-OE2 3.47Å; K1202-E1230 IonicContact NZ-OE1 3.66Å; K1202-E1230 PolarHBondContact NZ-OE1 3.02Å; K1202-E1230 IonicContact NZ-OE2 2.75Å; K1202-E1230 PolarHBondContact NZ-OE2 3.42Å; L1206-E1230 HydrophobicContact CD1-CB 4.03Å; L1206-E1230 HydrophobicContact CD1-CG 4.45Å; C1226-E1230 PolarHBondContact O-N 2.87Å; D1227-E1230 PolarHBondContact O-N 2.87Å; E1230-V1232 VanDerWaalsContact C-N 3.32Å; E1230-V1232 PolarHBondContact O-N 3.46Å; E1230-V1233 PolarHBondContact O-N 2.9Å; E1230-E1234 WeakPolarHBondContact O-CG 3.27Å; E1230-E1234 PolarHBondContact O-N 3.39Å
1231	H	76.8	Confident	76.7	Confident	80 Å²	80	43.4 Å²	43.4	37%	0.37	26%	0.259	S	S	.	.	H	α-helix	trans	-61.9	-39.8	178.3	-168.2	58.7	0	0	0	112.4	D1227 S1228 V1229 E1234 N1235	D1227-H1231 WeakPolarHBondContact O-CB 3.35Å; D1227-H1231 PolarHBondContact O-N 3.49Å; S1228-H1231 PolarHBondContact O-N 3.22Å; V1229-H1231 VanDerWaalsContact C-N 3.3Å; V1229-H1231 PolarHBondContact O-N 2.9Å; H1231-E1234 PolarHBondContact O-N 3.43Å; H1231-N1235 PolarHBondContact CD2-ND2 3.48Å; H1231-N1235 VanDerWaalsContact CD2-ND2 3.29Å; H1231-N1235 PolarHBondContact CE1-ND2 2.99Å; H1231-N1235 PolarHBondContact NE2-ND2 2.88Å; H1231-N1235 WeakPolarHBondContact O-CB 3.25Å; H1231-N1235 VanDerWaalsContact O-CG 3.26Å; H1231-N1235 PolarHBondContact O-N 3.48Å
1232	V	80.6	Confident	75.9	Confident	22 Å²	22	43.2 Å²	43.2	13%	0.133	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-46.5	174.2	164.3	0	0	0	0	111.4	I1115 Y1140 F1144 S1228 V1229 E1230 N1235 M1236	I1115-V1232 HydrophobicContact CD1-CB 4.45Å; I1115-V1232 HydrophobicContact CD1-CG1 3.65Å; I1115-V1232 HydrophobicContact CD1-CG2 4.06Å; I1115-V1232 HydrophobicContact CG1-CG1 4.26Å; Y1140-V1232 HydrophobicContact CD1-CG1 4.41Å; Y1140-V1232 HydrophobicContact CE1-CG1 4.01Å; Y1140-V1232 HydrophobicContact CE1-CG2 4.45Å; F1144-V1232 HydrophobicContact CZ-CG1 4.36Å; S1228-V1232 VanDerWaalsContact O-CG2 3.31Å; S1228-V1232 WeakPolarHBondContact O-CG2 3.49Å; S1228-V1232 PolarHBondContact O-N 3.39Å; V1229-V1232 WeakPolarHBondContact O-CB 3.33Å; V1229-V1232 PolarHBondContact O-N 2.97Å; E1230-V1232 VanDerWaalsContact C-N 3.32Å; E1230-V1232 PolarHBondContact O-N 3.46Å; V1232-N1235 PolarHBondContact O-N 2.87Å; V1232-M1236 VanDerWaalsContact O-CB 3.28Å; V1232-M1236 WeakPolarHBondContact O-CB 3.5Å; V1232-M1236 PolarHBondContact O-N 2.92Å
1233	V	82.9	Confident	76.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.4	-48.4	177.4	-179.5	0	0	0	0	109.9	F1144 I1191 L1194 L1195 V1229 E1230 N1235 M1236 F1237	F1144-V1233 HydrophobicContact CE1-CG2 3.96Å; I1191-V1233 HydrophobicContact CG2-CG1 3.95Å; I1191-V1233 HydrophobicContact CG2-CG2 4.47Å; L1194-V1233 HydrophobicContact CD2-CG2 4.5Å; L1195-V1233 HydrophobicContact CD1-CG1 4.44Å; L1195-V1233 HydrophobicContact CD2-CB 4.44Å; L1195-V1233 HydrophobicContact CD2-CG1 3.77Å; L1195-V1233 HydrophobicContact CG-CG1 4.18Å; V1229-V1233 HydrophobicContact CG1-CG2 4.42Å; V1229-V1233 WeakPolarHBondContact O-CG2 3.46Å; V1229-V1233 PolarHBondContact O-N 3.14Å; E1230-V1233 PolarHBondContact O-N 2.9Å; V1233-N1235 PolarHBondContact O-N 2.86Å; V1233-M1236 WeakPolarHBondContact O-CB 3.44Å; V1233-M1236 PolarHBondContact O-N 3.49Å; V1233-F1237 HydrophobicContact CG1-CD2 3.71Å; V1233-F1237 HydrophobicContact CG1-CE2 3.73Å; V1233-F1237 WeakPolarHBondContact O-CD2 3.4Å; V1233-F1237 PolarHBondContact O-N 3.24Å
1234	E	77.1	Confident	75.8	Confident	26 Å²	26	36.8 Å²	36.8	12%	0.121	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-45.8	179.7	-72.4	-163.3	162.1	0	0	113.1	K709 R747 L1195 E1230 H1231 M1236 F1237 S1238	K709-E1234 IonicContact NZ-OE2 2.77Å; K709-E1234 PolarHBondContact NZ-OE2 2.95Å; R747-E1234 IonicContact CZ-OE1 3.7Å; R747-E1234 IonicContact NH1-OE1 2.76Å; R747-E1234 PolarHBondContact NH1-OE1 3.36Å; R747-E1234 IonicContact NH2-OE1 2.7Å; L1195-E1234 HydrophobicContact CD2-CG 3.79Å; E1230-E1234 WeakPolarHBondContact O-CG 3.27Å; E1230-E1234 PolarHBondContact O-N 3.39Å; H1231-E1234 PolarHBondContact O-N 3.43Å; E1234-M1236 VanDerWaalsContact C-N 3.35Å; E1234-F1237 PolarHBondContact O-N 3.44Å; E1234-S1238 VanDerWaalsContact O-CB 3.26Å; E1234-S1238 WeakPolarHBondContact O-CB 3.46Å; E1234-S1238 PolarHBondContact O-N 2.91Å
1235	N	72.7	Confident	75.4	Confident	52 Å²	52	37.9 Å²	37.9	28%	0.278	21%	0.213	S	C	.	.	H	α-helix	trans	-65.5	-40.7	179	-72	-12.4	0	0	0	111	H1231 V1232 V1233 S1238 T1239	H1231-N1235 PolarHBondContact CD2-ND2 3.48Å; H1231-N1235 VanDerWaalsContact CD2-ND2 3.29Å; H1231-N1235 PolarHBondContact CE1-ND2 2.99Å; H1231-N1235 PolarHBondContact NE2-ND2 2.88Å; H1231-N1235 WeakPolarHBondContact O-CB 3.25Å; H1231-N1235 VanDerWaalsContact O-CG 3.26Å; H1231-N1235 PolarHBondContact O-N 3.48Å; V1232-N1235 PolarHBondContact O-N 2.87Å; V1233-N1235 PolarHBondContact O-N 2.86Å; N1235-S1238 PolarHBondContact O-N 3.31Å; N1235-T1239 WeakPolarHBondContact O-CB 3.35Å; N1235-T1239 PolarHBondContact O-N 2.92Å; N1235-T1239 PolarHBondContact O-OG1 3.05Å
1236	M	76.9	Confident	74.9	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-56.2	-55	175.3	-173.6	166.9	-173.3	0	0	111.1	V158 M1111 C1134 L1136 F1144 V1232 V1233 E1234 S1238 T1239 I1240	V158-M1236 HydrophobicContact CB-CE 4.44Å; V158-M1236 HydrophobicContact CG1-CE 4.35Å; V158-M1236 HydrophobicContact CG2-CE 4.37Å; M1111-M1236 HydrophobicContact CE-CB 3.39Å; M1111-M1236 HydrophobicContact CE-CG 3.56Å; M1111-M1236 HydrophobicContact CE-SD 3.93Å; M1111-M1236 HydrophobicContact SD-CB 3.96Å; M1111-M1236 HydrophobicContact SD-CG 3.63Å; M1111-M1236 HydrophobicContact SD-SD 4.32Å; C1134-M1236 VanDerWaalsContact SG-CE 3.56Å; L1136-M1236 HydrophobicContact CD2-CE 4.28Å; F1144-M1236 HydrophobicContact CE1-SD 4.43Å; F1144-M1236 HydrophobicContact CE2-SD 4.19Å; F1144-M1236 HydrophobicContact CZ-SD 3.75Å; V1232-M1236 VanDerWaalsContact O-CB 3.28Å; V1232-M1236 WeakPolarHBondContact O-CB 3.5Å; V1232-M1236 PolarHBondContact O-N 2.92Å; V1233-M1236 WeakPolarHBondContact O-CB 3.44Å; V1233-M1236 PolarHBondContact O-N 3.49Å; E1234-M1236 VanDerWaalsContact C-N 3.35Å; M1236-S1238 PolarHBondContact O-N 3.44Å; M1236-T1239 WeakPolarHBondContact O-CB 3.43Å; M1236-T1239 PolarHBondContact O-N 3.35Å; M1236-I1240 HydrophobicContact CE-CD1 4.08Å; M1236-I1240 HydrophobicContact CG-CD1 3.73Å; M1236-I1240 VanDerWaalsContact O-CG1 3.24Å; M1236-I1240 WeakPolarHBondContact O-CG1 3.37Å; M1236-I1240 PolarHBondContact O-N 3.33Å
1237	F	75.7	Confident	74.5	Confident	17 Å²	17	36.3 Å²	36.3	8%	0.075	20%	0.203	C	C	.	.	H	α-helix	trans	-71.6	-31.5	-177.8	-74.6	-72.1	0	0	0	113.2	H160 G1188 I1191 A1192 L1195 V1233 E1234 T1239 I1240 S1241	H160-F1237 AromaticContact CD2-CD1 3.93Å; H160-F1237 AromaticContact CD2-CE1 3.76Å; H160-F1237 AromaticContact CE1-CE1 3.66Å; H160-F1237 AromaticContact CG-CE1 3.76Å; H160-F1237 AromaticContact ND1-CE1 3.69Å; H160-F1237 AromaticContact NE2-CD1 3.69Å; H160-F1237 AromaticContact NE2-CE1 3.69Å; G1188-F1237 WeakPolarHBondContact O-CE1 3.43Å; G1188-F1237 WeakPolarHBondContact O-CZ 3.48Å; I1191-F1237 HydrophobicContact CB-CE2 4.12Å; I1191-F1237 HydrophobicContact CB-CZ 4.02Å; I1191-F1237 HydrophobicContact CG2-CE2 3.74Å; I1191-F1237 HydrophobicContact CG2-CZ 4.14Å; A1192-F1237 HydrophobicContact CB-CD1 4.07Å; A1192-F1237 HydrophobicContact CB-CE1 3.73Å; A1192-F1237 HydrophobicContact CB-CE2 4.34Å; A1192-F1237 HydrophobicContact CB-CZ 3.9Å; L1195-F1237 HydrophobicContact CD1-CB 4.02Å; L1195-F1237 HydrophobicContact CD1-CD2 3.96Å; L1195-F1237 HydrophobicContact CD1-CG 4.22Å; V1233-F1237 HydrophobicContact CG1-CD2 3.71Å; V1233-F1237 HydrophobicContact CG1-CE2 3.73Å; V1233-F1237 WeakPolarHBondContact O-CD2 3.4Å; V1233-F1237 PolarHBondContact O-N 3.24Å; E1234-F1237 PolarHBondContact O-N 3.44Å; F1237-T1239 VanDerWaalsContact C-N 3.28Å; F1237-T1239 PolarHBondContact O-N 3.04Å; F1237-I1240 HydrophobicContact CD1-CD1 4.44Å; F1237-I1240 PolarHBondContact O-N 3.46Å; F1237-S1241 VanDerWaalsContact O-CB 3.3Å; F1237-S1241 WeakPolarHBondContact O-CB 3.4Å; F1237-S1241 PolarHBondContact O-N 3.47Å
1238	S	68.8	Low	74.6	Confident	37 Å²	37	30.9 Å²	30.9	26%	0.259	18%	0.175	S	C	.	.	H	α-helix	trans	-63	-38.4	170.6	-171.2	0	0	0	0	111.3	E1234 N1235 M1236 N1242	E1234-S1238 VanDerWaalsContact O-CB 3.26Å; E1234-S1238 WeakPolarHBondContact O-CB 3.46Å; E1234-S1238 PolarHBondContact O-N 2.91Å; N1235-S1238 PolarHBondContact O-N 3.31Å; M1236-S1238 PolarHBondContact O-N 3.44Å; S1238-N1242 WeakPolarHBondContact O-CB 3.36Å; S1238-N1242 PolarHBondContact O-N 3.44Å; S1238-N1242 VanDerWaalsContact O-N 3.1Å; S1238-N1242 PolarHBondContact O-ND2 3.08Å; S1238-N1242 VanDerWaalsContact O-ND2 3.17Å
1239	T	69.8	Low	74.3	Confident	19 Å²	19	28.3 Å²	28.3	12%	0.117	15%	0.154	C	C	.	.	H	α-helix	trans	-71.2	-38.8	177.3	-52.2	0	0	0	0	111.7	R1105 M1107 A1110 N1235 M1236 F1237 S1241	R1105-T1239 PolarHBondContact NH2-O 2.89Å; M1107-T1239 HydrophobicContact CE-CG2 3.85Å; M1107-T1239 HydrophobicContact SD-CG2 3.97Å; A1110-T1239 HydrophobicContact CB-CG2 3.78Å; A1110-T1239 WeakPolarHBondContact CB-OG1 3.46Å; N1235-T1239 WeakPolarHBondContact O-CB 3.35Å; N1235-T1239 PolarHBondContact O-N 2.92Å; N1235-T1239 PolarHBondContact O-OG1 3.05Å; M1236-T1239 WeakPolarHBondContact O-CB 3.43Å; M1236-T1239 PolarHBondContact O-N 3.35Å; F1237-T1239 VanDerWaalsContact C-N 3.28Å; F1237-T1239 PolarHBondContact O-N 3.04Å; T1239-S1241 VanDerWaalsContact C-N 3.35Å
1240	I	69	Low	73.5	Confident	6 Å²	6	30.2 Å²	30.2	3%	0.031	16%	0.164	C	C	.	.	H	α-helix	trans	-70.7	-34.6	178.7	-64.3	164.7	0	0	0	110.8	R1105 M1107 M1236 F1237	R1105-I1240 PolarHBondContact NH1-O 3.24Å; R1105-I1240 VanDerWaalsContact NH2-C 3.33Å; R1105-I1240 PolarHBondContact NH2-O 3.04Å; M1107-I1240 HydrophobicContact CE-CG1 4.19Å; M1236-I1240 HydrophobicContact CE-CD1 4.08Å; M1236-I1240 HydrophobicContact CG-CD1 3.73Å; M1236-I1240 VanDerWaalsContact O-CG1 3.24Å; M1236-I1240 WeakPolarHBondContact O-CG1 3.37Å; M1236-I1240 PolarHBondContact O-N 3.33Å; F1237-I1240 HydrophobicContact CD1-CD1 4.44Å; F1237-I1240 PolarHBondContact O-N 3.46Å
1241	S	65.5	Low	72.9	Confident	33 Å²	33	30.1 Å²	30.1	23%	0.231	17%	0.165	C	C	.	.	H	α-helix	trans	-75	-29.2	176.8	179.7	0	0	0	0	113.7	S791 V792 F1237 T1239	S791-S1241 PolarHBondContact OG-OG 3.25Å; V792-S1241 WeakPolarHBondContact CG2-O 3.46Å; F1237-S1241 VanDerWaalsContact O-CB 3.3Å; F1237-S1241 WeakPolarHBondContact O-CB 3.4Å; F1237-S1241 PolarHBondContact O-N 3.47Å; T1239-S1241 VanDerWaalsContact C-N 3.35Å
1242	N	58.5	Low	72.5	Confident	67 Å²	67	25.5 Å²	25.5	36%	0.358	15%	0.147	S	C	.	.			trans	-83.6	0	176.2	-71.7	-22.7	0	0	0	110.7	G472 R1105 S1238	G472-N1242 WeakPolarHBondContact CA-O 3.25Å; R1105-N1242 PolarHBondContact NH2-OXT 3.46Å; S1238-N1242 WeakPolarHBondContact O-CB 3.36Å; S1238-N1242 PolarHBondContact O-N 3.44Å; S1238-N1242 VanDerWaalsContact O-N 3.1Å; S1238-N1242 PolarHBondContact O-ND2 3.08Å; S1238-N1242 VanDerWaalsContact O-ND2 3.17Å

Retrieved 1,242 of 1,242 residues in 1804.3 ms (Link to these results)

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