A0A087X792_POEFO Loading...

Cilia and flagella associated protein 74

AlphaFold DB , UniProt , Accession A0A087X792, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 955 aa.

						>A0A087X792_POEFO|A0A087X792
MDEQAAKLKGEEIECQRKTEESRANRKIAAKYLRQSNKRLHQQVAEKEQQNREFIERRIQAVESLKSNIAANQESLRVQQKRAKKKVLKKEQDERHLKASLEAQGFNGFKHVYLKRQLEETNRKQQEFEESQKSKRLEIVAKILQEEQLVKGRSKAPPPNLSAHDKFSSLRQGREVLLSYLEPKVPSAPTSPTSNTHLMSSSTSSDGENFKMEMEEMDEIAHKRTDYSTPSDFLAEPEFSGLWEQECKVFQLIKHITEATVQHSSKTQQNNTTERIKDLKYVISFNVTQTKELKRPPFSSKPEVVLFKDFEVGKRYKKRIVLTNISYTINFCKFIRISAALKDFISVNFQPPGSLSTGMSCEILVIFHPLINEDLEGEIYFESTFGPFSVPVRCTIKKCSPEVDCQSIDFGSHVVGESVSRTITLTNNGALASFFSVGTSMHLSAARSRSQIFGSQVAKTSSPFMYYIRQSSYSLSLEEVHAKRQSFSTESGKNTAELNQSKTYKSLTPLWQRRALTLAHAMHQFPAELLPHKVLKQRSYITLNILKLGMVRGGEIGPFQSVKLEMLFKPTVPGETIMDFYIRFSDANTKPIPIHVSGVAVSNPVWVVHPSIDLKICTFDRLYQYTIVVQSRENRAFKLTFDVCPEMRKHLQIIPIRGFIQALSTFNAQLKFIPRQSLPKDAQKYFDSDTGVLEVPMTVQVAGQVLPAKYTIHAIVTSSDLQFDQIQVDFGHCSIYHFVRTTVRLTNMSILPQDFGFVAVPEYIEVQPYDGFGTLLPQETLELDLIFRPKKPIEYNFQLRCKSGIDRDFVLPCRGVGFHPPLVLSHSLIQFRPTPVGDKSTATIYLTNYQDKEAATRLFKVISAVEAPRLFCFSLPKDSDISISPSVGRLLPGERCLVQVMFRPVLREKTVTEEALRLHRIAKATSEKEPEVSRVTEHERKHSAADQIMTEKKML
					

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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	50.7	Low	59.6	Low	201 Å²	201	120.5 Å²	120.5	99%	0.99	63%	0.633	S	S	*	*				0	2.2	0	-75.2	-166.6	-72.5	0	0	112	E3	M1-E3 PolarHBondContact O-N 2.9Å
2	D	54.7	Low	60.4	Low	132 Å²	132	120.1 Å²	120.1	71%	0.706	63%	0.625	S	S	*	*	H	α-helix	trans	-84.8	-24.1	-151.1	-52.6	-92.7	0	0	0	113	A5 A6	D2-A5 PolarHBondContact O-N 3.48Å; D2-A6 WeakPolarHBondContact O-CB 3.49Å; D2-A6 PolarHBondContact O-N 3.25Å
3	E	54	Low	61.5	Low	173 Å²	173	119.6 Å²	119.6	81%	0.808	62%	0.622	S	S	*	*	H	α-helix	trans	-66.6	-38.3	-179.7	-165.5	170.5	-154	0	0	112.8	M1 K7	M1-E3 PolarHBondContact O-N 2.9Å; E3-K7 PolarHBondContact O-N 3.18Å
4	Q	55.2	Low	62.2	Low	151 Å²	151	117.4 Å²	117.4	71%	0.706	61%	0.607	S	S	*	*	H	α-helix	trans	-69.5	-37.8	172.8	-73.9	179.8	-34.6	0	0	111.9	K7 L8	Q4-K7 PolarHBondContact O-N 3.35Å; Q4-L8 PolarHBondContact O-N 3.38Å; Q4-L8 VanDerWaalsContact O-N 3.09Å
5	A	58	Low	62.8	Low	53 Å²	53	114.6 Å²	114.6	44%	0.438	60%	0.6	S	S	.	*	H	α-helix	trans	-68	-35.3	178	0	0	0	0	0	112.5	D2 K9	D2-A5 PolarHBondContact O-N 3.48Å; A5-K9 WeakPolarHBondContact O-CG 3.5Å; A5-K9 PolarHBondContact O-N 3.08Å
6	A	60.4	Low	63.5	Low	65 Å²	65	114 Å²	114	54%	0.537	59%	0.593	S	S	.	*	H	α-helix	trans	-65.7	-43.5	172.9	0	0	0	0	0	111.7	D2 K9 G10	D2-A6 WeakPolarHBondContact O-CB 3.49Å; D2-A6 PolarHBondContact O-N 3.25Å; A6-K9 PolarHBondContact O-N 3.39Å; A6-G10 PolarHBondContact O-N 3.34Å; A6-G10 VanDerWaalsContact O-N 3.08Å
7	K	62.2	Low	64.4	Low	145 Å²	145	116.5 Å²	116.5	63%	0.63	59%	0.593	S	S	*	*	H	α-helix	trans	-66	-46.2	-177.7	-152.4	174.3	-173.9	179	0	112.6	E3 Q4 K9 G10 E11	E3-K7 PolarHBondContact O-N 3.18Å; Q4-K7 PolarHBondContact O-N 3.35Å; K7-K9 VanDerWaalsContact C-N 3.33Å; K7-K9 PolarHBondContact O-N 3.04Å; K7-G10 PolarHBondContact O-N 3.5Å; K7-G10 VanDerWaalsContact O-N 3.11Å; K7-E11 PolarHBondContact O-N 2.91Å
8	L	60.9	Low	65.1	Low	115 Å²	115	116.3 Å²	116.3	60%	0.602	59%	0.588	S	S	*	*	H	α-helix	trans	-58.4	-41.2	175.2	-76	166.2	0	0	0	112.5	Q4 E11 E12	Q4-L8 PolarHBondContact O-N 3.38Å; Q4-L8 VanDerWaalsContact O-N 3.09Å; L8-E11 PolarHBondContact O-N 3.41Å; L8-E12 WeakPolarHBondContact O-CB 3.44Å; L8-E12 PolarHBondContact O-N 3.02Å
9	K	64.3	Low	65.7	Low	139 Å²	139	113.4 Å²	113.4	60%	0.604	58%	0.576	S	S	*	*	H	α-helix	trans	-65.9	-36.3	175.2	-77.7	-178.7	173.7	-179.8	0	113	A5 A6 K7 I13	A5-K9 WeakPolarHBondContact O-CG 3.5Å; A5-K9 PolarHBondContact O-N 3.08Å; A6-K9 PolarHBondContact O-N 3.39Å; K7-K9 VanDerWaalsContact C-N 3.33Å; K7-K9 PolarHBondContact O-N 3.04Å; K9-I13 WeakPolarHBondContact O-CB 3.24Å; K9-I13 WeakPolarHBondContact O-CD1 3.36Å; K9-I13 VanDerWaalsContact O-CG1 3.24Å; K9-I13 WeakPolarHBondContact O-CG1 3.49Å; K9-I13 PolarHBondContact O-N 3.38Å
10	G	66.6	Low	66.5	Low	40 Å²	40	114.3 Å²	114.3	41%	0.412	58%	0.578	S	S	.	*	H	α-helix	trans	-62.8	-47.9	173.8	0	0	0	0	0	112.1	A6 K7 E12 I13 E14	A6-G10 PolarHBondContact O-N 3.34Å; A6-G10 VanDerWaalsContact O-N 3.08Å; K7-G10 PolarHBondContact O-N 3.5Å; K7-G10 VanDerWaalsContact O-N 3.11Å; G10-E12 PolarHBondContact O-N 3.11Å; G10-I13 PolarHBondContact O-N 3.09Å; G10-E14 PolarHBondContact O-N 2.97Å
11	E	68.3	Low	67.1	Low	112 Å²	112	113.9 Å²	113.9	52%	0.523	57%	0.574	S	S	.	*	H	α-helix	trans	-64	-38.9	177.9	-69.8	169.9	-167.6	0	0	112.1	K7 L8 E14 C15	K7-E11 PolarHBondContact O-N 2.91Å; L8-E11 PolarHBondContact O-N 3.41Å; E11-E14 PolarHBondContact O-N 3.42Å; E11-C15 VanDerWaalsContact O-CB 3.25Å; E11-C15 WeakPolarHBondContact O-CB 3.35Å; E11-C15 PolarHBondContact O-N 3.01Å
12	E	69.8	Low	68	Low	115 Å²	115	108 Å²	108	54%	0.537	55%	0.552	S	S	.	*	H	α-helix	trans	-64.6	-44.9	175.3	-173.3	174.4	-154.9	0	0	112.3	L8 G10 C15 Q16	L8-E12 WeakPolarHBondContact O-CB 3.44Å; L8-E12 PolarHBondContact O-N 3.02Å; G10-E12 PolarHBondContact O-N 3.11Å; E12-C15 WeakPolarHBondContact O-CB 3.47Å; E12-C15 PolarHBondContact O-N 3.32Å; E12-Q16 WeakPolarHBondContact O-CG 3.25Å; E12-Q16 PolarHBondContact O-N 3Å
13	I	74.7	Confident	69.1	Low	114 Å²	114	109.2 Å²	109.2	59%	0.585	55%	0.547	S	S	*	.	H	α-helix	trans	-64.1	-41.7	176.7	-69.9	165.8	0	0	0	111.1	K9 G10 Q16 R17	K9-I13 WeakPolarHBondContact O-CB 3.24Å; K9-I13 WeakPolarHBondContact O-CD1 3.36Å; K9-I13 VanDerWaalsContact O-CG1 3.24Å; K9-I13 WeakPolarHBondContact O-CG1 3.49Å; K9-I13 PolarHBondContact O-N 3.38Å; G10-I13 PolarHBondContact O-N 3.09Å; I13-Q16 PolarHBondContact O-N 3.46Å; I13-R17 PolarHBondContact O-N 3.2Å
14	E	71.1	Confident	70.4	Confident	89 Å²	89	103 Å²	103	42%	0.416	53%	0.525	S	S	.	.	H	α-helix	trans	-69	-35.8	177.5	-158.8	-173.1	145.6	0	0	112	G10 E11 R17 K18	G10-E14 PolarHBondContact O-N 2.97Å; E11-E14 PolarHBondContact O-N 3.42Å; E14-R17 PolarHBondContact O-N 3.33Å; E14-K18 WeakPolarHBondContact O-CG 3.34Å; E14-K18 PolarHBondContact O-N 2.97Å; E14-K18 WeakPolarHBondContact OE1-CE 3.4Å; E14-K18 IonicContact OE1-NZ 2.62Å; E14-K18 PolarHBondContact OE1-NZ 3.5Å
15	C	71	Confident	71.5	Confident	75 Å²	75	100 Å²	100	51%	0.507	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-49.5	171.8	-172.9	0	0	0	0	111.2	E11 E12 R17 K18 T19	E11-C15 VanDerWaalsContact O-CB 3.25Å; E11-C15 WeakPolarHBondContact O-CB 3.35Å; E11-C15 PolarHBondContact O-N 3.01Å; E12-C15 WeakPolarHBondContact O-CB 3.47Å; E12-C15 PolarHBondContact O-N 3.32Å; C15-R17 PolarHBondContact O-N 2.91Å; C15-K18 PolarHBondContact O-N 2.77Å; C15-T19 WeakPolarHBondContact O-CG2 3.17Å; C15-T19 PolarHBondContact O-N 3.2Å
16	Q	74.7	Confident	72.5	Confident	105 Å²	105	107.2 Å²	107.2	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-55.2	-51	175.6	-72.5	178.4	22.3	0	0	110.9	E12 I13 K18 T19 E20	E12-Q16 WeakPolarHBondContact O-CG 3.25Å; E12-Q16 PolarHBondContact O-N 3Å; I13-Q16 PolarHBondContact O-N 3.46Å; Q16-K18 VanDerWaalsContact C-N 3.34Å; Q16-K18 PolarHBondContact O-N 3.48Å; Q16-T19 PolarHBondContact O-N 3Å; Q16-T19 PolarHBondContact O-OG1 3.4Å; Q16-E20 PolarHBondContact O-N 2.89Å
17	R	79.1	Confident	73.7	Confident	157 Å²	157	111.9 Å²	111.9	59%	0.592	54%	0.538	S	S	*	.	H	α-helix	trans	-55.1	-44.9	177.4	-167.9	178	72.6	128	0.1	112.6	I13 E14 C15 T19 E20 E21	I13-R17 PolarHBondContact O-N 3.2Å; E14-R17 PolarHBondContact O-N 3.33Å; C15-R17 PolarHBondContact O-N 2.91Å; R17-T19 VanDerWaalsContact C-N 3.35Å; R17-T19 PolarHBondContact O-N 3.17Å; R17-E20 PolarHBondContact O-N 2.92Å; R17-E21 WeakPolarHBondContact O-CB 3.44Å; R17-E21 PolarHBondContact O-N 3.46Å
18	K	77.3	Confident	74.8	Confident	113 Å²	113	109 Å²	109	49%	0.491	53%	0.529	S	S	.	.	H	α-helix	trans	-63	-36.8	175.9	-73.8	168.7	-177.5	165.5	0	112.4	E14 C15 Q16 S22	E14-K18 WeakPolarHBondContact O-CG 3.34Å; E14-K18 PolarHBondContact O-N 2.97Å; E14-K18 WeakPolarHBondContact OE1-CE 3.4Å; E14-K18 IonicContact OE1-NZ 2.62Å; E14-K18 PolarHBondContact OE1-NZ 3.5Å; C15-K18 PolarHBondContact O-N 2.77Å; Q16-K18 VanDerWaalsContact C-N 3.34Å; Q16-K18 PolarHBondContact O-N 3.48Å; K18-S22 VanDerWaalsContact O-CB 3.24Å; K18-S22 WeakPolarHBondContact O-CB 3.48Å; K18-S22 PolarHBondContact O-N 2.81Å
19	T	75.3	Confident	75.8	Confident	61 Å²	61	106.3 Å²	106.3	37%	0.374	52%	0.523	S	S	.	.	H	α-helix	trans	-69.7	-34.6	174.3	70.2	0	0	0	0	112.8	C15 Q16 R17 R23	C15-T19 WeakPolarHBondContact O-CG2 3.17Å; C15-T19 PolarHBondContact O-N 3.2Å; Q16-T19 PolarHBondContact O-N 3Å; Q16-T19 PolarHBondContact O-OG1 3.4Å; R17-T19 VanDerWaalsContact C-N 3.35Å; R17-T19 PolarHBondContact O-N 3.17Å; T19-R23 WeakPolarHBondContact O-CB 3.41Å; T19-R23 WeakPolarHBondContact O-CD 3.46Å; T19-R23 WeakPolarHBondContact O-CG 3.24Å; T19-R23 PolarHBondContact O-N 2.93Å
20	E	81.5	Confident	76.8	Confident	130 Å²	130	101.7 Å²	101.7	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-71.6	-42.4	176.7	-65.5	-157.9	133.7	0	0	112.3	Q16 R17 R23 A24	Q16-E20 PolarHBondContact O-N 2.89Å; R17-E20 PolarHBondContact O-N 2.92Å; E20-R23 CarbonylContact O-C 3.56Å; E20-R23 WeakPolarHBondContact O-CB 3.44Å; E20-R23 PolarHBondContact O-N 3.23Å; E20-A24 WeakPolarHBondContact O-CB 3Å; E20-A24 PolarHBondContact O-N 2.98Å
21	E	79.7	Confident	77.8	Confident	107 Å²	107	107.1 Å²	107.1	50%	0.5	52%	0.523	S	S	.	.	H	α-helix	trans	-61.6	-43	172.9	-174.8	169.5	-160.7	0	0	111.3	R17 R23 A24 N25	R17-E21 WeakPolarHBondContact O-CB 3.44Å; R17-E21 PolarHBondContact O-N 3.46Å; E21-R23 PolarHBondContact O-N 3.45Å; E21-A24 PolarHBondContact O-N 2.98Å; E21-N25 WeakPolarHBondContact O-CB 3.34Å; E21-N25 PolarHBondContact O-N 2.95Å; E21-N25 PolarHBondContact O-ND2 3.04Å
22	S	70	Confident	78.8	Confident	76 Å²	76	109 Å²	109	53%	0.531	53%	0.526	S	S	.	.	H	α-helix	trans	-59.9	-42.7	171.4	-179.4	0	0	0	0	112.5	K18 A24 R26	K18-S22 VanDerWaalsContact O-CB 3.24Å; K18-S22 WeakPolarHBondContact O-CB 3.48Å; K18-S22 PolarHBondContact O-N 2.81Å; S22-A24 PolarHBondContact O-N 2.62Å; S22-R26 VanDerWaalsContact O-CB 3.3Å; S22-R26 WeakPolarHBondContact O-CB 3.39Å; S22-R26 PolarHBondContact O-N 3.44Å
23	R	76.9	Confident	79.5	Confident	159 Å²	159	108.7 Å²	108.7	60%	0.6	53%	0.528	S	S	*	.	H	α-helix	trans	-64.4	-37.2	174.1	-74.2	163.3	176.9	-177.4	0.5	112.2	T19 E20 E21 K27	T19-R23 WeakPolarHBondContact O-CB 3.41Å; T19-R23 WeakPolarHBondContact O-CD 3.46Å; T19-R23 WeakPolarHBondContact O-CG 3.24Å; T19-R23 PolarHBondContact O-N 2.93Å; E20-R23 CarbonylContact O-C 3.56Å; E20-R23 WeakPolarHBondContact O-CB 3.44Å; E20-R23 PolarHBondContact O-N 3.23Å; E21-R23 PolarHBondContact O-N 3.45Å; R23-K27 WeakPolarHBondContact O-CG 3.3Å; R23-K27 PolarHBondContact O-N 3.48Å; R23-K27 VanDerWaalsContact O-N 3.14Å
24	A	82.4	Confident	80.1	Confident	42 Å²	42	112.4 Å²	112.4	35%	0.347	54%	0.535	S	S	.	.	H	α-helix	trans	-67.9	-49.7	175.9	0	0	0	0	0	111.3	E20 E21 S22 R26 K27 I28	E20-A24 WeakPolarHBondContact O-CB 3Å; E20-A24 PolarHBondContact O-N 2.98Å; E21-A24 PolarHBondContact O-N 2.98Å; S22-A24 PolarHBondContact O-N 2.62Å; A24-R26 VanDerWaalsContact C-N 3.3Å; A24-R26 PolarHBondContact O-N 3.26Å; A24-K27 WeakPolarHBondContact O-CA 3.5Å; A24-K27 WeakPolarHBondContact O-CB 3.42Å; A24-K27 PolarHBondContact O-N 3.04Å; A24-I28 WeakPolarHBondContact O-CG1 3.49Å; A24-I28 PolarHBondContact O-N 2.9Å
25	N	77.8	Confident	80.9	Confident	89 Å²	89	112.6 Å²	112.6	48%	0.476	54%	0.535	S	S	.	.	H	α-helix	trans	-60.2	-38.4	176.6	-72.8	-26.8	0	0	0	111.8	E21 K27 I28 A29	E21-N25 WeakPolarHBondContact O-CB 3.34Å; E21-N25 PolarHBondContact O-N 2.95Å; E21-N25 PolarHBondContact O-ND2 3.04Å; N25-K27 PolarHBondContact O-N 3.14Å; N25-I28 PolarHBondContact O-N 3.36Å; N25-A29 WeakPolarHBondContact O-CB 3.24Å; N25-A29 PolarHBondContact O-N 3.04Å
26	R	77.9	Confident	81.7	Confident	204 Å²	204	112.3 Å²	112.3	77%	0.77	53%	0.534	S	S	*	.	H	α-helix	trans	-64.5	-36.6	173	-168.4	172.7	-177.5	174.6	1.2	113.1	S22 A24 A30	S22-R26 VanDerWaalsContact O-CB 3.3Å; S22-R26 WeakPolarHBondContact O-CB 3.39Å; S22-R26 PolarHBondContact O-N 3.44Å; A24-R26 VanDerWaalsContact C-N 3.3Å; A24-R26 PolarHBondContact O-N 3.26Å; R26-A30 WeakPolarHBondContact O-CB 3.37Å; R26-A30 PolarHBondContact O-N 3.11Å
27	K	87.5	Confident	82.1	Confident	162 Å²	162	110.8 Å²	110.8	70%	0.704	53%	0.529	S	S	*	.	H	α-helix	trans	-66.5	-40.7	172.5	-72.1	168.5	-178.6	176.7	0	111.7	R23 A24 N25 A30 K31	R23-K27 WeakPolarHBondContact O-CG 3.3Å; R23-K27 PolarHBondContact O-N 3.48Å; R23-K27 VanDerWaalsContact O-N 3.14Å; A24-K27 WeakPolarHBondContact O-CA 3.5Å; A24-K27 WeakPolarHBondContact O-CB 3.42Å; A24-K27 PolarHBondContact O-N 3.04Å; N25-K27 PolarHBondContact O-N 3.14Å; K27-A30 PolarHBondContact O-N 2.84Å; K27-K31 PolarHBondContact O-N 3.35Å
28	I	84.6	Confident	82.7	Confident	86 Å²	86	111 Å²	111	44%	0.441	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-48.8	177.5	-67.7	165.1	0	0	0	110.6	A24 N25 A30 K31 Y32	A24-I28 WeakPolarHBondContact O-CG1 3.49Å; A24-I28 PolarHBondContact O-N 2.9Å; N25-I28 PolarHBondContact O-N 3.36Å; I28-A30 VanDerWaalsContact C-N 3.32Å; I28-A30 PolarHBondContact O-N 3.29Å; I28-K31 WeakPolarHBondContact O-CB 3.41Å; I28-K31 PolarHBondContact O-N 3.4Å; I28-Y32 HydrophobicContact CG2-CD2 3.83Å; I28-Y32 HydrophobicContact CG2-CE2 3.49Å; I28-Y32 VanDerWaalsContact CG2-CE2 3.49Å; I28-Y32 WeakPolarHBondContact O-CD2 3.39Å; I28-Y32 PolarHBondContact O-N 2.87Å
29	A	80.9	Confident	83.3	Confident	57 Å²	57	113.2 Å²	113.2	47%	0.471	54%	0.54	S	S	.	.	H	α-helix	trans	-57.8	-42.8	175	0	0	0	0	0	112	N25 K31 Y32 L33	N25-A29 WeakPolarHBondContact O-CB 3.24Å; N25-A29 PolarHBondContact O-N 3.04Å; A29-K31 VanDerWaalsContact C-N 3.31Å; A29-K31 PolarHBondContact O-N 3.06Å; A29-Y32 PolarHBondContact O-N 2.86Å; A29-L33 WeakPolarHBondContact O-CB 3.45Å; A29-L33 PolarHBondContact O-N 3.41Å
30	A	85.8	Confident	83.9	Confident	42 Å²	42	115 Å²	115	35%	0.347	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-32.4	175.3	0	0	0	0	0	113.3	R26 K27 I28 R34	R26-A30 WeakPolarHBondContact O-CB 3.37Å; R26-A30 PolarHBondContact O-N 3.11Å; K27-A30 PolarHBondContact O-N 2.84Å; I28-A30 VanDerWaalsContact C-N 3.32Å; I28-A30 PolarHBondContact O-N 3.29Å; A30-R34 WeakPolarHBondContact O-CB 3.43Å; A30-R34 WeakPolarHBondContact O-CD 3.44Å; A30-R34 VanDerWaalsContact O-CG 3.24Å; A30-R34 WeakPolarHBondContact O-CG 3.41Å; A30-R34 PolarHBondContact O-N 3.05Å; A30-R34 VanDerWaalsContact O-N 3.11Å
31	K	88.7	Confident	84.1	Confident	155 Å²	155	115.1 Å²	115.1	67%	0.674	55%	0.547	S	S	*	.	H	α-helix	trans	-66.8	-46.3	173.5	-172	-179.6	177.9	-176.1	0	111.1	K27 I28 A29 R34 Q35	K27-K31 PolarHBondContact O-N 3.35Å; I28-K31 WeakPolarHBondContact O-CB 3.41Å; I28-K31 PolarHBondContact O-N 3.4Å; A29-K31 VanDerWaalsContact C-N 3.31Å; A29-K31 PolarHBondContact O-N 3.06Å; K31-R34 PolarHBondContact O-N 3.38Å; K31-Q35 PolarHBondContact O-N 3.03Å
32	Y	88.1	Confident	84.7	Confident	150 Å²	150	115.6 Å²	115.6	59%	0.588	55%	0.549	S	S	*	.	H	α-helix	trans	-65.7	-41.1	176.2	-71.5	-55.8	0	0	0	112.8	I28 A29 R34 Q35 S36	I28-Y32 HydrophobicContact CG2-CD2 3.83Å; I28-Y32 HydrophobicContact CG2-CE2 3.49Å; I28-Y32 VanDerWaalsContact CG2-CE2 3.49Å; I28-Y32 WeakPolarHBondContact O-CD2 3.39Å; I28-Y32 PolarHBondContact O-N 2.87Å; A29-Y32 PolarHBondContact O-N 2.86Å; Y32-R34 VanDerWaalsContact C-N 3.35Å; Y32-R34 PolarHBondContact O-N 3.28Å; Y32-Q35 PolarHBondContact O-N 3.18Å; Y32-Q35 VanDerWaalsContact O-N 3.14Å; Y32-S36 WeakPolarHBondContact O-CB 3.34Å; Y32-S36 PolarHBondContact O-N 3.43Å
33	L	85.3	Confident	85.5	Confident	109 Å²	109	117.1 Å²	117.1	57%	0.571	55%	0.548	S	S	*	.	H	α-helix	trans	-58.2	-46	174.7	-168.9	83.4	0	0	0	111.4	A29 Q35 S36 N37	A29-L33 WeakPolarHBondContact O-CB 3.45Å; A29-L33 PolarHBondContact O-N 3.41Å; L33-Q35 VanDerWaalsContact C-N 3.32Å; L33-Q35 PolarHBondContact O-N 3.14Å; L33-S36 PolarHBondContact O-N 2.92Å; L33-N37 PolarHBondContact O-N 2.84Å
34	R	87	Confident	86	Confident	193 Å²	193	113 Å²	113	73%	0.728	54%	0.54	S	S	*	.	H	α-helix	trans	-62.5	-37.2	175.7	-73.8	170.6	178.4	-171.1	-0.8	112.4	A30 K31 Y32 K38	A30-R34 WeakPolarHBondContact O-CB 3.43Å; A30-R34 WeakPolarHBondContact O-CD 3.44Å; A30-R34 VanDerWaalsContact O-CG 3.24Å; A30-R34 WeakPolarHBondContact O-CG 3.41Å; A30-R34 PolarHBondContact O-N 3.05Å; A30-R34 VanDerWaalsContact O-N 3.11Å; K31-R34 PolarHBondContact O-N 3.38Å; Y32-R34 VanDerWaalsContact C-N 3.35Å; Y32-R34 PolarHBondContact O-N 3.28Å; R34-K38 WeakPolarHBondContact O-CG 3.49Å; R34-K38 PolarHBondContact O-N 2.81Å; R34-K38 VanDerWaalsContact O-N 3.13Å
35	Q	88.3	Confident	86.4	Confident	92 Å²	92	113.7 Å²	113.7	43%	0.43	55%	0.546	S	S	.	.	H	α-helix	trans	-70.8	-37.4	176.3	-167.2	174	11.4	0	0	112.2	K31 Y32 L33 R39	K31-Q35 PolarHBondContact O-N 3.03Å; Y32-Q35 PolarHBondContact O-N 3.18Å; Y32-Q35 VanDerWaalsContact O-N 3.14Å; L33-Q35 VanDerWaalsContact C-N 3.32Å; L33-Q35 PolarHBondContact O-N 3.14Å; Q35-R39 PolarHBondContact O-N 3.44Å
36	S	86.7	Confident	87.1	Confident	69 Å²	69	113.7 Å²	113.7	48%	0.483	54%	0.543	S	S	.	.	H	α-helix	trans	-65	-49.7	174.7	-165.3	0	0	0	0	111.5	Y32 L33 K38 R39 L40	Y32-S36 WeakPolarHBondContact O-CB 3.34Å; Y32-S36 PolarHBondContact O-N 3.43Å; L33-S36 PolarHBondContact O-N 2.92Å; S36-K38 VanDerWaalsContact C-N 3.29Å; S36-K38 PolarHBondContact O-N 3.02Å; S36-R39 WeakPolarHBondContact O-CB 3.45Å; S36-R39 PolarHBondContact O-N 3.13Å; S36-L40 PolarHBondContact O-N 3.06Å
37	N	82.9	Confident	87.6	Confident	73 Å²	73	110.7 Å²	110.7	39%	0.39	54%	0.536	S	S	.	.	H	α-helix	trans	-60.6	-36.7	177.3	-72.5	-13.5	0	0	0	112.3	L33 L40 H41	L33-N37 PolarHBondContact O-N 2.84Å; N37-L40 PolarHBondContact O-N 3.42Å; N37-H41 PolarHBondContact O-CD2 3.32Å; N37-H41 PolarHBondContact O-N 2.81Å
38	K	91.9	Very high	87.6	Confident	161 Å²	161	107.5 Å²	107.5	70%	0.7	52%	0.523	S	S	*	.	H	α-helix	trans	-61.4	-43.9	172.3	-80.3	-170.5	173.9	-164	0	112.6	R34 S36 L40 H41 Q42	R34-K38 WeakPolarHBondContact O-CG 3.49Å; R34-K38 PolarHBondContact O-N 2.81Å; R34-K38 VanDerWaalsContact O-N 3.13Å; S36-K38 VanDerWaalsContact C-N 3.29Å; S36-K38 PolarHBondContact O-N 3.02Å; K38-L40 VanDerWaalsContact C-N 3.35Å; K38-H41 PolarHBondContact O-N 3.48Å; K38-Q42 WeakPolarHBondContact O-CB 3.19Å; K38-Q42 PolarHBondContact O-N 3.3Å
39	R	89.7	Confident	87.9	Confident	161 Å²	161	109.1 Å²	109.1	61%	0.608	53%	0.529	S	S	*	.	H	α-helix	trans	-62.9	-40.5	174.8	-71.4	174.1	173.5	171.1	-2.7	111.8	Q35 S36 Q42 Q43	Q35-R39 PolarHBondContact O-N 3.44Å; S36-R39 WeakPolarHBondContact O-CB 3.45Å; S36-R39 PolarHBondContact O-N 3.13Å; R39-Q42 PolarHBondContact O-N 2.92Å; R39-Q43 WeakPolarHBondContact O-CG 3.45Å; R39-Q43 PolarHBondContact O-N 2.84Å
40	L	89.3	Confident	88.3	Confident	99 Å²	99	112.7 Å²	112.7	52%	0.518	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-51.2	176.5	-168.9	78.5	0	0	0	111.5	S36 N37 K38 Q42 Q43 V44	S36-L40 PolarHBondContact O-N 3.06Å; N37-L40 PolarHBondContact O-N 3.42Å; K38-L40 VanDerWaalsContact C-N 3.35Å; L40-Q42 VanDerWaalsContact C-N 3.3Å; L40-Q42 PolarHBondContact O-N 3.05Å; L40-Q43 PolarHBondContact O-N 2.98Å; L40-V44 WeakPolarHBondContact O-CG2 3.21Å; L40-V44 PolarHBondContact O-N 3.42Å
41	H	84.7	Confident	88.4	Confident	132 Å²	132	115 Å²	115	61%	0.611	54%	0.543	S	S	*	.	H	α-helix	trans	-61	-37.9	177.8	-73.4	-60.6	0	0	0	112.5	N37 K38 V44 A45	N37-H41 PolarHBondContact O-CD2 3.32Å; N37-H41 PolarHBondContact O-N 2.81Å; K38-H41 PolarHBondContact O-N 3.48Å; H41-V44 PolarHBondContact O-N 2.94Å; H41-A45 PolarHBondContact O-N 3.22Å
42	Q	91.9	Very high	88.5	Confident	116 Å²	116	115.4 Å²	115.4	54%	0.542	54%	0.54	S	S	.	.	H	α-helix	trans	-63.6	-47.5	175	-178.3	174.4	-14.2	0	0	111.7	K38 R39 L40 V44 A45 E46	K38-Q42 WeakPolarHBondContact O-CB 3.19Å; K38-Q42 PolarHBondContact O-N 3.3Å; R39-Q42 PolarHBondContact O-N 2.92Å; L40-Q42 VanDerWaalsContact C-N 3.3Å; L40-Q42 PolarHBondContact O-N 3.05Å; Q42-V44 VanDerWaalsContact C-N 3.28Å; Q42-V44 PolarHBondContact O-N 2.68Å; Q42-A45 PolarHBondContact O-N 3.47Å; Q42-E46 HydrophobicContact CG-CG 4.44Å; Q42-E46 VanDerWaalsContact CG-OE1 3.23Å; Q42-E46 WeakPolarHBondContact CG-OE1 3.36Å; Q42-E46 PolarHBondContact NE2-OE1 3.12Å; Q42-E46 WeakPolarHBondContact O-CG 3.49Å; Q42-E46 PolarHBondContact O-N 3.29Å
43	Q	87.1	Confident	88.8	Confident	109 Å²	109	111.6 Å²	111.6	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-63.7	-30.7	176.3	-73.8	-174.4	-5.8	0	0	113.5	R39 L40 K47	R39-Q43 WeakPolarHBondContact O-CG 3.45Å; R39-Q43 PolarHBondContact O-N 2.84Å; L40-Q43 PolarHBondContact O-N 2.98Å; Q43-K47 WeakPolarHBondContact O-CB 3.23Å; Q43-K47 VanDerWaalsContact O-CG 3.29Å; Q43-K47 WeakPolarHBondContact O-CG 3.38Å; Q43-K47 PolarHBondContact O-N 2.91Å; Q43-K47 VanDerWaalsContact O-N 3.16Å
44	V	86.6	Confident	89	Confident	72 Å²	72	112.1 Å²	112.1	44%	0.436	53%	0.525	S	S	.	.	H	α-helix	trans	-68.5	-46.4	172.9	171.2	0	0	0	0	110.5	L40 H41 Q42 K47 E48	L40-V44 WeakPolarHBondContact O-CG2 3.21Å; L40-V44 PolarHBondContact O-N 3.42Å; H41-V44 PolarHBondContact O-N 2.94Å; Q42-V44 VanDerWaalsContact C-N 3.28Å; Q42-V44 PolarHBondContact O-N 2.68Å; V44-K47 PolarHBondContact O-N 2.98Å; V44-E48 PolarHBondContact O-N 3.38Å
45	A	92.1	Very high	89.1	Confident	57 Å²	57	106.7 Å²	106.7	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-42.9	177.5	0	0	0	0	0	112.6	H41 Q42 K47 E48 Q49	H41-A45 PolarHBondContact O-N 3.22Å; Q42-A45 PolarHBondContact O-N 3.47Å; A45-K47 PolarHBondContact O-N 3.18Å; A45-E48 PolarHBondContact O-N 3.46Å; A45-Q49 PolarHBondContact O-N 2.98Å
46	E	92	Very high	89.3	Confident	88 Å²	88	107.7 Å²	107.7	41%	0.411	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-42	175.8	-72.8	167	-176.1	0	0	111.6	Q42 Q49 Q50	Q42-E46 HydrophobicContact CG-CG 4.44Å; Q42-E46 VanDerWaalsContact CG-OE1 3.23Å; Q42-E46 WeakPolarHBondContact CG-OE1 3.36Å; Q42-E46 PolarHBondContact NE2-OE1 3.12Å; Q42-E46 WeakPolarHBondContact O-CG 3.49Å; Q42-E46 PolarHBondContact O-N 3.29Å; E46-Q49 PolarHBondContact O-N 3.25Å; E46-Q50 WeakPolarHBondContact O-CG 3.42Å; E46-Q50 PolarHBondContact O-N 3.38Å
47	K	88.4	Confident	89.6	Confident	141 Å²	141	112 Å²	112	61%	0.613	52%	0.52	S	S	*	.	H	α-helix	trans	-68.7	-38.2	174.8	-75.4	176	-179.5	178.4	0	113	Q43 V44 A45 Q49 Q50 N51	Q43-K47 WeakPolarHBondContact O-CB 3.23Å; Q43-K47 VanDerWaalsContact O-CG 3.29Å; Q43-K47 WeakPolarHBondContact O-CG 3.38Å; Q43-K47 PolarHBondContact O-N 2.91Å; Q43-K47 VanDerWaalsContact O-N 3.16Å; V44-K47 PolarHBondContact O-N 2.98Å; A45-K47 PolarHBondContact O-N 3.18Å; K47-Q49 VanDerWaalsContact C-N 3.35Å; K47-Q50 PolarHBondContact O-N 3.4Å; K47-N51 WeakPolarHBondContact O-CB 3.49Å; K47-N51 PolarHBondContact O-N 3.35Å
48	E	87.6	Confident	90	Very high	95 Å²	95	116.1 Å²	116.1	44%	0.444	53%	0.53	S	S	.	.	H	α-helix	trans	-62.1	-42.3	172.9	-87.1	-164	-140.7	0	0	111.8	V44 A45 N51 R52	V44-E48 PolarHBondContact O-N 3.38Å; A45-E48 PolarHBondContact O-N 3.46Å; E48-N51 PolarHBondContact O-N 3.33Å; E48-R52 VanDerWaalsContact O-CG 3.28Å; E48-R52 WeakPolarHBondContact O-CG 3.28Å; E48-R52 PolarHBondContact O-N 3.13Å; E48-R52 IonicContact OE2-CZ 3.81Å; E48-R52 IonicContact OE2-NE 3.85Å; E48-R52 IonicContact OE2-NH2 2.89Å; E48-R52 PolarHBondContact OE2-NH2 2.96Å
49	Q	91.3	Very high	90	Very high	120 Å²	120	112.7 Å²	112.7	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-64.7	-47	177.2	-175.7	174.7	-28.7	0	0	111.4	A45 E46 K47 N51 R52 E53	A45-Q49 PolarHBondContact O-N 2.98Å; E46-Q49 PolarHBondContact O-N 3.25Å; K47-Q49 VanDerWaalsContact C-N 3.35Å; Q49-N51 VanDerWaalsContact C-N 3.25Å; Q49-N51 PolarHBondContact O-N 3Å; Q49-R52 PolarHBondContact O-N 3.38Å; Q49-R52 VanDerWaalsContact O-N 3.1Å; Q49-E53 PolarHBondContact NE2-OE1 3.28Å; Q49-E53 PolarHBondContact O-N 2.95Å
50	Q	89.4	Confident	90.1	Very high	133 Å²	133	109.9 Å²	109.9	62%	0.621	51%	0.512	S	S	*	.	H	α-helix	trans	-57.2	-39	174.5	-72.6	174.9	5.5	0	0	112.2	E46 K47 F54	E46-Q50 WeakPolarHBondContact O-CG 3.42Å; E46-Q50 PolarHBondContact O-N 3.38Å; K47-Q50 PolarHBondContact O-N 3.4Å; Q50-F54 VanDerWaalsContact O-CB 3.3Å; Q50-F54 WeakPolarHBondContact O-CB 3.25Å; Q50-F54 PolarHBondContact O-N 2.91Å
51	N	87.6	Confident	90.1	Very high	91 Å²	91	107.8 Å²	107.8	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-68.1	-40.2	175.8	-171.6	36.6	0	0	0	112.4	K47 E48 Q49 F54 I55	K47-N51 WeakPolarHBondContact O-CB 3.49Å; K47-N51 PolarHBondContact O-N 3.35Å; E48-N51 PolarHBondContact O-N 3.33Å; Q49-N51 VanDerWaalsContact C-N 3.25Å; Q49-N51 PolarHBondContact O-N 3Å; N51-F54 PolarHBondContact O-N 3.34Å; N51-I55 WeakPolarHBondContact O-CB 3.18Å; N51-I55 WeakPolarHBondContact O-CD1 3.43Å; N51-I55 VanDerWaalsContact O-CG1 3.24Å; N51-I55 WeakPolarHBondContact O-CG1 3.4Å; N51-I55 PolarHBondContact O-N 2.72Å
52	R	91.6	Very high	90.4	Very high	163 Å²	163	106 Å²	106	62%	0.615	51%	0.508	S	S	*	.	H	α-helix	trans	-61.7	-48.6	174.8	-70.9	166.7	-164.9	-106.9	3.1	111.2	E48 Q49 F54 I55 E56	E48-R52 VanDerWaalsContact O-CG 3.28Å; E48-R52 WeakPolarHBondContact O-CG 3.28Å; E48-R52 PolarHBondContact O-N 3.13Å; E48-R52 IonicContact OE2-CZ 3.81Å; E48-R52 IonicContact OE2-NE 3.85Å; E48-R52 IonicContact OE2-NH2 2.89Å; E48-R52 PolarHBondContact OE2-NH2 2.96Å; Q49-R52 PolarHBondContact O-N 3.38Å; Q49-R52 VanDerWaalsContact O-N 3.1Å; R52-F54 VanDerWaalsContact C-N 3.32Å; R52-F54 PolarHBondContact O-N 3.08Å; R52-I55 PolarHBondContact O-N 3.48Å; R52-E56 PolarHBondContact O-N 3.14Å
53	E	92.8	Very high	90.3	Very high	70 Å²	70	106.4 Å²	106.4	33%	0.327	51%	0.51	S	S	.	.	H	α-helix	trans	-60.9	-39.5	175.6	-70.8	-178.1	-142.9	0	0	112.4	Q49 E56 R57	Q49-E53 PolarHBondContact NE2-OE1 3.28Å; Q49-E53 PolarHBondContact O-N 2.95Å; E53-E56 PolarHBondContact O-N 3.01Å; E53-R57 WeakPolarHBondContact O-CB 3.29Å; E53-R57 VanDerWaalsContact O-CG 3.22Å; E53-R57 WeakPolarHBondContact O-CG 3.43Å; E53-R57 PolarHBondContact O-N 2.97Å; E53-R57 IonicContact OE2-CZ 2.64Å; E53-R57 IonicContact OE2-NH2 2.81Å; E53-R57 PolarHBondContact OE2-NH2 2.84Å
54	F	89.8	Confident	90.6	Very high	119 Å²	119	104.2 Å²	104.2	52%	0.522	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-41.3	176	177.2	-109.2	0	0	0	112.2	Q50 N51 R52 R58	Q50-F54 VanDerWaalsContact O-CB 3.3Å; Q50-F54 WeakPolarHBondContact O-CB 3.25Å; Q50-F54 PolarHBondContact O-N 2.91Å; N51-F54 PolarHBondContact O-N 3.34Å; R52-F54 VanDerWaalsContact C-N 3.32Å; R52-F54 PolarHBondContact O-N 3.08Å; F54-R58 HydrophobicContact CE2-CG 4.49Å; F54-R58 HydrophobicContact CZ-CG 4.38Å; F54-R58 WeakPolarHBondContact O-CG 3.46Å; F54-R58 PolarHBondContact O-N 3.02Å; F54-R58 VanDerWaalsContact O-N 3.07Å
55	I	89.1	Confident	90.7	Very high	80 Å²	80	105.5 Å²	105.5	41%	0.41	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-44.3	174.7	-70.7	163.5	0	0	0	110.5	N51 R52 R58 I59	N51-I55 WeakPolarHBondContact O-CB 3.18Å; N51-I55 WeakPolarHBondContact O-CD1 3.43Å; N51-I55 VanDerWaalsContact O-CG1 3.24Å; N51-I55 WeakPolarHBondContact O-CG1 3.4Å; N51-I55 PolarHBondContact O-N 2.72Å; R52-I55 PolarHBondContact O-N 3.48Å; I55-R58 WeakPolarHBondContact O-CB 3.35Å; I55-R58 PolarHBondContact O-N 3.42Å; I55-I59 HydrophobicContact CG2-CD1 3.91Å; I55-I59 WeakPolarHBondContact O-CG1 3.28Å; I55-I59 PolarHBondContact O-N 2.89Å
56	E	92.4	Very high	90.7	Very high	112 Å²	112	110.1 Å²	110.1	52%	0.523	52%	0.52	S	S	.	.	H	α-helix	trans	-62.8	-47.5	178.9	-167.9	-177.6	165.4	0	0	112.1	R52 E53 R58 I59 Q60	R52-E56 PolarHBondContact O-N 3.14Å; E53-E56 PolarHBondContact O-N 3.01Å; E56-R58 PolarHBondContact O-N 3.44Å; E56-I59 WeakPolarHBondContact O-CB 3.27Å; E56-I59 PolarHBondContact O-N 3.23Å; E56-Q60 WeakPolarHBondContact O-CG 3.24Å; E56-Q60 PolarHBondContact O-N 2.95Å; E56-Q60 PolarHBondContact OE1-NE2 2.84Å
57	R	92.9	Very high	90.7	Very high	159 Å²	159	109.7 Å²	109.7	60%	0.6	53%	0.526	S	S	*	.	H	α-helix	trans	-58.4	-35.4	174.3	-67.6	171.9	-154.5	-167	9.4	111.7	E53 A61	E53-R57 WeakPolarHBondContact O-CB 3.29Å; E53-R57 VanDerWaalsContact O-CG 3.22Å; E53-R57 WeakPolarHBondContact O-CG 3.43Å; E53-R57 PolarHBondContact O-N 2.97Å; E53-R57 IonicContact OE2-CZ 2.64Å; E53-R57 IonicContact OE2-NH2 2.81Å; E53-R57 PolarHBondContact OE2-NH2 2.84Å; R57-A61 WeakPolarHBondContact O-CB 3.48Å; R57-A61 PolarHBondContact O-N 3.21Å
58	R	91	Very high	90.9	Very high	160 Å²	160	108.1 Å²	108.1	60%	0.604	53%	0.525	S	S	*	.	H	α-helix	trans	-70	-36.3	173.6	-76.1	-175.8	67.7	-176.6	1.1	113.1	F54 I55 E56 A61 V62	F54-R58 HydrophobicContact CE2-CG 4.49Å; F54-R58 HydrophobicContact CZ-CG 4.38Å; F54-R58 WeakPolarHBondContact O-CG 3.46Å; F54-R58 PolarHBondContact O-N 3.02Å; F54-R58 VanDerWaalsContact O-N 3.07Å; I55-R58 WeakPolarHBondContact O-CB 3.35Å; I55-R58 PolarHBondContact O-N 3.42Å; E56-R58 PolarHBondContact O-N 3.44Å; R58-A61 PolarHBondContact O-N 2.99Å; R58-V62 WeakPolarHBondContact O-CG2 3.22Å; R58-V62 PolarHBondContact O-N 3.28Å
59	I	92.2	Very high	90.8	Very high	90 Å²	90	107.5 Å²	107.5	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-65	-50	174.8	-69.2	164.8	0	0	0	109.8	I55 E56 A61 V62 E63	I55-I59 HydrophobicContact CG2-CD1 3.91Å; I55-I59 WeakPolarHBondContact O-CG1 3.28Å; I55-I59 PolarHBondContact O-N 2.89Å; E56-I59 WeakPolarHBondContact O-CB 3.27Å; E56-I59 PolarHBondContact O-N 3.23Å; I59-A61 VanDerWaalsContact C-N 3.28Å; I59-A61 PolarHBondContact O-N 2.87Å; I59-V62 WeakPolarHBondContact O-CA 3.38Å; I59-V62 PolarHBondContact O-N 3.47Å; I59-E63 HydrophobicContact CG2-CG 4.4Å; I59-E63 WeakPolarHBondContact O-CG 3.28Å; I59-E63 PolarHBondContact O-N 3.3Å
60	Q	93.1	Very high	90.6	Very high	101 Å²	101	104.5 Å²	104.5	47%	0.472	52%	0.519	S	S	.	.	H	α-helix	trans	-59	-37.3	176.9	-65.4	173.2	5.2	0	0	112.4	E56 E63 S64	E56-Q60 WeakPolarHBondContact O-CG 3.24Å; E56-Q60 PolarHBondContact O-N 2.95Å; E56-Q60 PolarHBondContact OE1-NE2 2.84Å; Q60-E63 PolarHBondContact O-N 3.16Å; Q60-S64 WeakPolarHBondContact O-CB 3.46Å; Q60-S64 PolarHBondContact O-N 2.9Å; Q60-S64 PolarHBondContact O-OG 3.27Å
61	A	89	Confident	90.5	Very high	56 Å²	56	101.1 Å²	101.1	46%	0.463	51%	0.514	S	S	.	.	H	α-helix	trans	-65.7	-36.1	173	0	0	0	0	0	113	R57 R58 I59 S64 L65	R57-A61 WeakPolarHBondContact O-CB 3.48Å; R57-A61 PolarHBondContact O-N 3.21Å; R58-A61 PolarHBondContact O-N 2.99Å; I59-A61 VanDerWaalsContact C-N 3.28Å; I59-A61 PolarHBondContact O-N 2.87Å; A61-S64 WeakPolarHBondContact CA-OG 3.47Å; A61-S64 PolarHBondContact O-OG 3.34Å; A61-S64 VanDerWaalsContact O-OG 3.13Å; A61-L65 VanDerWaalsContact O-CB 3.24Å; A61-L65 WeakPolarHBondContact O-CB 3.4Å; A61-L65 PolarHBondContact O-N 3.22Å; A61-L65 VanDerWaalsContact O-N 3.08Å
62	V	91	Very high	90.5	Very high	95 Å²	95	102.1 Å²	102.1	58%	0.576	52%	0.52	S	S	*	.	H	α-helix	trans	-73.7	-37.3	175.9	168.8	0	0	0	0	111.6	R58 I59 L65 K66	R58-V62 WeakPolarHBondContact O-CG2 3.22Å; R58-V62 PolarHBondContact O-N 3.28Å; I59-V62 WeakPolarHBondContact O-CA 3.38Å; I59-V62 PolarHBondContact O-N 3.47Å; V62-L65 PolarHBondContact O-N 3.23Å; V62-K66 VanDerWaalsContact O-CB 3.29Å; V62-K66 WeakPolarHBondContact O-CB 3.41Å; V62-K66 PolarHBondContact O-N 2.85Å
63	E	89	Confident	90.3	Very high	124 Å²	124	99.1 Å²	99.1	58%	0.579	51%	0.512	S	S	*	.	H	α-helix	trans	-69	-43.8	177.3	-69.6	-174.9	148.4	0	0	112.5	I59 Q60 K66 S67	I59-E63 HydrophobicContact CG2-CG 4.4Å; I59-E63 WeakPolarHBondContact O-CG 3.28Å; I59-E63 PolarHBondContact O-N 3.3Å; Q60-E63 PolarHBondContact O-N 3.16Å; E63-K66 WeakPolarHBondContact O-CB 3.24Å; E63-K66 PolarHBondContact O-N 2.93Å; E63-S67 PolarHBondContact O-N 2.77Å
64	S	92.9	Very high	90	Very high	62 Å²	62	99.3 Å²	99.3	43%	0.434	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-39.9	172.8	52.1	0	0	0	0	112	Q60 A61 S67 N68	Q60-S64 WeakPolarHBondContact O-CB 3.46Å; Q60-S64 PolarHBondContact O-N 2.9Å; Q60-S64 PolarHBondContact O-OG 3.27Å; A61-S64 WeakPolarHBondContact CA-OG 3.47Å; A61-S64 PolarHBondContact O-OG 3.34Å; A61-S64 VanDerWaalsContact O-OG 3.13Å; S64-S67 PolarHBondContact O-N 2.81Å; S64-N68 WeakPolarHBondContact O-CB 3.37Å; S64-N68 PolarHBondContact O-N 2.76Å; S64-N68 PolarHBondContact O-ND2 2.88Å
65	L	88.9	Confident	89.9	Confident	99 Å²	99	96.3 Å²	96.3	52%	0.518	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-43.4	171.7	-179.3	61.5	0	0	0	112.2	A61 V62 S67 N68 I69	A61-L65 VanDerWaalsContact O-CB 3.24Å; A61-L65 WeakPolarHBondContact O-CB 3.4Å; A61-L65 PolarHBondContact O-N 3.22Å; A61-L65 VanDerWaalsContact O-N 3.08Å; V62-L65 PolarHBondContact O-N 3.23Å; L65-S67 VanDerWaalsContact C-N 3.34Å; L65-S67 PolarHBondContact O-N 3.02Å; L65-N68 PolarHBondContact O-N 2.93Å; L65-I69 HydrophobicContact CD1-CD1 4.14Å; L65-I69 HydrophobicContact CD1-CG1 4.35Å; L65-I69 HydrophobicContact CG-CD1 3.92Å; L65-I69 WeakPolarHBondContact O-CB 3.09Å; L65-I69 VanDerWaalsContact O-CG1 3.28Å; L65-I69 WeakPolarHBondContact O-CG1 3.5Å; L65-I69 PolarHBondContact O-N 3.1Å
66	K	91.9	Very high	89.7	Confident	155 Å²	155	96.7 Å²	96.7	67%	0.674	51%	0.509	S	S	*	.	H	α-helix	trans	-61.3	-40.7	176	-178	-177.3	176.7	-173.1	0	111.8	V62 E63 I69 A70	V62-K66 VanDerWaalsContact O-CB 3.29Å; V62-K66 WeakPolarHBondContact O-CB 3.41Å; V62-K66 PolarHBondContact O-N 2.85Å; E63-K66 WeakPolarHBondContact O-CB 3.24Å; E63-K66 PolarHBondContact O-N 2.93Å; K66-I69 PolarHBondContact O-N 3.23Å; K66-A70 PolarHBondContact O-N 2.92Å
67	S	93.8	Very high	89.6	Confident	78 Å²	78	97.3 Å²	97.3	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-62.8	-48	173.9	-169.2	0	0	0	0	111.7	E63 S64 L65 I69 A70 A71	E63-S67 PolarHBondContact O-N 2.77Å; S64-S67 PolarHBondContact O-N 2.81Å; L65-S67 VanDerWaalsContact C-N 3.34Å; L65-S67 PolarHBondContact O-N 3.02Å; S67-I69 VanDerWaalsContact C-N 3.34Å; S67-I69 PolarHBondContact O-N 3.41Å; S67-A70 PolarHBondContact O-N 2.92Å; S67-A70 VanDerWaalsContact O-N 3.15Å; S67-A71 PolarHBondContact O-N 2.93Å
68	N	91.1	Very high	89.4	Confident	109 Å²	109	92.3 Å²	92.3	58%	0.583	49%	0.494	S	S	*	.	H	α-helix	trans	-61.2	-39.5	176.7	-73.2	-31.1	0	0	0	112.7	S64 L65 N72	S64-N68 WeakPolarHBondContact O-CB 3.37Å; S64-N68 PolarHBondContact O-N 2.76Å; S64-N68 PolarHBondContact O-ND2 2.88Å; L65-N68 PolarHBondContact O-N 2.93Å; N68-N72 WeakPolarHBondContact O-CB 3.44Å; N68-N72 PolarHBondContact O-N 3.29Å
69	I	86.4	Confident	88.9	Confident	82 Å²	82	90.2 Å²	90.2	42%	0.421	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-44.1	174.3	-70.9	166.4	0	0	0	110.7	L65 K66 S67 N72 Q73	L65-I69 HydrophobicContact CD1-CD1 4.14Å; L65-I69 HydrophobicContact CD1-CG1 4.35Å; L65-I69 HydrophobicContact CG-CD1 3.92Å; L65-I69 WeakPolarHBondContact O-CB 3.09Å; L65-I69 VanDerWaalsContact O-CG1 3.28Å; L65-I69 WeakPolarHBondContact O-CG1 3.5Å; L65-I69 PolarHBondContact O-N 3.1Å; K66-I69 PolarHBondContact O-N 3.23Å; S67-I69 VanDerWaalsContact C-N 3.34Å; S67-I69 PolarHBondContact O-N 3.41Å; I69-N72 PolarHBondContact O-N 3.5Å; I69-Q73 HydrophobicContact CG2-CG 4.43Å; I69-Q73 WeakPolarHBondContact O-CB 3.45Å; I69-Q73 VanDerWaalsContact O-CG 3.29Å; I69-Q73 WeakPolarHBondContact O-CG 3.35Å; I69-Q73 PolarHBondContact O-N 2.97Å
70	A	87.8	Confident	88.5	Confident	56 Å²	56	90.5 Å²	90.5	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-63.5	-44.2	177.7	0	0	0	0	0	112.3	K66 S67 N72 Q73 E74	K66-A70 PolarHBondContact O-N 2.92Å; S67-A70 PolarHBondContact O-N 2.92Å; S67-A70 VanDerWaalsContact O-N 3.15Å; A70-N72 PolarHBondContact O-N 3.35Å; A70-Q73 PolarHBondContact O-N 3.33Å; A70-E74 PolarHBondContact O-N 2.77Å
71	A	86.7	Confident	88.2	Confident	63 Å²	63	92 Å²	92	52%	0.521	50%	0.496	S	S	.	.	H	α-helix	trans	-61.5	-43.2	175.8	0	0	0	0	0	112.1	S67 E74 S75	S67-A71 PolarHBondContact O-N 2.93Å; A71-E74 PolarHBondContact O-N 3.15Å; A71-S75 WeakPolarHBondContact O-CB 3.39Å; A71-S75 PolarHBondContact O-N 2.6Å
72	N	87.9	Confident	87.9	Confident	112 Å²	112	97.8 Å²	97.8	60%	0.599	51%	0.505	S	S	*	.	H	α-helix	trans	-67.4	-38.7	177	-164.1	9.7	0	0	0	111.9	N68 I69 A70 E74 S75 L76	N68-N72 WeakPolarHBondContact O-CB 3.44Å; N68-N72 PolarHBondContact O-N 3.29Å; I69-N72 PolarHBondContact O-N 3.5Å; A70-N72 PolarHBondContact O-N 3.35Å; N72-E74 PolarHBondContact O-N 2.95Å; N72-S75 WeakPolarHBondContact O-CB 3.24Å; N72-S75 PolarHBondContact O-N 2.86Å; N72-L76 WeakPolarHBondContact O-CB 3.22Å; N72-L76 PolarHBondContact O-N 2.97Å
73	Q	87.4	Confident	87.6	Confident	100 Å²	100	95.8 Å²	95.8	47%	0.467	50%	0.499	S	S	.	.	H	α-helix	trans	-62.2	-40.5	174	-76.4	-179.8	15.3	0	0	112.8	I69 A70 L76 R77	I69-Q73 HydrophobicContact CG2-CG 4.43Å; I69-Q73 WeakPolarHBondContact O-CB 3.45Å; I69-Q73 VanDerWaalsContact O-CG 3.29Å; I69-Q73 WeakPolarHBondContact O-CG 3.35Å; I69-Q73 PolarHBondContact O-N 2.97Å; A70-Q73 PolarHBondContact O-N 3.33Å; Q73-L76 PolarHBondContact O-N 2.94Å; Q73-R77 VanDerWaalsContact O-CG 3.29Å; Q73-R77 WeakPolarHBondContact O-CG 3.48Å; Q73-R77 PolarHBondContact O-N 3.02Å
74	E	86.8	Confident	87.4	Confident	74 Å²	74	96.7 Å²	96.7	35%	0.346	50%	0.501	S	S	.	.	H	α-helix	trans	-73.9	-35.2	176	-163.9	57.3	-138.8	0	0	112.3	A70 A71 N72 L76 R77 V78 K81	A70-E74 PolarHBondContact O-N 2.77Å; A71-E74 PolarHBondContact O-N 3.15Å; N72-E74 PolarHBondContact O-N 2.95Å; E74-L76 VanDerWaalsContact C-N 3.33Å; E74-L76 PolarHBondContact O-N 3.26Å; E74-R77 PolarHBondContact O-N 2.94Å; E74-R77 WeakPolarHBondContact OE2-CD 3.22Å; E74-R77 IonicContact OE2-CZ 3.39Å; E74-R77 IonicContact OE2-NE 3.97Å; E74-R77 IonicContact OE2-NH1 2.76Å; E74-R77 PolarHBondContact OE2-NH1 2.88Å; E74-V78 WeakPolarHBondContact O-CG2 3.35Å; E74-V78 PolarHBondContact O-N 3.41Å; E74-K81 IonicContact OE1-NZ 3.15Å
75	S	86.8	Confident	87.2	Confident	56 Å²	56	101.7 Å²	101.7	39%	0.392	51%	0.514	S	S	.	.	H	α-helix	trans	-55.3	-48.3	168.7	-174	0	0	0	0	111.5	A71 N72 R77 V78 Q79	A71-S75 WeakPolarHBondContact O-CB 3.39Å; A71-S75 PolarHBondContact O-N 2.6Å; N72-S75 WeakPolarHBondContact O-CB 3.24Å; N72-S75 PolarHBondContact O-N 2.86Å; S75-R77 PolarHBondContact O-N 2.9Å; S75-V78 PolarHBondContact O-N 2.92Å; S75-Q79 WeakPolarHBondContact O-CG 3.35Å; S75-Q79 PolarHBondContact O-N 3.42Å
76	L	85.8	Confident	86.8	Confident	87 Å²	87	104.7 Å²	104.7	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-59.3	-44.4	175.4	-167.6	82.9	0	0	0	111.9	N72 Q73 E74 V78 Q79 Q80	N72-L76 WeakPolarHBondContact O-CB 3.22Å; N72-L76 PolarHBondContact O-N 2.97Å; Q73-L76 PolarHBondContact O-N 2.94Å; E74-L76 VanDerWaalsContact C-N 3.33Å; E74-L76 PolarHBondContact O-N 3.26Å; L76-V78 PolarHBondContact O-N 3.18Å; L76-Q79 PolarHBondContact O-N 2.97Å; L76-Q80 WeakPolarHBondContact O-CB 3.49Å; L76-Q80 VanDerWaalsContact O-CG 3.31Å; L76-Q80 WeakPolarHBondContact O-CG 3.5Å; L76-Q80 PolarHBondContact O-N 3.49Å
77	R	88.8	Confident	86.6	Confident	126 Å²	126	102 Å²	102	48%	0.475	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-40.9	176.2	-72.6	162.8	176.7	175	3.3	112.1	Q73 E74 S75 Q80 K81	Q73-R77 VanDerWaalsContact O-CG 3.29Å; Q73-R77 WeakPolarHBondContact O-CG 3.48Å; Q73-R77 PolarHBondContact O-N 3.02Å; E74-R77 PolarHBondContact O-N 2.94Å; E74-R77 WeakPolarHBondContact OE2-CD 3.22Å; E74-R77 IonicContact OE2-CZ 3.39Å; E74-R77 IonicContact OE2-NE 3.97Å; E74-R77 IonicContact OE2-NH1 2.76Å; E74-R77 PolarHBondContact OE2-NH1 2.88Å; S75-R77 PolarHBondContact O-N 2.9Å; R77-Q80 PolarHBondContact O-N 2.91Å; R77-K81 WeakPolarHBondContact O-CB 3.43Å; R77-K81 VanDerWaalsContact O-CG 3.27Å; R77-K81 WeakPolarHBondContact O-CG 3.37Å; R77-K81 PolarHBondContact O-N 2.86Å
78	V	90.2	Very high	86.3	Confident	53 Å²	53	103.3 Å²	103.3	32%	0.321	52%	0.52	S	S	.	.	H	α-helix	trans	-65.5	-42.8	175.7	170.5	0	0	0	0	110.8	E74 S75 L76 K81 R82	E74-V78 WeakPolarHBondContact O-CG2 3.35Å; E74-V78 PolarHBondContact O-N 3.41Å; S75-V78 PolarHBondContact O-N 2.92Å; L76-V78 PolarHBondContact O-N 3.18Å; V78-K81 PolarHBondContact O-N 2.89Å; V78-R82 WeakPolarHBondContact O-CB 3.48Å; V78-R82 VanDerWaalsContact O-CG 3.28Å; V78-R82 WeakPolarHBondContact O-CG 3.49Å; V78-R82 PolarHBondContact O-N 2.99Å
79	Q	79.1	Confident	86	Confident	116 Å²	116	104 Å²	104	54%	0.542	52%	0.518	S	S	.	.	H	α-helix	trans	-60.7	-46.9	173.6	-70.7	-179.2	14	0	0	111.7	S75 L76 K81 R82 A83	S75-Q79 WeakPolarHBondContact O-CG 3.35Å; S75-Q79 PolarHBondContact O-N 3.42Å; L76-Q79 PolarHBondContact O-N 2.97Å; Q79-K81 PolarHBondContact O-N 2.84Å; Q79-R82 PolarHBondContact O-N 3.48Å; Q79-A83 WeakPolarHBondContact O-CB 3.3Å; Q79-A83 PolarHBondContact O-N 2.79Å
80	Q	84.8	Confident	85.9	Confident	97 Å²	97	105.7 Å²	105.7	45%	0.453	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-41.5	177	-72.5	178.4	10.1	0	0	112.7	L76 R77 A83 K84	L76-Q80 WeakPolarHBondContact O-CB 3.49Å; L76-Q80 VanDerWaalsContact O-CG 3.31Å; L76-Q80 WeakPolarHBondContact O-CG 3.5Å; L76-Q80 PolarHBondContact O-N 3.49Å; R77-Q80 PolarHBondContact O-N 2.91Å; Q80-A83 PolarHBondContact O-N 3.34Å; Q80-K84 WeakPolarHBondContact O-CB 3.42Å; Q80-K84 WeakPolarHBondContact O-CG 3.49Å; Q80-K84 PolarHBondContact O-N 3.33Å
81	K	86.2	Confident	85.7	Confident	133 Å²	133	106.7 Å²	106.7	58%	0.578	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-44.6	173.3	-74.7	167.5	-178.1	167.8	0	111.1	E74 R77 V78 Q79 K85	E74-K81 IonicContact OE1-NZ 3.15Å; R77-K81 WeakPolarHBondContact O-CB 3.43Å; R77-K81 VanDerWaalsContact O-CG 3.27Å; R77-K81 WeakPolarHBondContact O-CG 3.37Å; R77-K81 PolarHBondContact O-N 2.86Å; V78-K81 PolarHBondContact O-N 2.89Å; Q79-K81 PolarHBondContact O-N 2.84Å; K81-K85 PolarHBondContact O-N 2.9Å
82	R	82.3	Confident	85.6	Confident	177 Å²	177	110 Å²	110	67%	0.668	52%	0.522	S	S	*	.	H	α-helix	trans	-63.9	-42.7	176.1	-73.1	173.3	179.2	-172.6	0.8	112.1	V78 Q79 K85 K86	V78-R82 WeakPolarHBondContact O-CB 3.48Å; V78-R82 VanDerWaalsContact O-CG 3.28Å; V78-R82 WeakPolarHBondContact O-CG 3.49Å; V78-R82 PolarHBondContact O-N 2.99Å; Q79-R82 PolarHBondContact O-N 3.48Å; R82-K85 PolarHBondContact O-N 3.29Å; R82-K86 PolarHBondContact O-N 2.86Å
83	A	85.7	Confident	85.3	Confident	53 Å²	53	108.6 Å²	108.6	44%	0.438	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-48.6	176.6	0	0	0	0	0	111.7	Q79 Q80 K85 K86 V87	Q79-A83 WeakPolarHBondContact O-CB 3.3Å; Q79-A83 PolarHBondContact O-N 2.79Å; Q80-A83 PolarHBondContact O-N 3.34Å; A83-K85 VanDerWaalsContact C-N 3.32Å; A83-K85 PolarHBondContact O-N 2.76Å; A83-K86 WeakPolarHBondContact O-CB 3.45Å; A83-K86 PolarHBondContact O-N 3.07Å; A83-K86 VanDerWaalsContact O-N 3.1Å; A83-V87 WeakPolarHBondContact O-CG2 3.48Å; A83-V87 PolarHBondContact O-N 2.88Å
84	K	83.6	Confident	85	Confident	143 Å²	143	106.5 Å²	106.5	62%	0.622	51%	0.505	S	S	*	.	H	α-helix	trans	-58.7	-41	175.4	-73	176.3	178.9	-180	0	112.1	Q80 V87 L88	Q80-K84 WeakPolarHBondContact O-CB 3.42Å; Q80-K84 WeakPolarHBondContact O-CG 3.49Å; Q80-K84 PolarHBondContact O-N 3.33Å; K84-V87 PolarHBondContact O-N 2.98Å; K84-L88 WeakPolarHBondContact O-CB 3.46Å; K84-L88 WeakPolarHBondContact O-CG 3.35Å; K84-L88 PolarHBondContact O-N 2.8Å
85	K	88.4	Confident	84.8	Confident	166 Å²	166	110.7 Å²	110.7	72%	0.722	52%	0.517	S	S	*	.	H	α-helix	trans	-64.7	-37.7	174.4	-169.4	173.4	-177.8	177.3	0	112.8	K81 R82 A83 K89	K81-K85 PolarHBondContact O-N 2.9Å; R82-K85 PolarHBondContact O-N 3.29Å; A83-K85 VanDerWaalsContact C-N 3.32Å; A83-K85 PolarHBondContact O-N 2.76Å; K85-K89 PolarHBondContact O-N 3.05Å
86	K	82.2	Confident	84.7	Confident	162 Å²	162	114.8 Å²	114.8	70%	0.704	53%	0.53	S	S	*	.	H	α-helix	trans	-64.2	-43.5	173.4	-76.6	-175.1	174.9	-172.7	0	112.2	R82 A83 K89 K90	R82-K86 PolarHBondContact O-N 2.86Å; A83-K86 WeakPolarHBondContact O-CB 3.45Å; A83-K86 PolarHBondContact O-N 3.07Å; A83-K86 VanDerWaalsContact O-N 3.1Å; K86-K89 PolarHBondContact O-N 3.07Å; K86-K90 PolarHBondContact O-N 2.91Å
87	V	86.8	Confident	84.3	Confident	98 Å²	98	113.3 Å²	113.3	59%	0.594	52%	0.522	S	S	*	.	H	α-helix	trans	-64.1	-49.2	177.8	174	0	0	0	0	111	A83 K84 K89 K90 E91	A83-V87 WeakPolarHBondContact O-CG2 3.48Å; A83-V87 PolarHBondContact O-N 2.88Å; K84-V87 PolarHBondContact O-N 2.98Å; V87-K89 VanDerWaalsContact C-N 3.3Å; V87-K89 PolarHBondContact O-N 3.33Å; V87-K90 PolarHBondContact O-N 2.94Å; V87-E91 PolarHBondContact O-N 2.84Å
88	L	86.7	Confident	83.9	Confident	107 Å²	107	110 Å²	110	56%	0.56	51%	0.511	S	S	*	.	H	α-helix	trans	-57.9	-40.7	176.8	-78.4	163.1	0	0	0	112.4	K84 E91 Q92	K84-L88 WeakPolarHBondContact O-CB 3.46Å; K84-L88 WeakPolarHBondContact O-CG 3.35Å; K84-L88 PolarHBondContact O-N 2.8Å; L88-E91 PolarHBondContact O-N 3.49Å; L88-Q92 WeakPolarHBondContact O-CG 3.29Å; L88-Q92 PolarHBondContact O-N 3.04Å
89	K	85.8	Confident	83.5	Confident	124 Å²	124	110.1 Å²	110.1	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-65.9	-48.6	174.8	-162.5	-165.3	169.4	-173.2	0	111.5	K85 K86 V87 E91 Q92 D93	K85-K89 PolarHBondContact O-N 3.05Å; K86-K89 PolarHBondContact O-N 3.07Å; V87-K89 VanDerWaalsContact C-N 3.3Å; V87-K89 PolarHBondContact O-N 3.33Å; K89-E91 PolarHBondContact O-N 2.95Å; K89-Q92 WeakPolarHBondContact O-CB 3.37Å; K89-Q92 PolarHBondContact O-N 2.85Å; K89-D93 WeakPolarHBondContact CE-OD1 3.35Å; K89-D93 WeakPolarHBondContact CE-OD2 3.35Å; K89-D93 PolarHBondContact O-N 3.44Å
90	K	83.5	Confident	83.6	Confident	117 Å²	117	107 Å²	107	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-54.4	-39.4	175.9	-90.1	-154	172.2	-162.5	0	112.1	K86 V87 D93 E94 E119	K86-K90 PolarHBondContact O-N 2.91Å; V87-K90 PolarHBondContact O-N 2.94Å; K90-D93 PolarHBondContact O-N 3.47Å; K90-E94 WeakPolarHBondContact O-CB 3.47Å; K90-E94 WeakPolarHBondContact O-CG 3.47Å; K90-E94 PolarHBondContact O-N 2.85Å; K90-E119 IonicContact NZ-OE2 3.74Å; K90-E119 PolarHBondContact NZ-OE2 3.47Å
91	E	83.9	Confident	83.2	Confident	77 Å²	77	103.3 Å²	103.3	36%	0.36	49%	0.492	S	S	.	.	H	α-helix	trans	-69.2	-37.2	178.1	-160.5	-171	166.5	0	0	112.4	V87 L88 K89 R95	V87-E91 PolarHBondContact O-N 2.84Å; L88-E91 PolarHBondContact O-N 3.49Å; K89-E91 PolarHBondContact O-N 2.95Å; E91-R95 WeakPolarHBondContact O-CB 3.48Å; E91-R95 WeakPolarHBondContact O-CD 3.46Å; E91-R95 WeakPolarHBondContact O-CG 3.29Å; E91-R95 PolarHBondContact O-N 2.88Å; E91-R95 IonicContact OE1-CZ 3.44Å; E91-R95 IonicContact OE1-NE 3.61Å; E91-R95 PolarHBondContact OE1-NE 2.95Å; E91-R95 IonicContact OE1-NH2 2.74Å; E91-R95 PolarHBondContact OE1-NH2 3.13Å
92	Q	84.2	Confident	82.7	Confident	132 Å²	132	101.2 Å²	101.2	62%	0.617	49%	0.485	S	S	*	.	H	α-helix	trans	-65.1	-44.4	171.3	-72.1	176.1	-40.2	0	0	111.6	L88 K89 R95 H96	L88-Q92 WeakPolarHBondContact O-CG 3.29Å; L88-Q92 PolarHBondContact O-N 3.04Å; K89-Q92 WeakPolarHBondContact O-CB 3.37Å; K89-Q92 PolarHBondContact O-N 2.85Å; Q92-R95 PolarHBondContact O-N 2.73Å; Q92-H96 WeakPolarHBondContact O-CB 3.42Å; Q92-H96 PolarHBondContact O-N 2.85Å
93	D	82.4	Confident	82.5	Confident	82 Å²	82	97.1 Å²	97.1	44%	0.439	49%	0.488	S	S	.	.	H	α-helix	trans	-63.2	-41.6	177.8	-61.4	-28.1	0	0	0	111	K89 K90 L97	K89-D93 WeakPolarHBondContact CE-OD1 3.35Å; K89-D93 WeakPolarHBondContact CE-OD2 3.35Å; K89-D93 PolarHBondContact O-N 3.44Å; K90-D93 PolarHBondContact O-N 3.47Å; D93-L97 WeakPolarHBondContact O-CB 3.45Å; D93-L97 PolarHBondContact O-N 3.48Å
94	E	82.1	Confident	82.2	Confident	57 Å²	57	100.2 Å²	100.2	27%	0.266	49%	0.494	S	S	.	.	H	α-helix	trans	-63.1	-44.3	172.7	-81.8	-170.6	163.1	0	0	112.5	K90 L97 K98 R116	K90-E94 WeakPolarHBondContact O-CB 3.47Å; K90-E94 WeakPolarHBondContact O-CG 3.47Å; K90-E94 PolarHBondContact O-N 2.85Å; E94-L97 PolarHBondContact O-N 3.08Å; E94-K98 WeakPolarHBondContact O-CB 3.11Å; E94-K98 PolarHBondContact O-N 2.78Å; E94-R116 IonicContact OE1-CZ 2.86Å; E94-R116 IonicContact OE1-NE 2.72Å; E94-R116 PolarHBondContact OE1-NE 3.34Å; E94-R116 IonicContact OE1-NH2 3.19Å; E94-R116 PolarHBondContact OE1-NH2 2.91Å; E94-R116 IonicContact OE2-CZ 3.05Å; E94-R116 IonicContact OE2-NH2 2.67Å; E94-R116 PolarHBondContact OE2-NH2 3.2Å
95	R	82	Confident	81.7	Confident	161 Å²	161	96.9 Å²	96.9	61%	0.608	50%	0.5	S	S	*	.	H	α-helix	trans	-64	-41.1	178.3	-73.2	165.5	-178.4	-145.9	7.2	111.7	E91 Q92 K98 A99	E91-R95 WeakPolarHBondContact O-CB 3.48Å; E91-R95 WeakPolarHBondContact O-CD 3.46Å; E91-R95 WeakPolarHBondContact O-CG 3.29Å; E91-R95 PolarHBondContact O-N 2.88Å; E91-R95 IonicContact OE1-CZ 3.44Å; E91-R95 IonicContact OE1-NE 3.61Å; E91-R95 PolarHBondContact OE1-NE 2.95Å; E91-R95 IonicContact OE1-NH2 2.74Å; E91-R95 PolarHBondContact OE1-NH2 3.13Å; Q92-R95 PolarHBondContact O-N 2.73Å; R95-K98 PolarHBondContact O-N 3.11Å; R95-A99 PolarHBondContact O-N 3.24Å
96	H	83.9	Confident	80.9	Confident	143 Å²	143	95.5 Å²	95.5	66%	0.662	49%	0.494	S	S	*	.	H	α-helix	trans	-66.6	-45.4	176.5	-171	-78.8	0	0	0	111.7	Q92 K98 A99 S100	Q92-H96 WeakPolarHBondContact O-CB 3.42Å; Q92-H96 PolarHBondContact O-N 2.85Å; H96-K98 VanDerWaalsContact C-N 3.32Å; H96-K98 PolarHBondContact O-N 3.13Å; H96-A99 PolarHBondContact O-N 3.26Å; H96-S100 PolarHBondContact O-N 2.86Å
97	L	78.6	Confident	80.7	Confident	55 Å²	55	93 Å²	93	29%	0.288	49%	0.488	S	S	.	.	H	α-helix	trans	-60.2	-42.3	175.1	179.1	60.8	0	0	0	111.7	D93 E94 S100 L101 K115	D93-L97 WeakPolarHBondContact O-CB 3.45Å; D93-L97 PolarHBondContact O-N 3.48Å; E94-L97 PolarHBondContact O-N 3.08Å; L97-S100 PolarHBondContact O-N 3.24Å; L97-L101 HydrophobicContact CD1-CD1 4.13Å; L97-L101 HydrophobicContact CD1-CG 4.37Å; L97-L101 HydrophobicContact CG-CD1 4.09Å; L97-L101 WeakPolarHBondContact O-CG 3.49Å; L97-L101 PolarHBondContact O-N 2.73Å; L97-K115 HydrophobicContact CD2-CD 4.13Å
98	K	80.1	Confident	80	Confident	56 Å²	56	88.3 Å²	88.3	24%	0.243	46%	0.46	C	S	.	.	H	α-helix	trans	-59.6	-51.1	175.4	-178.1	-175	165.1	-176.6	0	111.3	E94 R95 H96 S100 L101 E102 V112	E94-K98 WeakPolarHBondContact O-CB 3.11Å; E94-K98 PolarHBondContact O-N 2.78Å; R95-K98 PolarHBondContact O-N 3.11Å; H96-K98 VanDerWaalsContact C-N 3.32Å; H96-K98 PolarHBondContact O-N 3.13Å; K98-S100 VanDerWaalsContact C-N 3.3Å; K98-S100 PolarHBondContact O-N 2.79Å; K98-L101 PolarHBondContact O-N 2.86Å; K98-L101 VanDerWaalsContact O-N 3.14Å; K98-E102 WeakPolarHBondContact CE-OE1 3.37Å; K98-E102 WeakPolarHBondContact CE-OE2 3.45Å; K98-E102 HydrophobicContact CG-CG 4.45Å; K98-E102 IonicContact NZ-OE1 3.81Å; K98-E102 PolarHBondContact NZ-OE1 2.86Å; K98-E102 IonicContact NZ-OE2 2.77Å; K98-E102 WeakPolarHBondContact O-CG 3.19Å; K98-E102 PolarHBondContact O-N 3.34Å; K98-V112 HydrophobicContact CB-CG2 4.44Å
99	A	81.1	Confident	79.4	Confident	56 Å²	56	90 Å²	90	46%	0.463	46%	0.463	S	S	.	.	H	α-helix	trans	-60.1	-39.5	179.4	0	0	0	0	0	112.3	R95 H96 L101 E102 A103	R95-A99 PolarHBondContact O-N 3.24Å; H96-A99 PolarHBondContact O-N 3.26Å; A99-L101 PolarHBondContact O-N 2.81Å; A99-E102 PolarHBondContact O-N 3.12Å; A99-A103 VanDerWaalsContact O-CB 3.32Å; A99-A103 WeakPolarHBondContact O-CB 3.36Å; A99-A103 PolarHBondContact O-N 2.88Å
100	S	81.3	Confident	78.9	Confident	51 Å²	51	91.1 Å²	91.1	36%	0.357	47%	0.468	S	S	.	.	H	α-helix	trans	-64.2	-36.7	175.4	-171.3	0	0	0	0	113.2	H96 L97 K98 Q104	H96-S100 PolarHBondContact O-N 2.86Å; L97-S100 PolarHBondContact O-N 3.24Å; K98-S100 VanDerWaalsContact C-N 3.3Å; K98-S100 PolarHBondContact O-N 2.79Å; S100-Q104 VanDerWaalsContact O-CG 3.27Å; S100-Q104 WeakPolarHBondContact O-CG 3.48Å; S100-Q104 PolarHBondContact O-N 2.81Å
101	L	76.1	Confident	78.5	Confident	19 Å²	19	90.2 Å²	90.2	10%	0.099	47%	0.465	C	S	.	.	H	α-helix	trans	-76.1	-37.1	178.5	-71	168.3	0	0	0	112.1	L97 K98 A99 Q104 G105 F106 H111	L97-L101 HydrophobicContact CD1-CD1 4.13Å; L97-L101 HydrophobicContact CD1-CG 4.37Å; L97-L101 HydrophobicContact CG-CD1 4.09Å; L97-L101 WeakPolarHBondContact O-CG 3.49Å; L97-L101 PolarHBondContact O-N 2.73Å; K98-L101 PolarHBondContact O-N 2.86Å; K98-L101 VanDerWaalsContact O-N 3.14Å; A99-L101 PolarHBondContact O-N 2.81Å; L101-Q104 CarbonylContact O-C 3.58Å; L101-Q104 PolarHBondContact O-N 3.46Å; L101-G105 PolarHBondContact O-N 3.09Å; L101-F106 PolarHBondContact O-N 2.92Å; L101-H111 HydrophobicContact CD1-CB 4.01Å
102	E	76	Confident	78.2	Confident	90 Å²	90	87.6 Å²	87.6	42%	0.421	46%	0.455	S	S	.	.	H	α-helix	trans	-67.5	-37.9	174.4	-71.3	177.1	153.8	0	0	111.3	K98 A99 Q104 G105	K98-E102 WeakPolarHBondContact CE-OE1 3.37Å; K98-E102 WeakPolarHBondContact CE-OE2 3.45Å; K98-E102 HydrophobicContact CG-CG 4.45Å; K98-E102 IonicContact NZ-OE1 3.81Å; K98-E102 PolarHBondContact NZ-OE1 2.86Å; K98-E102 IonicContact NZ-OE2 2.77Å; K98-E102 WeakPolarHBondContact O-CG 3.19Å; K98-E102 PolarHBondContact O-N 3.34Å; A99-E102 PolarHBondContact O-N 3.12Å; E102-Q104 PolarHBondContact O-N 3.35Å; E102-G105 PolarHBondContact O-N 2.98Å
103	A	77.6	Confident	78	Confident	90 Å²	90	88.3 Å²	88.3	74%	0.744	45%	0.453	S	S	*	.	H	α-helix	trans	-65.4	-21.8	171.1	0	0	0	0	0	113.8	A99	A99-A103 VanDerWaalsContact O-CB 3.32Å; A99-A103 WeakPolarHBondContact O-CB 3.36Å; A99-A103 PolarHBondContact O-N 2.88Å
104	Q	79.3	Confident	77.9	Confident	119 Å²	119	89.1 Å²	89.1	56%	0.556	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	6.7	173.3	-71.2	170.2	-8.8	0	0	113	S100 L101 E102 F106	S100-Q104 VanDerWaalsContact O-CG 3.27Å; S100-Q104 WeakPolarHBondContact O-CG 3.48Å; S100-Q104 PolarHBondContact O-N 2.81Å; L101-Q104 CarbonylContact O-C 3.58Å; L101-Q104 PolarHBondContact O-N 3.46Å; E102-Q104 PolarHBondContact O-N 3.35Å; Q104-F106 VanDerWaalsContact C-N 3.27Å; Q104-F106 HydrophobicContact CB-CD2 3.77Å; Q104-F106 HydrophobicContact CB-CE2 4.13Å; Q104-F106 WeakPolarHBondContact O-CD2 3.49Å; Q104-F106 PolarHBondContact O-N 2.85Å
105	G	74.3	Confident	77.8	Confident	72 Å²	72	90.8 Å²	90.8	74%	0.742	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	4.7	178.6	0	0	0	0	0	115.4	L101 E102	L101-G105 PolarHBondContact O-N 3.09Å; E102-G105 PolarHBondContact O-N 2.98Å
106	F	70.9	Confident	77.8	Confident	137 Å²	137	89.3 Å²	89.3	60%	0.601	46%	0.457	S	S	*	.	S	Bend	trans	-85.9	148.7	177.5	-66.6	-75.6	0	0	0	111.8	L101 Q104 G108	L101-F106 PolarHBondContact O-N 2.92Å; Q104-F106 VanDerWaalsContact C-N 3.27Å; Q104-F106 HydrophobicContact CB-CD2 3.77Å; Q104-F106 HydrophobicContact CB-CE2 4.13Å; Q104-F106 WeakPolarHBondContact O-CD2 3.49Å; Q104-F106 PolarHBondContact O-N 2.85Å; F106-G108 VanDerWaalsContact C-N 3.34Å; F106-G108 PolarHBondContact O-N 3.45Å
107	N	77.2	Confident	77.5	Confident	110 Å²	110	86.8 Å²	86.8	59%	0.588	45%	0.446	S	S	*	.			trans	-71.3	88	175	-173	-41	0	0	0	110.5	F109 K110 H111	N107-F109 PolarHBondContact O-N 2.91Å; N107-F109 PolarHBondContact OD1-N 2.96Å; N107-K110 HydrophobicContact CB-CB 4.48Å; N107-K110 PolarHBondContact O-N 3.15Å; N107-K110 VanDerWaalsContact O-N 3.13Å; N107-K110 PolarHBondContact OD1-N 3.39Å; N107-H111 PolarHBondContact O-N 3.01Å
108	G	72.7	Confident	77.7	Confident	0 Å²	0	89.1 Å²	89.1	0%	0	46%	0.458	C	S	.	.	H	α-helix	trans	-56.9	-33.1	-175	0	0	0	0	0	114	F106 H111 V112	F106-G108 VanDerWaalsContact C-N 3.34Å; F106-G108 PolarHBondContact O-N 3.45Å; G108-H111 PolarHBondContact O-N 3.47Å; G108-V112 WeakPolarHBondContact O-CB 3.3Å; G108-V112 WeakPolarHBondContact O-CG2 3.28Å; G108-V112 PolarHBondContact O-N 2.88Å
109	F	73.8	Confident	77.8	Confident	143 Å²	143	90 Å²	90	63%	0.627	46%	0.463	S	S	*	.	H	α-helix	trans	-62	-46.7	175.8	-78	-82.9	0	0	0	112.4	N107 H111 Y113	N107-F109 PolarHBondContact O-N 2.91Å; N107-F109 PolarHBondContact OD1-N 2.96Å; F109-H111 VanDerWaalsContact C-N 3.31Å; F109-H111 PolarHBondContact O-N 2.94Å; F109-Y113 WeakPolarHBondContact O-CB 3.5Å; F109-Y113 PolarHBondContact O-N 2.88Å
110	K	76.2	Confident	77.8	Confident	147 Å²	147	91 Å²	91	64%	0.639	46%	0.458	S	S	*	.	H	α-helix	trans	-63.1	-39.4	178.6	-171.8	177.6	-179.6	-179	0	111.4	N107 L114	N107-K110 HydrophobicContact CB-CB 4.48Å; N107-K110 PolarHBondContact O-N 3.15Å; N107-K110 VanDerWaalsContact O-N 3.13Å; N107-K110 PolarHBondContact OD1-N 3.39Å; K110-L114 HydrophobicContact CG-CD1 4.36Å; K110-L114 WeakPolarHBondContact O-CG 3.3Å; K110-L114 PolarHBondContact O-N 3.29Å; K110-L114 VanDerWaalsContact O-N 3.16Å
111	H	75.2	Confident	77.8	Confident	97 Å²	97	92 Å²	92	45%	0.449	46%	0.462	S	S	.	.	H	α-helix	trans	-70.8	-43.6	-179.5	-163.5	-87.7	0	0	0	112.7	L101 N107 G108 F109 Y113 L114 K115	L101-H111 HydrophobicContact CD1-CB 4.01Å; N107-H111 PolarHBondContact O-N 3.01Å; G108-H111 PolarHBondContact O-N 3.47Å; F109-H111 VanDerWaalsContact C-N 3.31Å; F109-H111 PolarHBondContact O-N 2.94Å; H111-Y113 VanDerWaalsContact C-N 3.33Å; H111-Y113 PolarHBondContact O-N 2.74Å; H111-L114 PolarHBondContact O-N 3.28Å; H111-K115 WeakPolarHBondContact O-CB 3.24Å; H111-K115 PolarHBondContact O-N 2.93Å
112	V	78.1	Confident	78	Confident	23 Å²	23	94.7 Å²	94.7	14%	0.139	48%	0.477	C	S	.	.	H	α-helix	trans	-63.5	-38.3	175.3	171.3	0	0	0	0	111.3	K98 G108 K115 R116	K98-V112 HydrophobicContact CB-CG2 4.44Å; G108-V112 WeakPolarHBondContact O-CB 3.3Å; G108-V112 WeakPolarHBondContact O-CG2 3.28Å; G108-V112 PolarHBondContact O-N 2.88Å; V112-K115 PolarHBondContact O-N 3.26Å; V112-R116 WeakPolarHBondContact O-CB 3.32Å; V112-R116 PolarHBondContact O-N 3.46Å
113	Y	79.9	Confident	78.5	Confident	146 Å²	146	95.6 Å²	95.6	57%	0.573	48%	0.476	S	S	*	.	H	α-helix	trans	-61.5	-49.6	175.5	-180	-93.8	0	0	0	112.5	F109 H111 K115 R116 Q117	F109-Y113 WeakPolarHBondContact O-CB 3.5Å; F109-Y113 PolarHBondContact O-N 2.88Å; H111-Y113 VanDerWaalsContact C-N 3.33Å; H111-Y113 PolarHBondContact O-N 2.74Å; Y113-K115 VanDerWaalsContact C-N 3.35Å; Y113-K115 PolarHBondContact O-N 2.81Å; Y113-R116 PolarHBondContact O-N 2.9Å; Y113-Q117 HydrophobicContact CD1-CG 4.44Å; Y113-Q117 HydrophobicContact CE1-CG 3.95Å; Y113-Q117 PolarHBondContact O-N 2.97Å; Y113-Q117 PolarHBondContact OH-NE2 3.48Å; Y113-Q117 VanDerWaalsContact OH-NE2 3.09Å
114	L	79.1	Confident	78.7	Confident	99 Å²	99	96.7 Å²	96.7	52%	0.518	46%	0.464	S	S	.	.	H	α-helix	trans	-63.9	-38.7	178.4	-70.4	170.5	0	0	0	112.1	K110 H111 R116 Q117 L118	K110-L114 HydrophobicContact CG-CD1 4.36Å; K110-L114 WeakPolarHBondContact O-CG 3.3Å; K110-L114 PolarHBondContact O-N 3.29Å; K110-L114 VanDerWaalsContact O-N 3.16Å; H111-L114 PolarHBondContact O-N 3.28Å; L114-R116 VanDerWaalsContact C-N 3.34Å; L114-R116 PolarHBondContact O-N 2.6Å; L114-Q117 PolarHBondContact O-N 2.98Å; L114-L118 PolarHBondContact O-N 3.36Å; L114-L118 VanDerWaalsContact O-N 3.15Å
115	K	79.9	Confident	79	Confident	92 Å²	92	96.5 Å²	96.5	40%	0.4	46%	0.463	S	S	.	.	H	α-helix	trans	-62.1	-41.5	173.7	-169.1	-172.8	179.9	-156.3	0	111.8	L97 H111 V112 Y113 L118 E119	L97-K115 HydrophobicContact CD2-CD 4.13Å; H111-K115 WeakPolarHBondContact O-CB 3.24Å; H111-K115 PolarHBondContact O-N 2.93Å; V112-K115 PolarHBondContact O-N 3.26Å; Y113-K115 VanDerWaalsContact C-N 3.35Å; Y113-K115 PolarHBondContact O-N 2.81Å; K115-L118 PolarHBondContact O-N 2.93Å; K115-E119 WeakPolarHBondContact CE-OE1 3.39Å; K115-E119 IonicContact NZ-OE1 2.97Å; K115-E119 PolarHBondContact NZ-OE1 3.43Å; K115-E119 PolarHBondContact O-N 3.32Å
116	R	82.5	Confident	79.5	Confident	130 Å²	130	99.1 Å²	99.1	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-38.5	179.5	-170.8	175	-67.8	169.1	-2.2	112.6	E94 V112 Y113 L114 E119 E120	E94-R116 IonicContact OE1-CZ 2.86Å; E94-R116 IonicContact OE1-NE 2.72Å; E94-R116 PolarHBondContact OE1-NE 3.34Å; E94-R116 IonicContact OE1-NH2 3.19Å; E94-R116 PolarHBondContact OE1-NH2 2.91Å; E94-R116 IonicContact OE2-CZ 3.05Å; E94-R116 IonicContact OE2-NH2 2.67Å; E94-R116 PolarHBondContact OE2-NH2 3.2Å; V112-R116 WeakPolarHBondContact O-CB 3.32Å; V112-R116 PolarHBondContact O-N 3.46Å; Y113-R116 PolarHBondContact O-N 2.9Å; L114-R116 VanDerWaalsContact C-N 3.34Å; L114-R116 PolarHBondContact O-N 2.6Å; R116-E119 PolarHBondContact O-N 3.05Å; R116-E120 WeakPolarHBondContact O-CB 3.41Å; R116-E120 PolarHBondContact O-N 2.83Å
117	Q	77.8	Confident	80.3	Confident	91 Å²	91	97 Å²	97	43%	0.425	45%	0.448	S	S	.	.	H	α-helix	trans	-55.1	-50.3	169.7	-80.5	-81.7	-2.7	0	0	111	Y113 L114 E120 T121	Y113-Q117 HydrophobicContact CD1-CG 4.44Å; Y113-Q117 HydrophobicContact CE1-CG 3.95Å; Y113-Q117 PolarHBondContact O-N 2.97Å; Y113-Q117 PolarHBondContact OH-NE2 3.48Å; Y113-Q117 VanDerWaalsContact OH-NE2 3.09Å; L114-Q117 PolarHBondContact O-N 2.98Å; Q117-E120 PolarHBondContact O-N 3.16Å; Q117-E120 VanDerWaalsContact O-N 3.13Å; Q117-T121 PolarHBondContact O-N 2.94Å; Q117-T121 PolarHBondContact O-OG1 3.04Å
118	L	82.3	Confident	80.4	Confident	104 Å²	104	98.1 Å²	98.1	55%	0.545	45%	0.448	S	S	.	.	H	α-helix	trans	-66.5	-38.6	179.9	-172.3	65.8	0	0	0	113.3	L114 K115 E120 T121 N122	L114-L118 PolarHBondContact O-N 3.36Å; L114-L118 VanDerWaalsContact O-N 3.15Å; K115-L118 PolarHBondContact O-N 2.93Å; L118-E120 VanDerWaalsContact C-N 3.26Å; L118-E120 PolarHBondContact O-N 2.86Å; L118-T121 WeakPolarHBondContact CA-OG1 3.37Å; L118-T121 PolarHBondContact O-OG1 2.88Å; L118-N122 WeakPolarHBondContact O-CB 3.17Å; L118-N122 PolarHBondContact O-N 2.82Å; L118-N122 VanDerWaalsContact O-N 3.1Å; L118-N122 PolarHBondContact O-ND2 2.82Å; L118-N122 PolarHBondContact O-OD1 2.83Å
119	E	82.4	Confident	80.9	Confident	74 Å²	74	101.9 Å²	101.9	35%	0.346	47%	0.465	S	S	.	.	H	α-helix	trans	-64.1	-31.9	172.1	-76.4	-171.1	-144.7	0	0	111.8	K90 K115 R116 R123	K90-E119 IonicContact NZ-OE2 3.74Å; K90-E119 PolarHBondContact NZ-OE2 3.47Å; K115-E119 WeakPolarHBondContact CE-OE1 3.39Å; K115-E119 IonicContact NZ-OE1 2.97Å; K115-E119 PolarHBondContact NZ-OE1 3.43Å; K115-E119 PolarHBondContact O-N 3.32Å; R116-E119 PolarHBondContact O-N 3.05Å; E119-R123 WeakPolarHBondContact O-CB 3.49Å; E119-R123 PolarHBondContact O-N 2.87Å
120	E	81.8	Confident	81.4	Confident	77 Å²	77	101.4 Å²	101.4	36%	0.36	47%	0.465	S	S	.	.	H	α-helix	trans	-77.9	-39	177.8	-166.1	179.3	156.1	0	0	113.4	R116 Q117 L118 N122 R123 K124	R116-E120 WeakPolarHBondContact O-CB 3.41Å; R116-E120 PolarHBondContact O-N 2.83Å; Q117-E120 PolarHBondContact O-N 3.16Å; Q117-E120 VanDerWaalsContact O-N 3.13Å; L118-E120 VanDerWaalsContact C-N 3.26Å; L118-E120 PolarHBondContact O-N 2.86Å; E120-N122 VanDerWaalsContact C-N 3.34Å; E120-R123 PolarHBondContact O-N 2.91Å; E120-R123 IonicContact OE1-NH2 3.75Å; E120-K124 HydrophobicContact CG-CD 4.47Å; E120-K124 WeakPolarHBondContact O-CG 3.42Å; E120-K124 PolarHBondContact O-N 2.8Å; E120-K124 WeakPolarHBondContact OE1-CE 3.26Å; E120-K124 IonicContact OE1-NZ 3.18Å; E120-K124 PolarHBondContact OE1-NZ 2.87Å
121	T	80.4	Confident	81.5	Confident	71 Å²	71	96.7 Å²	96.7	44%	0.436	45%	0.451	S	S	.	.	H	α-helix	trans	-62.3	-44.7	172.7	52.1	0	0	0	0	110.9	Q117 L118 R123 K124 Q125	Q117-T121 PolarHBondContact O-N 2.94Å; Q117-T121 PolarHBondContact O-OG1 3.04Å; L118-T121 WeakPolarHBondContact CA-OG1 3.37Å; L118-T121 PolarHBondContact O-OG1 2.88Å; T121-R123 VanDerWaalsContact C-N 3.33Å; T121-R123 PolarHBondContact O-N 3.07Å; T121-K124 PolarHBondContact O-N 2.91Å; T121-Q125 PolarHBondContact O-N 2.83Å
122	N	79.8	Confident	81.5	Confident	77 Å²	77	95.4 Å²	95.4	41%	0.412	45%	0.445	S	S	.	.	H	α-helix	trans	-66.1	-36.8	179.5	-64.8	1.7	0	0	0	111.4	L118 E120 Q125 Q126	L118-N122 WeakPolarHBondContact O-CB 3.17Å; L118-N122 PolarHBondContact O-N 2.82Å; L118-N122 VanDerWaalsContact O-N 3.1Å; L118-N122 PolarHBondContact O-ND2 2.82Å; L118-N122 PolarHBondContact O-OD1 2.83Å; E120-N122 VanDerWaalsContact C-N 3.34Å; N122-Q125 PolarHBondContact O-N 3.13Å; N122-Q126 WeakPolarHBondContact O-CG 3.28Å; N122-Q126 PolarHBondContact O-N 3.26Å
123	R	86.6	Confident	81.7	Confident	109 Å²	109	99.5 Å²	99.5	41%	0.411	46%	0.461	S	S	.	.	H	α-helix	trans	-61.1	-47.5	171.5	-179.8	-179.5	68.3	87.1	1.7	111.8	E119 E120 T121 Q125 Q126 E127	E119-R123 WeakPolarHBondContact O-CB 3.49Å; E119-R123 PolarHBondContact O-N 2.87Å; E120-R123 PolarHBondContact O-N 2.91Å; E120-R123 IonicContact OE1-NH2 3.75Å; T121-R123 VanDerWaalsContact C-N 3.33Å; T121-R123 PolarHBondContact O-N 3.07Å; R123-Q125 VanDerWaalsContact C-N 3.3Å; R123-Q125 PolarHBondContact O-N 3.15Å; R123-Q126 PolarHBondContact O-N 3.24Å; R123-E127 VanDerWaalsContact CD-OE1 3.31Å; R123-E127 WeakPolarHBondContact CD-OE1 3.46Å; R123-E127 HydrophobicContact CG-CG 4.29Å; R123-E127 WeakPolarHBondContact CG-OE1 3.39Å; R123-E127 IonicContact CZ-OE1 3.57Å; R123-E127 IonicContact CZ-OE2 2.6Å; R123-E127 IonicContact NE-OE1 3.71Å; R123-E127 IonicContact NH1-OE1 2.75Å; R123-E127 PolarHBondContact NH1-OE1 3.02Å; R123-E127 IonicContact NH1-OE2 3.65Å; R123-E127 PolarHBondContact NH1-OE2 2.71Å; R123-E127 WeakPolarHBondContact O-CB 3.47Å; R123-E127 WeakPolarHBondContact O-CG 3.32Å; R123-E127 PolarHBondContact O-N 2.97Å
124	K	81.9	Confident	81.8	Confident	112 Å²	112	95.5 Å²	95.5	49%	0.487	45%	0.454	S	S	.	.	H	α-helix	trans	-61.7	-37.8	179	-73.6	169.9	-176.7	165.4	0	111.9	E120 T121 F128	E120-K124 HydrophobicContact CG-CD 4.47Å; E120-K124 WeakPolarHBondContact O-CG 3.42Å; E120-K124 PolarHBondContact O-N 2.8Å; E120-K124 WeakPolarHBondContact OE1-CE 3.26Å; E120-K124 IonicContact OE1-NZ 3.18Å; E120-K124 PolarHBondContact OE1-NZ 2.87Å; T121-K124 PolarHBondContact O-N 2.91Å; K124-F128 WeakPolarHBondContact O-CB 3.23Å; K124-F128 PolarHBondContact O-N 2.7Å
125	Q	85.8	Confident	82	Confident	116 Å²	116	96.2 Å²	96.2	54%	0.542	45%	0.453	S	S	.	.	H	α-helix	trans	-64.9	-44.4	173.2	-176.1	176.3	-15.9	0	0	112.1	T121 N122 R123 F128 E129	T121-Q125 PolarHBondContact O-N 2.83Å; N122-Q125 PolarHBondContact O-N 3.13Å; R123-Q125 VanDerWaalsContact C-N 3.3Å; R123-Q125 PolarHBondContact O-N 3.15Å; Q125-F128 PolarHBondContact O-N 3.08Å; Q125-E129 PolarHBondContact O-N 3.35Å
126	Q	85.9	Confident	82	Confident	126 Å²	126	99.8 Å²	99.8	59%	0.589	46%	0.464	S	S	*	.	H	α-helix	trans	-64.6	-42.7	176.7	-73.8	177.2	-12.9	0	0	112.3	N122 R123 F128 E129 E130	N122-Q126 WeakPolarHBondContact O-CG 3.28Å; N122-Q126 PolarHBondContact O-N 3.26Å; R123-Q126 PolarHBondContact O-N 3.24Å; Q126-F128 VanDerWaalsContact C-N 3.3Å; Q126-F128 PolarHBondContact O-N 3Å; Q126-E129 PolarHBondContact O-N 3.28Å; Q126-E130 WeakPolarHBondContact O-CG 3.47Å; Q126-E130 PolarHBondContact O-N 3.33Å
127	E	86.1	Confident	82	Confident	94 Å²	94	99.5 Å²	99.5	44%	0.439	47%	0.472	S	S	.	.	H	α-helix	trans	-62.5	-36.7	175.2	-73.4	169.3	-176.6	0	0	111.7	R123 S131	R123-E127 VanDerWaalsContact CD-OE1 3.31Å; R123-E127 WeakPolarHBondContact CD-OE1 3.46Å; R123-E127 HydrophobicContact CG-CG 4.29Å; R123-E127 WeakPolarHBondContact CG-OE1 3.39Å; R123-E127 IonicContact CZ-OE1 3.57Å; R123-E127 IonicContact CZ-OE2 2.6Å; R123-E127 IonicContact NE-OE1 3.71Å; R123-E127 IonicContact NH1-OE1 2.75Å; R123-E127 PolarHBondContact NH1-OE1 3.02Å; R123-E127 IonicContact NH1-OE2 3.65Å; R123-E127 PolarHBondContact NH1-OE2 2.71Å; R123-E127 WeakPolarHBondContact O-CB 3.47Å; R123-E127 WeakPolarHBondContact O-CG 3.32Å; R123-E127 PolarHBondContact O-N 2.97Å; E127-S131 VanDerWaalsContact O-CB 3.26Å; E127-S131 WeakPolarHBondContact O-CB 3.35Å; E127-S131 PolarHBondContact O-N 3.26Å
128	F	80.8	Confident	82.2	Confident	132 Å²	132	100 Å²	100	58%	0.579	47%	0.474	S	S	*	.	H	α-helix	trans	-67	-45.2	172	-177.8	-98.5	0	0	0	112.2	K124 Q125 Q126 S131 Q132	K124-F128 WeakPolarHBondContact O-CB 3.23Å; K124-F128 PolarHBondContact O-N 2.7Å; Q125-F128 PolarHBondContact O-N 3.08Å; Q126-F128 VanDerWaalsContact C-N 3.3Å; Q126-F128 PolarHBondContact O-N 3Å; F128-S131 WeakPolarHBondContact O-CB 3.39Å; F128-S131 PolarHBondContact O-N 2.96Å; F128-Q132 HydrophobicContact CD1-CG 4.22Å; F128-Q132 HydrophobicContact CE1-CG 3.94Å; F128-Q132 HydrophobicContact CZ-CG 4.23Å; F128-Q132 WeakPolarHBondContact O-CG 3.32Å; F128-Q132 PolarHBondContact O-N 3.19Å
129	E	83.5	Confident	82.2	Confident	79 Å²	79	99.8 Å²	99.8	37%	0.369	47%	0.472	S	S	.	.	H	α-helix	trans	-63.1	-40.7	176.1	-81.3	-171.8	-141.3	0	0	113.3	Q125 Q126 S131 Q132 K133	Q125-E129 PolarHBondContact O-N 3.35Å; Q126-E129 PolarHBondContact O-N 3.28Å; E129-S131 VanDerWaalsContact C-N 3.35Å; E129-Q132 PolarHBondContact O-N 2.95Å; E129-K133 WeakPolarHBondContact O-CB 3.42Å; E129-K133 WeakPolarHBondContact O-CD 3.38Å; E129-K133 WeakPolarHBondContact O-CG 3.44Å; E129-K133 PolarHBondContact O-N 3.08Å; E129-K133 IonicContact OE2-NZ 3.03Å; E129-K133 PolarHBondContact OE2-NZ 2.95Å
130	E	83.1	Confident	82.4	Confident	134 Å²	134	100 Å²	100	63%	0.626	48%	0.478	S	S	*	.	H	α-helix	trans	-67.1	-36.7	175	-73.2	-173.2	174.8	0	0	111.4	Q126 K133 S134	Q126-E130 WeakPolarHBondContact O-CG 3.47Å; Q126-E130 PolarHBondContact O-N 3.33Å; E130-K133 PolarHBondContact O-N 3.48Å; E130-S134 WeakPolarHBondContact O-CB 3.06Å; E130-S134 PolarHBondContact O-N 2.75Å; E130-S134 PolarHBondContact O-OG 2.97Å
131	S	77.6	Confident	82.4	Confident	47 Å²	47	99 Å²	99	33%	0.329	48%	0.483	S	S	.	.	H	α-helix	trans	-64.4	-37.6	171.4	-171.1	0	0	0	0	112.6	E127 F128 E129 S134 K135	E127-S131 VanDerWaalsContact O-CB 3.26Å; E127-S131 WeakPolarHBondContact O-CB 3.35Å; E127-S131 PolarHBondContact O-N 3.26Å; F128-S131 WeakPolarHBondContact O-CB 3.39Å; F128-S131 PolarHBondContact O-N 2.96Å; E129-S131 VanDerWaalsContact C-N 3.35Å; S131-S134 PolarHBondContact O-OG 3.35Å; S131-S134 VanDerWaalsContact O-OG 3.11Å; S131-K135 WeakPolarHBondContact O-CB 3.35Å; S131-K135 WeakPolarHBondContact O-CG 3.37Å; S131-K135 PolarHBondContact O-N 3.4Å; S131-K135 VanDerWaalsContact O-N 3.09Å
132	Q	75.9	Confident	82.4	Confident	70 Å²	70	101 Å²	101	33%	0.327	49%	0.486	S	S	.	.	H	α-helix	trans	-66.6	-42.2	171.9	-71.6	-70.8	-16.3	0	0	111.6	F128 E129 R136	F128-Q132 HydrophobicContact CD1-CG 4.22Å; F128-Q132 HydrophobicContact CE1-CG 3.94Å; F128-Q132 HydrophobicContact CZ-CG 4.23Å; F128-Q132 WeakPolarHBondContact O-CG 3.32Å; F128-Q132 PolarHBondContact O-N 3.19Å; E129-Q132 PolarHBondContact O-N 2.95Å; Q132-R136 WeakPolarHBondContact O-CB 3.3Å; Q132-R136 WeakPolarHBondContact O-CD 3.49Å; Q132-R136 WeakPolarHBondContact O-CG 3.44Å; Q132-R136 PolarHBondContact O-N 3.49Å; Q132-R136 VanDerWaalsContact O-N 3.08Å
133	K	82.3	Confident	82.5	Confident	109 Å²	109	102.1 Å²	102.1	47%	0.474	49%	0.491	S	S	.	.	H	α-helix	trans	-66.2	-42.5	178	-70.4	158.1	-166.3	161.8	0	111.6	E129 E130 R136 L137	E129-K133 WeakPolarHBondContact O-CB 3.42Å; E129-K133 WeakPolarHBondContact O-CD 3.38Å; E129-K133 WeakPolarHBondContact O-CG 3.44Å; E129-K133 PolarHBondContact O-N 3.08Å; E129-K133 IonicContact OE2-NZ 3.03Å; E129-K133 PolarHBondContact OE2-NZ 2.95Å; E130-K133 PolarHBondContact O-N 3.48Å; K133-R136 PolarHBondContact O-N 3.08Å; K133-L137 WeakPolarHBondContact O-CG 3.38Å; K133-L137 PolarHBondContact O-N 2.92Å
134	S	81.6	Confident	82.2	Confident	63 Å²	63	101.3 Å²	101.3	44%	0.441	49%	0.494	S	S	.	.	H	α-helix	trans	-67.9	-43.7	178.2	65.4	0	0	0	0	112.5	E130 S131 R136 L137 E138	E130-S134 WeakPolarHBondContact O-CB 3.06Å; E130-S134 PolarHBondContact O-N 2.75Å; E130-S134 PolarHBondContact O-OG 2.97Å; S131-S134 PolarHBondContact O-OG 3.35Å; S131-S134 VanDerWaalsContact O-OG 3.11Å; S134-R136 VanDerWaalsContact C-N 3.33Å; S134-R136 PolarHBondContact O-N 3.32Å; S134-L137 PolarHBondContact O-N 2.89Å; S134-E138 PolarHBondContact O-N 3.06Å
135	K	83.9	Confident	82	Confident	113 Å²	113	101.9 Å²	101.9	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-41.5	173.4	-73	173.4	-177.3	-174.9	0	112.3	S131 E138 I139	S131-K135 WeakPolarHBondContact O-CB 3.35Å; S131-K135 WeakPolarHBondContact O-CG 3.37Å; S131-K135 PolarHBondContact O-N 3.4Å; S131-K135 VanDerWaalsContact O-N 3.09Å; K135-E138 PolarHBondContact O-N 3.41Å; K135-I139 WeakPolarHBondContact O-CD1 3.42Å; K135-I139 VanDerWaalsContact O-CG1 3.28Å; K135-I139 WeakPolarHBondContact O-CG1 3.38Å; K135-I139 PolarHBondContact O-N 3.03Å
136	R	80.6	Confident	81.4	Confident	167 Å²	167	102.6 Å²	102.6	63%	0.63	50%	0.502	S	S	*	.	H	α-helix	trans	-62.3	-43	174.7	-72.6	169.1	-171.2	-153.6	1.2	111.9	Q132 K133 S134 I139 V140	Q132-R136 WeakPolarHBondContact O-CB 3.3Å; Q132-R136 WeakPolarHBondContact O-CD 3.49Å; Q132-R136 WeakPolarHBondContact O-CG 3.44Å; Q132-R136 PolarHBondContact O-N 3.49Å; Q132-R136 VanDerWaalsContact O-N 3.08Å; K133-R136 PolarHBondContact O-N 3.08Å; S134-R136 VanDerWaalsContact C-N 3.33Å; S134-R136 PolarHBondContact O-N 3.32Å; R136-I139 PolarHBondContact O-N 3.5Å; R136-V140 WeakPolarHBondContact O-CG2 3.22Å; R136-V140 PolarHBondContact O-N 3.4Å
137	L	81.1	Confident	80.7	Confident	124 Å²	124	99.9 Å²	99.9	65%	0.649	49%	0.489	S	S	*	.	H	α-helix	trans	-65.8	-37.2	175.7	-71.2	169.2	0	0	0	112.5	K133 S134 V140 A141	K133-L137 WeakPolarHBondContact O-CG 3.38Å; K133-L137 PolarHBondContact O-N 2.92Å; S134-L137 PolarHBondContact O-N 2.89Å; L137-V140 PolarHBondContact O-N 2.95Å; L137-A141 WeakPolarHBondContact O-CB 3.36Å; L137-A141 PolarHBondContact O-N 3.1Å
138	E	83.4	Confident	79.9	Confident	102 Å²	102	102 Å²	102	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-41.7	174.6	-165.8	-163.6	137.8	0	0	111.9	S134 K135 A141 K142	S134-E138 PolarHBondContact O-N 3.06Å; K135-E138 PolarHBondContact O-N 3.41Å; E138-A141 PolarHBondContact O-N 2.91Å; E138-K142 WeakPolarHBondContact O-CG 3.48Å; E138-K142 PolarHBondContact O-N 2.72Å; E138-K142 WeakPolarHBondContact OE1-CE 3.43Å; E138-K142 IonicContact OE1-NZ 2.73Å; E138-K142 PolarHBondContact OE1-NZ 2.98Å
139	I	82.6	Confident	79.1	Confident	99 Å²	99	101.1 Å²	101.1	51%	0.508	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-46.1	174.5	-69.3	162.7	0	0	0	110.5	K135 R136 A141 K142 I143	K135-I139 WeakPolarHBondContact O-CD1 3.42Å; K135-I139 VanDerWaalsContact O-CG1 3.28Å; K135-I139 WeakPolarHBondContact O-CG1 3.38Å; K135-I139 PolarHBondContact O-N 3.03Å; R136-I139 PolarHBondContact O-N 3.5Å; I139-A141 VanDerWaalsContact C-N 3.34Å; I139-A141 PolarHBondContact O-N 3.5Å; I139-K142 PolarHBondContact O-N 3.25Å; I139-I143 HydrophobicContact CG2-CD1 3.82Å; I139-I143 VanDerWaalsContact O-CG1 3.31Å; I139-I143 WeakPolarHBondContact O-CG1 3.14Å; I139-I143 PolarHBondContact O-N 2.87Å
140	V	85.2	Confident	78.2	Confident	78 Å²	78	101.4 Å²	101.4	47%	0.473	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-40.5	175.9	170.8	0	0	0	0	111.6	R136 L137 I143 L144	R136-V140 WeakPolarHBondContact O-CG2 3.22Å; R136-V140 PolarHBondContact O-N 3.4Å; L137-V140 PolarHBondContact O-N 2.95Å; V140-I143 PolarHBondContact O-N 2.94Å; V140-L144 HydrophobicContact CG1-CD1 4.06Å; V140-L144 WeakPolarHBondContact O-CG 3.29Å; V140-L144 PolarHBondContact O-N 2.85Å
141	A	81.3	Confident	77.1	Confident	56 Å²	56	100.6 Å²	100.6	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-41.8	175.8	0	0	0	0	0	112.3	L137 E138 I139 L144 Q145	L137-A141 WeakPolarHBondContact O-CB 3.36Å; L137-A141 PolarHBondContact O-N 3.1Å; E138-A141 PolarHBondContact O-N 2.91Å; I139-A141 VanDerWaalsContact C-N 3.34Å; I139-A141 PolarHBondContact O-N 3.5Å; A141-L144 PolarHBondContact O-N 2.86Å; A141-Q145 WeakPolarHBondContact O-CB 2.97Å; A141-Q145 PolarHBondContact O-N 2.98Å
142	K	81.1	Confident	76.1	Confident	115 Å²	115	101 Å²	101	50%	0.5	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-44.7	174.4	-78.9	169.7	169.5	169.4	0	112	E138 I139 L144 Q145 E146	E138-K142 WeakPolarHBondContact O-CG 3.48Å; E138-K142 PolarHBondContact O-N 2.72Å; E138-K142 WeakPolarHBondContact OE1-CE 3.43Å; E138-K142 IonicContact OE1-NZ 2.73Å; E138-K142 PolarHBondContact OE1-NZ 2.98Å; I139-K142 PolarHBondContact O-N 3.25Å; K142-L144 VanDerWaalsContact C-N 3.35Å; K142-L144 PolarHBondContact O-N 2.92Å; K142-Q145 PolarHBondContact O-N 3.39Å; K142-E146 WeakPolarHBondContact O-CB 3.44Å; K142-E146 PolarHBondContact O-N 3.21Å
143	I	82.2	Confident	75	Confident	100 Å²	100	107.8 Å²	107.8	51%	0.513	54%	0.536	S	S	.	.	H	α-helix	trans	-60.5	-43.4	176.1	-68.7	164.8	0	0	0	111	I139 V140 E146 E147	I139-I143 HydrophobicContact CG2-CD1 3.82Å; I139-I143 VanDerWaalsContact O-CG1 3.31Å; I139-I143 WeakPolarHBondContact O-CG1 3.14Å; I139-I143 PolarHBondContact O-N 2.87Å; V140-I143 PolarHBondContact O-N 2.94Å; I143-E146 PolarHBondContact O-N 3.28Å; I143-E147 WeakPolarHBondContact O-CB 3.49Å; I143-E147 PolarHBondContact O-N 2.93Å
144	L	81	Confident	73.4	Confident	91 Å²	91	106.9 Å²	106.9	48%	0.476	54%	0.544	S	S	.	.	H	α-helix	trans	-65.8	-37.9	176.6	-73.9	167.8	0	0	0	112.6	V140 A141 K142 E147 Q148	V140-L144 HydrophobicContact CG1-CD1 4.06Å; V140-L144 WeakPolarHBondContact O-CG 3.29Å; V140-L144 PolarHBondContact O-N 2.85Å; A141-L144 PolarHBondContact O-N 2.86Å; K142-L144 VanDerWaalsContact C-N 3.35Å; K142-L144 PolarHBondContact O-N 2.92Å; L144-E147 PolarHBondContact O-N 2.76Å; L144-Q148 WeakPolarHBondContact O-CG 3.15Å; L144-Q148 PolarHBondContact O-N 2.91Å; L144-Q148 VanDerWaalsContact O-N 3.08Å
145	Q	78.1	Confident	71.9	Confident	125 Å²	125	113.1 Å²	113.1	58%	0.584	56%	0.563	S	S	*	*	H	α-helix	trans	-67.4	-39.4	175.7	-170.2	174.9	15.3	0	0	111.6	A141 K142 Q148 L149	A141-Q145 WeakPolarHBondContact O-CB 2.97Å; A141-Q145 PolarHBondContact O-N 2.98Å; K142-Q145 PolarHBondContact O-N 3.39Å; Q145-Q148 PolarHBondContact O-N 2.83Å; Q145-L149 WeakPolarHBondContact O-CG 3.2Å; Q145-L149 PolarHBondContact O-N 2.96Å; Q145-L149 VanDerWaalsContact O-N 3.11Å
146	E	72.6	Confident	69.8	Low	130 Å²	130	111.6 Å²	111.6	61%	0.607	57%	0.571	S	S	*	*	H	α-helix	trans	-68.9	-39.3	174.7	-170	161.8	-143.1	0	0	111.9	K142 I143 Q148 L149 V150	K142-E146 WeakPolarHBondContact O-CB 3.44Å; K142-E146 PolarHBondContact O-N 3.21Å; I143-E146 PolarHBondContact O-N 3.28Å; E146-Q148 VanDerWaalsContact C-N 3.29Å; E146-Q148 PolarHBondContact O-N 2.88Å; E146-L149 PolarHBondContact O-N 3.23Å; E146-L149 VanDerWaalsContact O-N 3.11Å; E146-V150 WeakPolarHBondContact O-CG2 3.41Å; E146-V150 PolarHBondContact O-N 2.93Å
147	E	71	Confident	68.1	Low	69 Å²	69	109.5 Å²	109.5	32%	0.322	58%	0.579	S	S	.	*	H	α-helix	trans	-62.5	-35.4	173.6	-160.7	-169.3	171.3	0	0	111.9	I143 L144 K151	I143-E147 WeakPolarHBondContact O-CB 3.49Å; I143-E147 PolarHBondContact O-N 2.93Å; L144-E147 PolarHBondContact O-N 2.76Å; E147-K151 HydrophobicContact CG-CD 4.42Å; E147-K151 WeakPolarHBondContact O-CB 3.37Å; E147-K151 VanDerWaalsContact O-CG 3.29Å; E147-K151 WeakPolarHBondContact O-CG 3.25Å; E147-K151 PolarHBondContact O-N 3.2Å; E147-K151 WeakPolarHBondContact OE1-CE 3.4Å; E147-K151 IonicContact OE1-NZ 2.91Å; E147-K151 PolarHBondContact OE1-NZ 2.65Å; E147-K151 IonicContact OE2-NZ 3.33Å
148	Q	69.1	Low	66.3	Low	140 Å²	140	109 Å²	109	65%	0.654	58%	0.584	S	S	*	*	H	α-helix	trans	-65.9	-41.6	171.8	-72.9	177.2	11.7	0	0	112.1	L144 Q145 E146 K151 G152	L144-Q148 WeakPolarHBondContact O-CG 3.15Å; L144-Q148 PolarHBondContact O-N 2.91Å; L144-Q148 VanDerWaalsContact O-N 3.08Å; Q145-Q148 PolarHBondContact O-N 2.83Å; E146-Q148 VanDerWaalsContact C-N 3.29Å; E146-Q148 PolarHBondContact O-N 2.88Å; Q148-K151 PolarHBondContact O-N 3.1Å; Q148-G152 PolarHBondContact O-N 2.96Å
149	L	64.1	Low	64.1	Low	112 Å²	112	110.1 Å²	110.1	59%	0.586	60%	0.6	S	S	*	*	H	α-helix	trans	-66.1	-37.8	175.8	-70.1	167.4	0	0	0	112.2	Q145 E146 G152 R153	Q145-L149 WeakPolarHBondContact O-CG 3.2Å; Q145-L149 PolarHBondContact O-N 2.96Å; Q145-L149 VanDerWaalsContact O-N 3.11Å; E146-L149 PolarHBondContact O-N 3.23Å; E146-L149 VanDerWaalsContact O-N 3.11Å; L149-G152 PolarHBondContact O-N 2.97Å; L149-R153 PolarHBondContact O-N 3.11Å
150	V	64	Low	62.2	Low	85 Å²	85	113 Å²	113	52%	0.515	62%	0.616	S	S	.	*	H	α-helix	trans	-66	-43.9	174	170.9	0	0	0	0	111.3	E146 G152 R153 S154	E146-V150 WeakPolarHBondContact O-CG2 3.41Å; E146-V150 PolarHBondContact O-N 2.93Å; V150-G152 PolarHBondContact O-N 3.11Å; V150-R153 WeakPolarHBondContact O-CB 3.29Å; V150-R153 PolarHBondContact O-N 2.95Å; V150-S154 PolarHBondContact O-N 3.46Å
151	K	59.5	Low	59.7	Low	117 Å²	117	117.5 Å²	117.5	51%	0.509	64%	0.637	S	S	.	*	H	α-helix	trans	-64.8	-26	173.5	-72.6	167.2	-175.3	165.5	0	113	E147 Q148 R153 S154	E147-K151 HydrophobicContact CG-CD 4.42Å; E147-K151 WeakPolarHBondContact O-CB 3.37Å; E147-K151 VanDerWaalsContact O-CG 3.29Å; E147-K151 WeakPolarHBondContact O-CG 3.25Å; E147-K151 PolarHBondContact O-N 3.2Å; E147-K151 WeakPolarHBondContact OE1-CE 3.4Å; E147-K151 IonicContact OE1-NZ 2.91Å; E147-K151 PolarHBondContact OE1-NZ 2.65Å; E147-K151 IonicContact OE2-NZ 3.33Å; Q148-K151 PolarHBondContact O-N 3.1Å; K151-R153 VanDerWaalsContact C-N 3.34Å; K151-S154 PolarHBondContact O-OG 3.4Å
152	G	56.6	Low	57.4	Low	57 Å²	57	120.1 Å²	120.1	59%	0.588	65%	0.652	S	S	*	*	H	α-helix	trans	-67.9	-30.5	169.2	0	0	0	0	0	113.6	Q148 L149 V150	Q148-G152 PolarHBondContact O-N 2.96Å; L149-G152 PolarHBondContact O-N 2.97Å; V150-G152 PolarHBondContact O-N 3.11Å
153	R	53.8	Low	55.6	Low	211 Å²	211	119.1 Å²	119.1	80%	0.796	66%	0.664	S	S	*	*	H	α-helix	trans	-82.1	-20.6	-179.8	-70.7	174.3	175.4	174.5	-0.9	113.9	L149 V150 K151 K155	L149-R153 PolarHBondContact O-N 3.11Å; V150-R153 WeakPolarHBondContact O-CB 3.29Å; V150-R153 PolarHBondContact O-N 2.95Å; K151-R153 VanDerWaalsContact C-N 3.34Å; R153-K155 PolarHBondContact O-N 3.4Å; R153-K155 VanDerWaalsContact O-N 3.08Å
154	S	48.8	Very low	53.3	Low	91 Å²	91	122.5 Å²	122.5	64%	0.636	68%	0.678	S	S	*	*			trans	-84	34.7	-175.8	73.6	0	0	0	0	114.8	V150 K151	V150-S154 PolarHBondContact O-N 3.46Å; K151-S154 PolarHBondContact O-OG 3.4Å
155	K	49.1	Very low	50.9	Low	193 Å²	193	123 Å²	123	84%	0.839	68%	0.681	S	S	*	*			trans	-124.9	44.5	179.6	-75.2	-167.3	173.8	-174.6	0	113.1	R153	R153-K155 PolarHBondContact O-N 3.4Å; R153-K155 VanDerWaalsContact O-N 3.08Å
156	A	41.2	Very low	49	Very low	81 Å²	81	124.5 Å²	124.5	67%	0.669	69%	0.686	S	S	*	*	S	Bend	trans	-133.4	143.5	167.2	0	0	0	0	0	109.6
157	P	44.9	Very low	47.2	Very low	123 Å²	123	128 Å²	128	80%	0.799	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-75.8	147.2	-179	31.3	-34.7	0	0	0	111.9
158	P	41.8	Very low	45.6	Very low	115 Å²	115	128.1 Å²	128.1	75%	0.747	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-90.6	147.9	-175.2	35	-34.9	0	0	0	113.5
159	P	38.2	Very low	44.2	Very low	124 Å²	124	125.3 Å²	125.3	81%	0.805	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-78.9	152.2	154.3	34	-31.7	0	0	0	110.7
160	N	42.8	Very low	43.1	Very low	161 Å²	161	126.5 Å²	126.5	86%	0.861	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-72.3	140.9	-176.6	-65.4	-45.3	0	0	0	113.1
161	L	32.8	Very low	42	Very low	172 Å²	172	132.2 Å²	132.2	90%	0.901	72%	0.722	S	S	*	*			trans	-152.2	168.5	144.1	-111.4	168.7	0	0	0	110.1
162	S	33.6	Very low	41.2	Very low	111 Å²	111	132.9 Å²	132.9	78%	0.776	73%	0.727	S	S	*	*			trans	-73.9	150.1	-154.6	47	0	0	0	0	115.9
163	A	41.9	Very low	40.5	Very low	93 Å²	93	132.2 Å²	132.2	77%	0.769	72%	0.72	S	S	*	*			trans	-88.7	119.8	172.7	0	0	0	0	0	111.4
164	H	34.3	Very low	40	Very low	172 Å²	172	130.4 Å²	130.4	80%	0.796	71%	0.713	S	S	*	*				-159.4	163.5	120.9	-127.3	-95.2	0	0	0	113.6
165	D	31.4	Very low	39.7	Very low	100 Å²	100	132.6 Å²	132.6	54%	0.535	71%	0.713	S	S	.	*	S	Bend	trans	72.9	112.2	163.7	-85.1	34.9	0	0	0	122.2
166	K	37.7	Very low	39.6	Very low	158 Å²	158	127.3 Å²	127.3	69%	0.687	70%	0.697	S	S	*	*			trans	83.3	43.9	137.2	-64.3	166.5	178.1	137.2	0	120	S168	K166-S168 PolarHBondContact O-N 3.37Å
167	F	33.8	Very low	39.7	Very low	202 Å²	202	129.7 Å²	129.7	89%	0.886	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	62.3	148.8	-83.7	-79.1	0	0	0	112.4
168	S	37.5	Very low	39.6	Very low	73 Å²	73	129.3 Å²	129.3	51%	0.51	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.8	-35.8	-179.5	49.5	0	0	0	0	114.4	K166 L170 R171	K166-S168 PolarHBondContact O-N 3.37Å; S168-L170 PolarHBondContact O-N 3.24Å; S168-R171 PolarHBondContact O-N 2.96Å
169	S	39.9	Very low	39.6	Very low	81 Å²	81	127.6 Å²	127.6	57%	0.566	68%	0.679	S	S	*	*	H	α-helix	trans	-62.2	-35.8	-177.1	52.7	0	0	0	0	114.2	R171 Q172	S169-R171 VanDerWaalsContact C-N 3.28Å; S169-R171 PolarHBondContact O-N 2.83Å; S169-Q172 PolarHBondContact O-N 2.89Å
170	L	42.3	Very low	40	Very low	136 Å²	136	130.7 Å²	130.7	71%	0.712	68%	0.676	S	S	*	*	H	α-helix	trans	-72	-11.4	-176	-78	166.5	0	0	0	115	S168	S168-L170 PolarHBondContact O-N 3.24Å
171	R	40.7	Very low	40.1	Very low	206 Å²	206	129.6 Å²	129.6	78%	0.777	67%	0.67	S	S	*	*	H	α-helix	trans	-81	-44.1	169.5	-80.4	-167	177.6	-160.9	1.9	112.2	S168 S169 G173 R174 E175	S168-R171 PolarHBondContact O-N 2.96Å; S169-R171 VanDerWaalsContact C-N 3.28Å; S169-R171 PolarHBondContact O-N 2.83Å; R171-G173 VanDerWaalsContact C-N 3.33Å; R171-G173 PolarHBondContact O-N 2.88Å; R171-R174 VanDerWaalsContact O-CB 3.32Å; R171-R174 WeakPolarHBondContact O-CB 3.24Å; R171-R174 PolarHBondContact O-N 2.98Å; R171-E175 PolarHBondContact O-N 2.79Å
172	Q	42.8	Very low	40.3	Very low	131 Å²	131	127.7 Å²	127.7	61%	0.612	66%	0.656	S	S	*	*	H	α-helix	trans	-61.3	-39.8	-176.8	-70	177.5	-54.1	0	0	112.2	S169 R174 E175 V176	S169-Q172 PolarHBondContact O-N 2.89Å; Q172-R174 PolarHBondContact O-N 2.83Å; Q172-R174 VanDerWaalsContact O-N 3.16Å; Q172-E175 PolarHBondContact O-N 3.14Å; Q172-V176 WeakPolarHBondContact O-CG2 3.4Å; Q172-V176 PolarHBondContact O-N 2.76Å
173	G	40.9	Very low	40.6	Very low	43 Å²	43	128.3 Å²	128.3	44%	0.443	66%	0.657	S	S	.	*	H	α-helix	trans	-60.6	-23.4	174.2	0	0	0	0	0	114.4	R171 L177	R171-G173 VanDerWaalsContact C-N 3.33Å; R171-G173 PolarHBondContact O-N 2.88Å; G173-L177 PolarHBondContact O-N 2.85Å
174	R	43.6	Very low	40	Very low	172 Å²	172	132.4 Å²	132.4	65%	0.649	66%	0.658	S	S	*	*	H	α-helix	trans	-82.5	-31.8	178.6	-155.1	176.1	-166.6	168.1	8	112.6	R171 Q172 L178	R171-R174 VanDerWaalsContact O-CB 3.32Å; R171-R174 WeakPolarHBondContact O-CB 3.24Å; R171-R174 PolarHBondContact O-N 2.98Å; Q172-R174 PolarHBondContact O-N 2.83Å; Q172-R174 VanDerWaalsContact O-N 3.16Å; R174-L178 WeakPolarHBondContact O-CG 3.36Å
175	E	43	Very low	39.8	Very low	137 Å²	137	130.6 Å²	130.6	64%	0.64	66%	0.659	S	S	*	*	H	α-helix	trans	-75.7	-40.3	174.3	-68.4	173.1	151.5	0	0	111.2	R171 Q172 L177 L178 S179	R171-E175 PolarHBondContact O-N 2.79Å; Q172-E175 PolarHBondContact O-N 3.14Å; E175-L177 VanDerWaalsContact C-N 3.32Å; E175-L177 PolarHBondContact O-N 3.34Å; E175-L178 PolarHBondContact O-N 2.79Å; E175-L178 VanDerWaalsContact O-N 3.09Å; E175-S179 PolarHBondContact O-N 2.94Å
176	V	46.8	Very low	39.7	Very low	82 Å²	82	131.8 Å²	131.8	50%	0.497	67%	0.672	S	S	.	*	H	α-helix	trans	-59	-40.7	174.5	171.7	0	0	0	0	111.8	Q172 L178 S179 Y180	Q172-V176 WeakPolarHBondContact O-CG2 3.4Å; Q172-V176 PolarHBondContact O-N 2.76Å; V176-L178 VanDerWaalsContact C-N 3.3Å; V176-L178 PolarHBondContact O-N 3.19Å; V176-S179 PolarHBondContact O-N 3.14Å; V176-S179 PolarHBondContact O-OG 2.89Å; V176-Y180 HydrophobicContact CG1-CE2 4.16Å; V176-Y180 WeakPolarHBondContact O-CD2 3.46Å
177	L	43.2	Very low	39.3	Very low	132 Å²	132	130.1 Å²	130.1	69%	0.691	68%	0.68	S	S	*	*	H	α-helix	trans	-69.7	-24.1	176.6	-87.1	166.1	0	0	0	114	G173 E175	G173-L177 PolarHBondContact O-N 2.85Å; E175-L177 VanDerWaalsContact C-N 3.32Å; E175-L177 PolarHBondContact O-N 3.34Å
178	L	42.9	Very low	39	Very low	114 Å²	114	125.1 Å²	125.1	60%	0.597	68%	0.676	S	S	*	*	H	α-helix	trans	-82.4	-30.1	175.8	-73.6	168.6	0	0	0	112.5	R174 E175 V176 Y180 L181	R174-L178 WeakPolarHBondContact O-CG 3.36Å; E175-L178 PolarHBondContact O-N 2.79Å; E175-L178 VanDerWaalsContact O-N 3.09Å; V176-L178 VanDerWaalsContact C-N 3.3Å; V176-L178 PolarHBondContact O-N 3.19Å; L178-Y180 PolarHBondContact O-N 3.43Å; L178-L181 HydrophobicContact CD2-CD1 4.33Å; L178-L181 WeakPolarHBondContact O-CB 3.4Å; L178-L181 PolarHBondContact O-N 2.81Å; L178-L181 VanDerWaalsContact O-N 3.13Å
179	S	41.2	Very low	39	Very low	79 Å²	79	127.5 Å²	127.5	55%	0.552	69%	0.69	S	S	*	*	H	α-helix	trans	-65.4	-22.3	-179.8	69	0	0	0	0	113.8	E175 V176 L181	E175-S179 PolarHBondContact O-N 2.94Å; V176-S179 PolarHBondContact O-N 3.14Å; V176-S179 PolarHBondContact O-OG 2.89Å; S179-L181 PolarHBondContact O-N 3.26Å; S179-L181 VanDerWaalsContact O-N 3.13Å
180	Y	46.7	Very low	38.3	Very low	189 Å²	189	130.7 Å²	130.7	74%	0.741	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	2.8	173	-73.2	-73.9	0	0	0	114.9	V176 L178	V176-Y180 HydrophobicContact CG1-CE2 4.16Å; V176-Y180 WeakPolarHBondContact O-CD2 3.46Å; L178-Y180 PolarHBondContact O-N 3.43Å
181	L	44.7	Very low	37.4	Very low	138 Å²	138	129.3 Å²	129.3	72%	0.723	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-8	179.8	-63.9	173.1	0	0	0	115	L178 S179	L178-L181 HydrophobicContact CD2-CD1 4.33Å; L178-L181 WeakPolarHBondContact O-CB 3.4Å; L178-L181 PolarHBondContact O-N 2.81Å; L178-L181 VanDerWaalsContact O-N 3.13Å; S179-L181 PolarHBondContact O-N 3.26Å; S179-L181 VanDerWaalsContact O-N 3.13Å
182	E	36.9	Very low	37.6	Very low	133 Å²	133	124.8 Å²	124.8	62%	0.621	71%	0.705	S	S	*	*			trans	-112.2	131.6	173.4	-80.4	-157.6	-168.3	0	0	112.7	K184	E182-K184 IonicContact OE2-NZ 3.6Å; E182-K184 PolarHBondContact OE2-NZ 3.03Å
183	P	39.7	Very low	36.7	Very low	123 Å²	123	125 Å²	125	80%	0.799	72%	0.715	S	S	*	*			trans	-86.7	123.1	169.7	32.9	-30.5	0	0	0	111.2
184	K	29.2	Very low	36	Very low	180 Å²	180	127 Å²	127	78%	0.783	72%	0.723	S	S	*	*			trans	-145.2	159.4	171.2	-108.9	157.4	-162.1	151.1	0	114.4	E182	E182-K184 IonicContact OE2-NZ 3.6Å; E182-K184 PolarHBondContact OE2-NZ 3.03Å
185	V	30.6	Very low	35.1	Very low	134 Å²	134	126.4 Å²	126.4	81%	0.812	73%	0.732	S	S	*	*			trans	-94.7	145	-163	177.4	0	0	0	0	110.6
186	P	30.6	Very low	34.2	Very low	124 Å²	124	124.9 Å²	124.9	81%	0.805	73%	0.733	S	S	*	*			trans	-76.6	153.3	-171.9	30.4	-37.4	0	0	0	114.7
187	S	28.4	Very low	33.1	Very low	123 Å²	123	128.8 Å²	128.8	86%	0.86	75%	0.745	S	S	*	*			trans	-141.4	161	165.2	55.3	0	0	0	0	110.8
188	A	27.1	Very low	32.2	Very low	97 Å²	97	129.5 Å²	129.5	80%	0.802	75%	0.749	S	S	*	*			trans	-87.8	168.3	-161.8	0	0	0	0	0	114.3
189	P	37.7	Very low	31.2	Very low	123 Å²	123	131.7 Å²	131.7	80%	0.799	76%	0.758	S	S	*	*			trans	-100.2	171.2	-158.5	39.5	-37.3	0	0	0	115.7
190	T	24.5	Very low	30.4	Very low	148 Å²	148	131.9 Å²	131.9	91%	0.908	76%	0.76	S	S	*	*			trans	-145.2	156.9	161.4	-9.8	0	0	0	0	111.3
191	S	25.1	Very low	29.3	Very low	107 Å²	107	128.3 Å²	128.3	75%	0.748	76%	0.762	S	S	*	*			trans	-154.5	-177.2	178.9	69.6	0	0	0	0	108.4
192	P	43.4	Very low	28.3	Very low	111 Å²	111	126.5 Å²	126.5	72%	0.721	76%	0.761	S	S	*	*			cis	-126.8	-163.4	-12.5	41.5	-25.5	0	0	0	111.5
193	T	25.3	Very low	27.6	Very low	135 Å²	135	126.5 Å²	126.5	83%	0.828	77%	0.77	S	S	*	*				-176.5	154.3	126.5	-73.2	0	0	0	0	110.1
194	S	25.5	Very low	26.9	Very low	87 Å²	87	125.3 Å²	125.3	61%	0.608	77%	0.765	S	S	*	*			trans	-101	166.5	-169.4	55.1	0	0	0	0	115.2
195	N	24.8	Very low	26.6	Very low	158 Å²	158	120.9 Å²	120.9	85%	0.845	76%	0.756	S	S	*	*				-169.4	177.8	120.7	-92.5	-5.8	0	0	0	112.5
196	T	23.2	Very low	26.4	Very low	105 Å²	105	122 Å²	122	64%	0.644	76%	0.758	S	S	*	*			trans	-145.2	168.1	-140.6	-37.2	0	0	0	0	113
197	H	24.8	Very low	26	Very low	164 Å²	164	120 Å²	120	76%	0.759	76%	0.759	S	S	*	*			trans	78.4	150	167.4	-58.6	-67	0	0	0	116.6
198	L	24	Very low	26	Very low	147 Å²	147	122.8 Å²	122.8	77%	0.77	76%	0.759	S	S	*	*			cis	-153.1	177.3	-3.6	-121.6	165.3	0	0	0	113.1
199	M	22	Very low	25.8	Very low	160 Å²	160	125 Å²	125	79%	0.788	76%	0.757	S	S	*	*			trans	-63.9	171.1	174.5	-75.4	-168.9	88.5	0	0	114.6
200	S	24.5	Very low	25	Very low	84 Å²	84	127.1 Å²	127.1	59%	0.587	75%	0.754	S	S	*	*			cis	-176.3	175.2	-9.1	46.8	0	0	0	0	111.5
201	S	22.9	Very low	24.9	Very low	114 Å²	114	127.8 Å²	127.8	80%	0.797	75%	0.745	S	S	*	*			trans	70	163.7	160.4	71	0	0	0	0	116
202	S	24.2	Very low	24.8	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	74%	0.737	S	S	*	*			cis	-151	171.4	16.7	59.8	0	0	0	0	115.2
203	T	21.4	Very low	23.7	Very low	132 Å²	132	130.6 Å²	130.6	81%	0.81	74%	0.738	S	S	*	*			trans	-14.2	164.8	152	58	0	0	0	0	119.6
204	S	24.7	Very low	23.6	Very low	99 Å²	99	131.7 Å²	131.7	69%	0.692	74%	0.735	S	S	*	*			cis	-147	171.6	21.3	57.2	0	0	0	0	110.6
205	S	24.1	Very low	23.5	Very low	86 Å²	86	135 Å²	135	60%	0.601	74%	0.741	S	S	*	*				58.3	133.2	53.6	144.5	0	0	0	0	113.5
206	D	25.6	Very low	23.3	Very low	158 Å²	158	135.4 Å²	135.4	85%	0.845	74%	0.738	S	S	*	*			cis	-158.1	176.2	-7.7	-83	-43.5	0	0	0	109.6
207	G	23.3	Very low	23.4	Very low	81 Å²	81	137.2 Å²	137.2	84%	0.835	74%	0.741	S	S	*	*			trans	152.4	107	159	0	0	0	0	0	117.4
208	E	28.3	Very low	23.3	Very low	183 Å²	183	135.1 Å²	135.1	86%	0.855	74%	0.735	S	S	*	*			trans	-103.4	157.9	172.9	-55.8	-176.3	132.1	0	0	112.4
209	N	23.3	Very low	23.4	Very low	143 Å²	143	135.2 Å²	135.2	77%	0.765	73%	0.732	S	S	*	*			trans	-169	126.9	130.6	-111.3	-21.5	0	0	0	116.3
210	F	20.9	Very low	23.6	Very low	168 Å²	168	134.9 Å²	134.9	74%	0.737	73%	0.732	S	S	*	*			trans	42.7	124.1	134.7	-84.6	-115.5	0	0	0	123.8
211	K	21.5	Very low	23.7	Very low	162 Å²	162	133.9 Å²	133.9	70%	0.704	73%	0.729	S	S	*	*				48.9	149.8	112.6	-95.6	-170.9	172.5	-149.5	0	120.9
212	M	23.6	Very low	23.9	Very low	120 Å²	120	137 Å²	137	59%	0.591	73%	0.73	S	S	*	*			cis	-166.4	171.2	2.3	-158.6	153.4	167.6	0	0	110.9
213	E	20.8	Very low	24.1	Very low	156 Å²	156	140.8 Å²	140.8	73%	0.729	73%	0.734	S	S	*	*			trans	65.7	121.1	152.1	-89.8	150	-154.1	0	0	124.6
214	M	22.7	Very low	24.2	Very low	158 Å²	158	145.7 Å²	145.7	78%	0.778	74%	0.738	S	S	*	*				45	135.4	124.7	-144.2	96	167.5	0	0	125.1
215	E	22.8	Very low	24.2	Very low	157 Å²	157	146 Å²	146	73%	0.734	74%	0.735	S	S	*	*			trans	92.8	137.2	141.4	-98.6	158.5	-153.3	0	0	125
216	E	21.2	Very low	24.2	Very low	166 Å²	166	147.4 Å²	147.4	78%	0.776	74%	0.736	S	S	*	*			trans	35.8	137.4	163.3	-71.4	-173.7	155.6	0	0	127.8
217	M	24.1	Very low	24.3	Very low	144 Å²	144	150.7 Å²	150.7	71%	0.709	74%	0.738	S	S	*	*			trans	46.2	151.5	138.6	-71.3	168.6	69.1	0	0	122.2
218	D	23.9	Very low	24.5	Very low	120 Å²	120	151.5 Å²	151.5	64%	0.642	73%	0.731	S	S	*	*			cis	-154.2	167.9	11	-139.8	-8	0	0	0	116.3
219	E	26.6	Very low	24.3	Very low	149 Å²	149	149 Å²	149	70%	0.696	73%	0.728	S	S	*	*			trans	20.7	139	148.5	-116.8	-170.9	-151.1	0	0	122.7
220	I	25.8	Very low	25.2	Very low	153 Å²	153	147.5 Å²	147.5	79%	0.785	73%	0.727	S	S	*	*				-168.8	169.7	73.7	-85.6	-170.7	0	0	0	110.3
221	A	25.6	Very low	25.4	Very low	63 Å²	63	144.1 Å²	144.1	52%	0.521	72%	0.724	S	S	.	*				-171.5	104.1	-87.5	0	0	0	0	0	110.8
222	H	27	Very low	25.7	Very low	178 Å²	178	143.3 Å²	143.3	82%	0.824	73%	0.727	S	S	*	*			trans	-146.1	138.1	177.4	-93	25.6	0	0	0	114
223	K	28.5	Very low	25.7	Very low	180 Å²	180	147.4 Å²	147.4	78%	0.783	74%	0.742	S	S	*	*			cis	-165	134.6	-31.5	-142.6	176.3	-173.4	175.5	0	112.2
224	R	23.9	Very low	26.3	Very low	236 Å²	236	148 Å²	148	89%	0.891	75%	0.75	S	S	*	*			trans	131.5	140.1	156.4	-81.2	-179.2	171.4	170.3	0	111.9
225	T	24.6	Very low	26.5	Very low	105 Å²	105	145.2 Å²	145.2	64%	0.644	75%	0.751	S	S	*	*			cis	157.3	133.8	-9.9	-96.5	0	0	0	0	103.8
226	D	24	Very low	27.3	Very low	116 Å²	116	146.4 Å²	146.4	62%	0.62	76%	0.757	S	S	*	*			cis	-159.5	174.2	-16.3	-92	-47.3	0	0	0	109.4
227	Y	26.9	Very low	27.7	Very low	227 Å²	227	144.1 Å²	144.1	89%	0.89	76%	0.757	S	S	*	*			trans	85.5	129.9	164.4	-54.1	-67.6	0	0	0	120.7
228	S	27.8	Very low	27.7	Very low	98 Å²	98	144.9 Å²	144.9	69%	0.685	76%	0.758	S	S	*	*			trans	-141.2	169.5	168.6	60	0	0	0	0	109.5
229	T	25.8	Very low	27.9	Very low	129 Å²	129	148.2 Å²	148.2	79%	0.791	77%	0.767	S	S	*	*			trans	64.6	161.7	162.1	42.7	0	0	0	0	117.9
230	P	41.8	Very low	27.9	Very low	113 Å²	113	146.3 Å²	146.3	73%	0.734	77%	0.77	S	S	*	*			cis	-139	-150.7	-36.9	38.3	-18.5	0	0	0	112.4
231	S	24.6	Very low	28.1	Very low	96 Å²	96	142.6 Å²	142.6	67%	0.671	77%	0.77	S	S	*	*			trans	93.1	106	154.7	-64.7	0	0	0	0	120.4
232	D	27.3	Very low	28.5	Very low	145 Å²	145	146 Å²	146	78%	0.775	78%	0.779	S	S	*	*				-1.3	152.6	126.9	-47.3	-56.7	0	0	0	119.5
233	F	23.1	Very low	28.7	Very low	207 Å²	207	148.6 Å²	148.6	91%	0.908	78%	0.782	S	S	*	*				-148	131	123.9	-105.7	-72.6	0	0	0	111.9
234	L	34.5	Very low	28.6	Very low	169 Å²	169	147.7 Å²	147.7	89%	0.885	78%	0.78	S	S	*	*			trans	-102.1	131.8	159.5	-77.3	165.4	0	0	0	108
235	A	26.9	Very low	28.7	Very low	98 Å²	98	144.4 Å²	144.4	81%	0.81	78%	0.775	S	S	*	*			trans	-178.5	149.4	151.3	0	0	0	0	0	111.3
236	E	39.9	Very low	28.8	Very low	182 Å²	182	148.2 Å²	148.2	85%	0.85	79%	0.786	S	S	*	*			trans	-95.9	163.7	166.4	-61.1	178.9	148.1	0	0	110.2
237	P	28.7	Very low	28.7	Very low	119 Å²	119	147.2 Å²	147.2	77%	0.773	79%	0.786	S	S	*	*				-135.7	142.3	119.2	32.9	-21	0	0	0	110.9
238	E	25	Very low	28.7	Very low	159 Å²	159	145.5 Å²	145.5	74%	0.743	78%	0.784	S	S	*	*			cis	116.4	123.3	31.6	-99.8	-163.7	-174.9	0	0	109.9
239	F	28.1	Very low	28.6	Very low	190 Å²	190	147.7 Å²	147.7	83%	0.833	79%	0.792	S	S	*	*			trans	63.7	141.9	174.5	-72.1	-106.3	0	0	0	117.8
240	S	27.1	Very low	28.5	Very low	109 Å²	109	150.5 Å²	150.5	76%	0.762	79%	0.794	S	S	*	*			cis	-160	157.2	-11.4	51.3	0	0	0	0	112.1
241	G	29.6	Very low	27.8	Very low	76 Å²	76	153 Å²	153	78%	0.784	80%	0.796	S	S	*	*			trans	-178.6	100.4	175.4	0	0	0	0	0	111.6
242	L	33.9	Very low	27.8	Very low	133 Å²	133	155.1 Å²	155.1	70%	0.696	80%	0.799	S	S	*	*			trans	-61.7	140.1	-172.1	-69.2	66.9	0	0	0	112.7
243	W	30.1	Very low	27.7	Very low	234 Å²	234	156.2 Å²	156.2	89%	0.886	80%	0.803	S	S	*	*				165	139.2	104.1	-82.5	110.5	0	0	0	111.1
244	E	27	Very low	27.7	Very low	161 Å²	161	153.8 Å²	153.8	75%	0.752	79%	0.792	S	S	*	*			trans	-91.2	155.2	168.9	-69	-167.4	106.4	0	0	111.6
245	Q	27.1	Very low	27.3	Very low	166 Å²	166	152.2 Å²	152.2	78%	0.776	78%	0.78	S	S	*	*			trans	62.7	134.5	162	-62.5	168.3	37.7	0	0	115.5
246	E	24.9	Very low	27.2	Very low	186 Å²	186	155.7 Å²	155.7	87%	0.869	78%	0.783	S	S	*	*				-162.7	-165.3	73	-119.6	-163.8	-172.1	0	0	115.1
247	C	22.7	Very low	26.5	Very low	94 Å²	94	151.3 Å²	151.3	64%	0.635	77%	0.769	S	S	*	*			trans	-79	158.8	-162.7	-76.3	0	0	0	0	117.9
248	K	27.5	Very low	26.2	Very low	192 Å²	192	154.4 Å²	154.4	84%	0.835	77%	0.773	S	S	*	*			trans	28.2	144	134.8	-53.1	165.8	-175	167.1	0	120
249	V	24.8	Very low	26.2	Very low	143 Å²	143	150.3 Å²	150.3	87%	0.867	77%	0.767	S	S	*	*				-165.7	167.5	123	130.6	0	0	0	0	112.3
250	F	24.8	Very low	26	Very low	188 Å²	188	147.7 Å²	147.7	83%	0.825	77%	0.766	S	S	*	*			trans	-124.8	161.4	-176.5	-133.6	-82	0	0	0	109.6
251	Q	25.3	Very low	25.9	Very low	165 Å²	165	148.6 Å²	148.6	77%	0.771	77%	0.767	S	S	*	*			trans	71.2	166.1	176.9	-48.8	177.7	9	0	0	113.3
252	L	25.6	Very low	25.6	Very low	141 Å²	141	152.7 Å²	152.7	74%	0.738	77%	0.766	S	S	*	*			cis	-147.7	156.9	15	-169.8	78.7	0	0	0	110.5
253	I	24.8	Very low	25.3	Very low	169 Å²	169	154.5 Å²	154.5	87%	0.867	77%	0.77	S	S	*	*			trans	-117.6	123.6	164.8	-66.8	175.5	0	0	0	109.5
254	K	24.1	Very low	24.9	Very low	156 Å²	156	149 Å²	149	68%	0.678	77%	0.767	S	S	*	*			trans	-162	142.7	158.5	-143.6	-174.8	177.2	-155.9	0	112.9
255	H	24.5	Very low	25.1	Very low	136 Å²	136	146.7 Å²	146.7	63%	0.63	77%	0.769	S	S	*	*			trans	63.9	133.5	168.2	-65.4	-65.9	0	0	0	118.3
256	I	26.8	Very low	25	Very low	170 Å²	170	147.8 Å²	147.8	87%	0.872	77%	0.771	S	S	*	*				-153.2	165	90.5	-93.5	163.9	0	0	0	108.4
257	T	23.2	Very low	25.1	Very low	90 Å²	90	144.5 Å²	144.5	55%	0.552	76%	0.764	S	S	*	*			trans	-130.3	145.8	-165.6	-33.5	0	0	0	0	110.3
258	E	23.8	Very low	25.5	Very low	184 Å²	184	147.5 Å²	147.5	86%	0.86	77%	0.769	S	S	*	*			trans	63.1	153	160.3	-82.4	153.7	-132.3	0	0	117
259	A	24.5	Very low	25.6	Very low	74 Å²	74	145.3 Å²	145.3	61%	0.612	76%	0.762	S	S	*	*			cis	-155.6	173.6	6.6	0	0	0	0	0	111.9
260	T	23.6	Very low	25.8	Very low	135 Å²	135	143.9 Å²	143.9	83%	0.828	75%	0.749	S	S	*	*			trans	63.3	155.1	154.2	49.3	0	0	0	0	120.7
261	V	24.7	Very low	25.8	Very low	127 Å²	127	141.5 Å²	141.5	77%	0.77	75%	0.745	S	S	*	*			cis	-166.1	167.8	-40.1	103.4	0	0	0	0	109.3
262	Q	24.7	Very low	26	Very low	163 Å²	163	139 Å²	139	76%	0.762	74%	0.741	S	S	*	*			trans	92.5	105.6	171.9	-54.8	-153.1	-4.8	0	0	121.6
263	H	26.3	Very low	26	Very low	171 Å²	171	137.6 Å²	137.6	79%	0.792	74%	0.738	S	S	*	*				59.8	131.3	122.3	-72.4	-78.9	0	0	0	125.6
264	S	23.4	Very low	26.2	Very low	117 Å²	117	137 Å²	137	82%	0.818	73%	0.732	S	S	*	*			trans	84	145.8	145.4	88	0	0	0	0	117.3
265	S	29.2	Very low	26.4	Very low	113 Å²	113	139.4 Å²	139.4	79%	0.79	74%	0.737	S	S	*	*			cis	-145.9	178.4	3.8	69.4	0	0	0	0	114.2
266	K	26.4	Very low	26.7	Very low	189 Å²	189	139.6 Å²	139.6	82%	0.822	74%	0.741	S	S	*	*			trans	-54.6	160	-177.7	-56.2	156.4	-177	174.4	0	112
267	T	27.3	Very low	26.7	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.724	73%	0.733	S	S	*	*			cis	-164.4	134	47.8	-44.7	0	0	0	0	107.2
268	Q	29.4	Very low	26.9	Very low	157 Å²	157	140.8 Å²	140.8	73%	0.734	74%	0.738	S	S	*	*				49.5	135.7	83.7	-104.2	-174	24.4	0	0	113.4
269	Q	31.5	Very low	27.2	Very low	146 Å²	146	137.8 Å²	137.8	68%	0.682	73%	0.727	S	S	*	*			cis	-146.5	154.2	28	-73.7	-167.4	-13.5	0	0	114
270	N	27.3	Very low	27.2	Very low	113 Å²	113	143 Å²	143	60%	0.604	74%	0.736	S	S	*	*				43.1	148.1	124.3	-46	-7.7	0	0	0	119.7
271	N	26.6	Very low	27.3	Very low	137 Å²	137	146.5 Å²	146.5	73%	0.733	74%	0.736	S	S	*	*			cis	-172	177.3	-2.3	-107.1	-5	0	0	0	107.2
272	T	28.2	Very low	27.5	Very low	114 Å²	114	145.7 Å²	145.7	70%	0.699	73%	0.731	S	S	*	*			cis	-150.6	168.7	8.1	-9.6	0	0	0	0	112.6
273	T	27	Very low	27.6	Very low	111 Å²	111	144.6 Å²	144.6	68%	0.681	73%	0.729	S	S	*	*			trans	-29.6	166.4	154.5	58.5	0	0	0	0	119.5
274	E	28.7	Very low	27.5	Very low	157 Å²	157	141.1 Å²	141.1	73%	0.734	72%	0.723	S	S	*	*			cis	-138.9	144.5	32	-81.3	-165.8	126.8	0	0	113.5
275	R	28.2	Very low	27.7	Very low	206 Å²	206	144.5 Å²	144.5	78%	0.777	72%	0.724	S	S	*	*				56	142.3	86.2	-62	176.9	162.6	170.4	-5.3	114
276	I	29.4	Very low	27.5	Very low	140 Å²	140	146.4 Å²	146.4	72%	0.718	73%	0.725	S	S	*	*			cis	-137.5	129	36.5	-78.5	174.1	0	0	0	109.7
277	K	27.5	Very low	27.5	Very low	163 Å²	163	143.6 Å²	143.6	71%	0.709	72%	0.724	S	S	*	*				52.7	162	108.3	-31.1	-175.2	-162.5	173.9	0	117.5
278	D	27.9	Very low	27.3	Very low	121 Å²	121	144.1 Å²	144.1	65%	0.647	73%	0.727	S	S	*	*			cis	-147.2	178.6	3.2	-122.6	-33.3	0	0	0	107
279	L	29.3	Very low	27.3	Very low	122 Å²	122	145.4 Å²	145.4	64%	0.639	73%	0.733	S	S	*	*			cis	-154.6	171.4	9.5	-137.8	174	0	0	0	108.2	Y281	L279-Y281 HydrophobicContact CD1-CD2 4.49Å; L279-Y281 HydrophobicContact CD1-CE2 4.22Å; L279-Y281 HydrophobicContact CD2-CD2 4.46Å
280	K	24.8	Very low	27	Very low	184 Å²	184	145 Å²	145	80%	0.8	74%	0.74	S	S	*	*			trans	-133.8	127.4	158.3	-93.5	-174.1	176.8	179	0	109.5
281	Y	26	Very low	27.2	Very low	208 Å²	208	149.5 Å²	149.5	82%	0.816	76%	0.755	S	S	*	*			trans	-91.6	98.2	164.5	-101.2	-92.8	0	0	0	109.8	L279	L279-Y281 HydrophobicContact CD1-CD2 4.49Å; L279-Y281 HydrophobicContact CD1-CE2 4.22Å; L279-Y281 HydrophobicContact CD2-CD2 4.46Å
282	V	27.7	Very low	27.2	Very low	110 Å²	110	151.4 Å²	151.4	67%	0.667	76%	0.759	S	S	*	*			trans	-129.2	117	163	176.8	0	0	0	0	106.2	S284	V282-S284 PolarHBondContact O-N 2.81Å
283	I	27.5	Very low	27.4	Very low	140 Å²	140	154.3 Å²	154.3	72%	0.718	77%	0.77	S	S	*	*			trans	-78.9	106.3	-177.4	-63.8	168.3	0	0	0	108.4	F285	I283-F285 HydrophobicContact CG2-CD2 4.3Å; I283-F285 HydrophobicContact CG2-CE2 4.36Å
284	S	25.2	Very low	28.2	Very low	97 Å²	97	156.7 Å²	156.7	68%	0.678	77%	0.77	S	S	*	*			trans	-93	113.7	172.1	-58.8	0	0	0	0	110	V282 N286	V282-S284 PolarHBondContact O-N 2.81Å; S284-N286 PolarHBondContact O-N 3Å
285	F	26.8	Very low	29.5	Very low	189 Å²	189	158.3 Å²	158.3	83%	0.829	77%	0.77	S	S	*	*			trans	-74.3	113.5	171.1	-98.4	-92.9	0	0	0	110.3	I283	I283-F285 HydrophobicContact CG2-CD2 4.3Å; I283-F285 HydrophobicContact CG2-CE2 4.36Å
286	N	23.8	Very low	31.3	Very low	152 Å²	152	152 Å²	152	81%	0.813	76%	0.755	S	S	*	*			trans	-80.2	116.7	167.7	-75.7	-18.5	0	0	0	109.7	S284	S284-N286 PolarHBondContact O-N 3Å
287	V	27.6	Very low	33.3	Very low	131 Å²	131	146.1 Å²	146.1	79%	0.794	73%	0.727	S	S	*	*			trans	-129.4	96.2	164.9	-179.2	0	0	0	0	108.4
288	T	23.8	Very low	35.9	Very low	129 Å²	129	138.6 Å²	138.6	79%	0.791	69%	0.694	S	S	*	*			trans	-85.9	115.1	174	43.3	0	0	0	0	110.8	T290	T288-T290 PolarHBondContact O-N 3.16Å
289	Q	27.6	Very low	38.6	Very low	183 Å²	183	135 Å²	135	86%	0.855	68%	0.678	S	S	*	*	S	Bend	trans	12.5	98.8	152.1	-64.4	171.5	-20.9	0	0	117.5
290	T	26.7	Very low	41.2	Very low	138 Å²	138	130.1 Å²	130.1	85%	0.847	65%	0.654	S	S	*	*				-179.8	88.7	113.3	43	0	0	0	0	109.8	T288	T288-T290 PolarHBondContact O-N 3.16Å
291	K	30	Very low	44	Very low	208 Å²	208	127.9 Å²	127.9	90%	0.904	64%	0.644	S	S	*	*	S	Bend	trans	-167.1	153.2	160.7	-113.5	159.3	-173.7	169	0	109.4
292	E	27	Very low	46.8	Very low	177 Å²	177	120.3 Å²	120.3	83%	0.827	62%	0.621	S	S	*	*			trans	-59.7	145.7	176.4	-59.3	164.7	122	0	0	110.8	K294	E292-K294 PolarHBondContact O-N 3.23Å
293	L	33	Very low	49.4	Very low	175 Å²	175	122.5 Å²	122.5	92%	0.916	62%	0.624	S	S	*	*			trans	-69.5	81.1	168.9	-85	162.3	0	0	0	109.6	R295	L293-R295 VanDerWaalsContact C-N 3.32Å; L293-R295 PolarHBondContact O-N 3.49Å
294	K	43.3	Very low	52.1	Low	161 Å²	161	118.6 Å²	118.6	70%	0.7	61%	0.606	S	S	*	*			trans	-56	97.5	163.7	-82.9	-164.2	170.1	-167.8	0	108.4	E292 F385	E292-K294 PolarHBondContact O-N 3.23Å; K294-F385 PolarHBondContact NZ-O 2.86Å; K294-F385 VanDerWaalsContact NZ-O 3.12Å
295	R	56.3	Low	55	Low	190 Å²	190	114 Å²	114	72%	0.717	57%	0.574	S	S	*	*			trans	-53.4	140.7	163.1	-70	-178.7	175.4	173.5	-1.1	107.8	L293	L293-R295 VanDerWaalsContact C-N 3.32Å; L293-R295 PolarHBondContact O-N 3.49Å
296	P	66.6	Low	57.7	Low	73 Å²	73	108 Å²	108	47%	0.474	55%	0.55	S	S	.	*			trans	-57.6	137.7	175.8	25.8	-33.9	0	0	0	108.8	F298 I325	P296-F298 PolarHBondContact O-N 2.88Å; P296-F298 VanDerWaalsContact O-N 3.14Å; P296-I325 VanDerWaalsContact O-CD1 3.28Å; P296-I325 WeakPolarHBondContact O-CD1 3.43Å; P296-I325 VanDerWaalsContact O-CG1 3.25Å; P296-I325 WeakPolarHBondContact O-CG1 3.49Å
297	P	71.8	Confident	60.6	Low	18 Å²	18	101.4 Å²	101.4	12%	0.117	51%	0.514	C	S	.	.	S	Bend	trans	-63.3	-23.1	-173.9	17.7	-27	0	0	0	113.3	N324 I325 S326 N330 S383 F385 F388	P297-N324 PolarHBondContact O-OD1 3.43Å; P297-I325 PolarHBondContact O-N 2.9Å; P297-S326 PolarHBondContact O-N 3.47Å; P297-N330 WeakPolarHBondContact CB-ND2 3.26Å; P297-S383 WeakPolarHBondContact CG-OG 3.17Å; P297-F385 HydrophobicContact CB-CD2 4.49Å; P297-F388 HydrophobicContact CG-CD1 3.97Å; P297-F388 HydrophobicContact CG-CG 4.5Å
298	F	81.8	Confident	63.1	Low	5 Å²	5	102 Å²	102	2%	0.022	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	146	174.3	-72.5	-93	0	0	0	111.1	P296 L322 T323 N324 N330 C332 L355 F388	P296-F298 PolarHBondContact O-N 2.88Å; P296-F298 VanDerWaalsContact O-N 3.14Å; F298-L322 HydrophobicContact CB-CB 4.47Å; F298-L322 HydrophobicContact CD1-CB 4.03Å; F298-T323 CarbonylContact C-O 3.53Å; F298-T323 VanDerWaalsContact CA-O 3.28Å; F298-T323 WeakPolarHBondContact CA-O 3.4Å; F298-N324 HydrophobicContact CD1-CB 4.15Å; F298-N324 HydrophobicContact CE1-CB 3.66Å; F298-N324 HydrophobicContact CZ-CB 4.13Å; F298-N330 HydrophobicContact CE2-CB 4.24Å; F298-N330 HydrophobicContact CZ-CB 4.19Å; F298-C332 HydrophobicContact CE1-CB 4.17Å; F298-C332 HydrophobicContact CE2-CB 3.98Å; F298-C332 HydrophobicContact CZ-CB 3.73Å; F298-L355 HydrophobicContact CE1-CD1 3.66Å; F298-L355 HydrophobicContact CZ-CD1 4.01Å; F298-F388 HydrophobicContact CB-CE1 4.22Å; F298-F388 HydrophobicContact CB-CE2 3.82Å; F298-F388 HydrophobicContact CB-CZ 3.63Å; F298-F388 HydrophobicContact CD2-CD1 4.34Å; F298-F388 AromaticContact CD2-CE1 3.47Å; F298-F388 HydrophobicContact CD2-CE1 3.47Å; F298-F388 VanDerWaalsContact CD2-CE1 3.47Å; F298-F388 AromaticContact CD2-CZ 3.6Å; F298-F388 HydrophobicContact CD2-CZ 3.6Å; F298-F388 HydrophobicContact CE2-CE1 4.22Å; F298-F388 HydrophobicContact CG-CE1 4.14Å; F298-F388 HydrophobicContact CG-CE2 4.47Å; F298-F388 AromaticContact CG-CZ 3.79Å; F298-F388 HydrophobicContact CG-CZ 3.79Å
299	S	84	Confident	65.8	Low	44 Å²	44	98.3 Å²	98.3	31%	0.308	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.7	168.4	176.3	0	0	0	0	109.7	L322 T323	S299-L322 WeakPolarHBondContact O-CA 3.38Å; S299-T323 PolarHBondContact N-O 3.44Å; S299-T323 PolarHBondContact O-N 3.34Å
300	S	84.6	Confident	68.3	Low	20 Å²	20	89.7 Å²	89.7	14%	0.14	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	138.3	175.2	50.4	0	0	0	0	112.5	P302 E303 V321	S300-P302 CarbonylContact C-O 3.54Å; S300-P302 WeakPolarHBondContact CB-O 3.27Å; S300-P302 CarbonylContact O-C 3.52Å; S300-E303 PolarHBondContact O-N 3.2Å; S300-E303 WeakPolarHBondContact OG-CA 3.35Å; S300-E303 PolarHBondContact OG-O 3Å; S300-V321 CarbonylContact C-O 3.57Å; S300-V321 WeakPolarHBondContact CA-O 3.31Å
301	K	83.6	Confident	70.7	Confident	137 Å²	137	86.2 Å²	86.2	60%	0.596	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.3	112.7	167.9	-69.7	179.3	-179.4	174.1	0	108.8	I320 V321	K301-I320 WeakPolarHBondContact O-CA 3.38Å; K301-V321 HydrophobicContact CB-CB 4.47Å; K301-V321 PolarHBondContact N-O 3.27Å; K301-V321 PolarHBondContact O-N 2.87Å
302	P	83.6	Confident	73.2	Confident	49 Å²	49	79.7 Å²	79.7	32%	0.318	39%	0.393	S	S	.	.	S	Bend	cis	-67.5	157.9	-4.9	32.6	-37.7	0	0	0	112.6	S300 V304	S300-P302 CarbonylContact C-O 3.54Å; S300-P302 WeakPolarHBondContact CB-O 3.27Å; S300-P302 CarbonylContact O-C 3.52Å; P302-V304 VanDerWaalsContact C-N 3.34Å; P302-V304 WeakPolarHBondContact CG-O 3.25Å; P302-V304 PolarHBondContact O-N 3.31Å
303	E	82.1	Confident	75.4	Confident	157 Å²	157	74 Å²	74	73%	0.734	38%	0.382	S	S	*	.	S	Bend	trans	-61.9	-41.3	176.6	-172.2	170.8	-161.9	0	0	111.7	S300	S300-E303 PolarHBondContact O-N 3.2Å; S300-E303 WeakPolarHBondContact OG-CA 3.35Å; S300-E303 PolarHBondContact OG-O 3Å
304	V	84.6	Confident	77.7	Confident	58 Å²	58	70.8 Å²	70.8	35%	0.352	36%	0.36	S	S	.	.	S	Bend	trans	-116.1	129.8	173.1	-174.3	0	0	0	0	110.8	P302 L306 P391 R393	P302-V304 VanDerWaalsContact C-N 3.34Å; P302-V304 WeakPolarHBondContact CG-O 3.25Å; P302-V304 PolarHBondContact O-N 3.31Å; V304-L306 VanDerWaalsContact C-N 3.28Å; V304-L306 PolarHBondContact O-N 3.39Å; V304-P391 HydrophobicContact CB-CG 4.45Å; V304-P391 HydrophobicContact CG1-CG 4.38Å; V304-P391 HydrophobicContact CG2-CG 4.02Å; V304-R393 HydrophobicContact CG1-CG 4.36Å
305	V	85.5	Confident	79.6	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	73.6	-179.1	-168.6	0	0	0	0	109.7	F307 K318 I320 V390 P391 V392 R393	V305-F307 HydrophobicContact CG1-CD2 4.37Å; V305-F307 HydrophobicContact CG1-CE2 3.78Å; V305-F307 HydrophobicContact CG1-CZ 4.48Å; V305-K318 HydrophobicContact CG1-CD 4.13Å; V305-I320 HydrophobicContact CB-CD1 4.31Å; V305-I320 HydrophobicContact CG1-CD1 3.97Å; V305-I320 HydrophobicContact CG1-CG1 4.35Å; V305-I320 HydrophobicContact CG2-CD1 3.31Å; V305-I320 HydrophobicContact CG2-CG1 3.97Å; V305-V390 HydrophobicContact CG2-CG1 3.62Å; V305-P391 PolarHBondContact N-O 2.86Å; V305-V392 HydrophobicContact CB-CB 4.27Å; V305-V392 HydrophobicContact CB-CG1 4.15Å; V305-V392 HydrophobicContact CB-CG2 4.01Å; V305-V392 HydrophobicContact CG1-CG1 4.29Å; V305-V392 HydrophobicContact CG2-CG2 4.32Å; V305-V392 WeakPolarHBondContact O-CG1 3.38Å; V305-R393 PolarHBondContact O-N 3.03Å; V305-R393 VanDerWaalsContact O-N 3.12Å
306	L	84.2	Confident	81	Confident	63 Å²	63	65.9 Å²	65.9	33%	0.33	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	119.2	-178.1	-175.7	61.5	0	0	0	112.5	V304 K308 K318 R393	V304-L306 VanDerWaalsContact C-N 3.28Å; V304-L306 PolarHBondContact O-N 3.39Å; L306-K308 HydrophobicContact CD1-CG 4.25Å; L306-K308 HydrophobicContact CD2-CD 4.08Å; L306-K308 HydrophobicContact CD2-CG 4.07Å; L306-K308 HydrophobicContact CG-CG 4.03Å; L306-K318 PolarHBondContact O-NZ 3.28Å; L306-R393 CarbonylContact C-O 3.54Å; L306-R393 WeakPolarHBondContact CA-O 3.42Å; L306-R393 HydrophobicContact CD1-CB 3.92Å
307	F	84.4	Confident	82	Confident	13 Å²	13	69.6 Å²	69.6	6%	0.057	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	100.3	165.2	-68.1	-87.9	0	0	0	108.6	V305 Y316 K318 V365 F367 V392 R393 C394 T395	V305-F307 HydrophobicContact CG1-CD2 4.37Å; V305-F307 HydrophobicContact CG1-CE2 3.78Å; V305-F307 HydrophobicContact CG1-CZ 4.48Å; F307-Y316 HydrophobicContact CD1-CG 4.5Å; F307-K318 HydrophobicContact CE1-CB 3.62Å; F307-K318 HydrophobicContact CE2-CB 4.41Å; F307-K318 HydrophobicContact CZ-CB 3.52Å; F307-K318 HydrophobicContact CZ-CD 4.49Å; F307-V365 HydrophobicContact CE2-CG1 4.05Å; F307-V365 HydrophobicContact CZ-CB 4.42Å; F307-V365 HydrophobicContact CZ-CG1 4.07Å; F307-F367 HydrophobicContact CB-CD1 4.03Å; F307-F367 HydrophobicContact CB-CE1 4.36Å; F307-F367 HydrophobicContact CD1-CB 4.22Å; F307-F367 HydrophobicContact CD1-CD1 4.16Å; F307-F367 HydrophobicContact CD2-CB 4.26Å; F307-F367 HydrophobicContact CD2-CD1 4.36Å; F307-F367 HydrophobicContact CD2-CG 4.48Å; F307-F367 HydrophobicContact CE1-CB 3.95Å; F307-F367 HydrophobicContact CE2-CB 4Å; F307-F367 HydrophobicContact CG-CB 4.36Å; F307-F367 AromaticContact CG-CD1 3.96Å; F307-F367 HydrophobicContact CG-CD1 3.96Å; F307-F367 HydrophobicContact CG-CG 4.47Å; F307-F367 HydrophobicContact CZ-CB 3.83Å; F307-V392 HydrophobicContact CD2-CG1 4.35Å; F307-V392 HydrophobicContact CE2-CG1 4.42Å; F307-R393 PolarHBondContact N-O 2.86Å; F307-C394 HydrophobicContact CB-CB 4.36Å; F307-C394 WeakPolarHBondContact O-CA 3.07Å; F307-T395 PolarHBondContact O-N 3.45Å
308	K	80.8	Confident	82.6	Confident	143 Å²	143	71.5 Å²	71.5	62%	0.622	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	151.8	178.4	-97	178.6	167.5	-174.5	0	111.9	L306 F310	L306-K308 HydrophobicContact CD1-CG 4.25Å; L306-K308 HydrophobicContact CD2-CD 4.08Å; L306-K308 HydrophobicContact CD2-CG 4.07Å; L306-K308 HydrophobicContact CG-CG 4.03Å; K308-F310 VanDerWaalsContact C-N 3.25Å; K308-F310 PolarHBondContact O-N 3.32Å; K308-F310 VanDerWaalsContact O-N 3.16Å
309	D	80.4	Confident	82.9	Confident	53 Å²	53	78.4 Å²	78.4	28%	0.283	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.9	40	164.6	-60.2	-61.2	0	0	0	114.3	T395 K397 A430	D309-T395 PolarHBondContact N-O 3.34Å; D309-K397 HydrophobicContact CB-CG 3.95Å; D309-K397 WeakPolarHBondContact O-CE 3.13Å; D309-K397 WeakPolarHBondContact O-CG 3.28Å; D309-A430 HydrophobicContact CB-CB 3.83Å; D309-A430 VanDerWaalsContact CG-CB 3.41Å; D309-A430 VanDerWaalsContact OD1-CB 3.23Å; D309-A430 WeakPolarHBondContact OD1-CB 3.5Å
310	F	80.8	Confident	83.1	Confident	2 Å²	2	76.3 Å²	76.3	1%	0.009	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	156.3	-175.1	75.3	-106.3	0	0	0	112.8	K308 Y316 F367 P369 E373 C394 T395 I396	K308-F310 VanDerWaalsContact C-N 3.25Å; K308-F310 PolarHBondContact O-N 3.32Å; K308-F310 VanDerWaalsContact O-N 3.16Å; F310-Y316 HydrophobicContact CB-CD2 4.39Å; F310-Y316 HydrophobicContact CB-CE2 3.86Å; F310-F367 HydrophobicContact CB-CE1 3.91Å; F310-F367 AromaticContact CD1-CE1 3.59Å; F310-F367 HydrophobicContact CD1-CE1 3.59Å; F310-F367 AromaticContact CD1-CZ 3.97Å; F310-F367 HydrophobicContact CD1-CZ 3.97Å; F310-F367 HydrophobicContact CD2-CE1 4.05Å; F310-F367 HydrophobicContact CD2-CZ 4.27Å; F310-F367 HydrophobicContact CE1-CE1 4.01Å; F310-F367 AromaticContact CE1-CZ 3.89Å; F310-F367 HydrophobicContact CE1-CZ 3.89Å; F310-F367 HydrophobicContact CE2-CE1 4.43Å; F310-F367 HydrophobicContact CE2-CZ 4.2Å; F310-F367 AromaticContact CG-CE1 3.6Å; F310-F367 HydrophobicContact CG-CE1 3.6Å; F310-F367 HydrophobicContact CG-CZ 4.16Å; F310-F367 HydrophobicContact CZ-CE1 4.39Å; F310-F367 AromaticContact CZ-CZ 3.99Å; F310-F367 HydrophobicContact CZ-CZ 3.99Å; F310-P369 HydrophobicContact CD2-CB 3.38Å; F310-P369 HydrophobicContact CD2-CG 3.61Å; F310-P369 HydrophobicContact CE2-CB 3.31Å; F310-P369 HydrophobicContact CE2-CG 4.1Å; F310-P369 HydrophobicContact CG-CB 4.35Å; F310-P369 HydrophobicContact CG-CG 4.36Å; F310-P369 HydrophobicContact CZ-CB 4.22Å; F310-E373 WeakPolarHBondContact CZ-O 3.27Å; F310-C394 HydrophobicContact CD1-CB 4.01Å; F310-C394 HydrophobicContact CE1-CB 3.76Å; F310-T395 VanDerWaalsContact CD1-C 3.45Å; F310-T395 WeakPolarHBondContact CD1-O 3.13Å; F310-T395 VanDerWaalsContact CE1-C 3.49Å; F310-T395 PolarHBondContact N-O 3.27Å; F310-I396 HydrophobicContact CE1-CG2 3.83Å; F310-I396 HydrophobicContact CE2-CG2 3.94Å; F310-I396 HydrophobicContact CZ-CG2 3.44Å; F310-I396 VanDerWaalsContact CZ-CG2 3.44Å
311	E	77.3	Confident	83.2	Confident	65 Å²	65	77.2 Å²	77.2	30%	0.304	37%	0.369	S	S	.	.			trans	-118.5	132.7	174.4	-61.3	173.6	-144.6	0	0	109.8	G313 K314 Y316 P369 K397	E311-G313 PolarHBondContact O-N 2.85Å; E311-K314 HydrophobicContact CB-CB 4.45Å; E311-K314 HydrophobicContact CB-CD 4.08Å; E311-K314 HydrophobicContact CB-CG 4.32Å; E311-K314 HydrophobicContact CG-CD 4.49Å; E311-K314 PolarHBondContact O-N 3.26Å; E311-K314 IonicContact OE1-NZ 3.63Å; E311-K314 PolarHBondContact OE1-NZ 2.73Å; E311-K314 WeakPolarHBondContact OE2-CD 3.46Å; E311-K314 WeakPolarHBondContact OE2-CE 3.45Å; E311-K314 IonicContact OE2-NZ 3.99Å; E311-K314 PolarHBondContact OE2-NZ 3.31Å; E311-Y316 PolarHBondContact N-OH 3.4Å; E311-P369 VanDerWaalsContact O-CG 3.25Å; E311-P369 WeakPolarHBondContact O-CG 3.45Å; E311-K397 VanDerWaalsContact CD-NZ 3.31Å; E311-K397 HydrophobicContact CG-CD 4.35Å; E311-K397 VanDerWaalsContact CG-CE 3.5Å; E311-K397 IonicContact OE1-NZ 3.48Å; E311-K397 PolarHBondContact OE1-NZ 3.42Å
312	V	81.5	Confident	83.2	Confident	70 Å²	70	70.7 Å²	70.7	42%	0.424	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	135.5	177	179.3	0	0	0	0	110.5	K314 N372	V312-K314 VanDerWaalsContact C-N 3.29Å; V312-K314 PolarHBondContact O-N 3.46Å; V312-N372 HydrophobicContact CG2-CB 3.84Å
313	G	74	Confident	83.3	Confident	58 Å²	58	69.5 Å²	69.5	60%	0.598	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-17.9	-178.4	0	0	0	0	0	115.9	E311 P369	E311-G313 PolarHBondContact O-N 2.85Å; G313-P369 PolarHBondContact N-O 2.84Å
314	K	81.3	Confident	83.5	Confident	107 Å²	107	62 Å²	62	47%	0.465	30%	0.298	S	S	.	.			trans	-79.1	139.9	172.9	-74.9	-172	179.4	165.2	0	111	E311 V312 Y316 P369	E311-K314 HydrophobicContact CB-CB 4.45Å; E311-K314 HydrophobicContact CB-CD 4.08Å; E311-K314 HydrophobicContact CB-CG 4.32Å; E311-K314 HydrophobicContact CG-CD 4.49Å; E311-K314 PolarHBondContact O-N 3.26Å; E311-K314 IonicContact OE1-NZ 3.63Å; E311-K314 PolarHBondContact OE1-NZ 2.73Å; E311-K314 WeakPolarHBondContact OE2-CD 3.46Å; E311-K314 WeakPolarHBondContact OE2-CE 3.45Å; E311-K314 IonicContact OE2-NZ 3.99Å; E311-K314 PolarHBondContact OE2-NZ 3.31Å; V312-K314 VanDerWaalsContact C-N 3.29Å; V312-K314 PolarHBondContact O-N 3.46Å; K314-Y316 HydrophobicContact CB-CE2 3.67Å; K314-Y316 VanDerWaalsContact O-CD2 3.31Å; K314-Y316 WeakPolarHBondContact O-CD2 3.19Å; K314-Y316 WeakPolarHBondContact O-CE2 3.29Å; K314-P369 WeakPolarHBondContact O-CD 3.5Å
315	R	83.6	Confident	83.3	Confident	192 Å²	192	62.8 Å²	62.8	73%	0.725	30%	0.299	S	S	*	.			trans	-94.6	114.7	-179	-58.3	-168.8	175.2	-157.9	1.3	110.8	H368	R315-H368 WeakPolarHBondContact CD-NE2 3.41Å
316	Y	84.7	Confident	82.8	Confident	56 Å²	56	63.6 Å²	63.6	22%	0.22	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	137.4	179.4	-62.7	-91.2	0	0	0	110.4	F307 F310 E311 K314 I366 F367 P369	F307-Y316 HydrophobicContact CD1-CG 4.5Å; F310-Y316 HydrophobicContact CB-CD2 4.39Å; F310-Y316 HydrophobicContact CB-CE2 3.86Å; E311-Y316 PolarHBondContact N-OH 3.4Å; K314-Y316 HydrophobicContact CB-CE2 3.67Å; K314-Y316 VanDerWaalsContact O-CD2 3.31Å; K314-Y316 WeakPolarHBondContact O-CD2 3.19Å; K314-Y316 WeakPolarHBondContact O-CE2 3.29Å; Y316-I366 CarbonylContact O-C 3.55Å; Y316-I366 VanDerWaalsContact O-CA 3.28Å; Y316-I366 WeakPolarHBondContact O-CA 3.29Å; Y316-I366 WeakPolarHBondContact O-CG2 3.29Å; Y316-F367 HydrophobicContact CD2-CD1 4.24Å; Y316-F367 PolarHBondContact N-O 2.79Å; Y316-F367 PolarHBondContact O-N 2.99Å; Y316-P369 HydrophobicContact CD2-CG 4.36Å; Y316-P369 HydrophobicContact CE2-CG 4.21Å
317	K	86.8	Confident	82.4	Confident	151 Å²	151	70.1 Å²	70.1	66%	0.657	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.7	177.2	-74.5	179	178.8	-179.8	0	109.2	L364 V365 I366	K317-L364 HydrophobicContact CB-CD1 4.18Å; K317-V365 WeakPolarHBondContact CA-O 3.48Å; K317-I366 HydrophobicContact CG-CG1 4.23Å; K317-I366 HydrophobicContact CG-CG2 3.87Å
318	K	86.1	Confident	82	Confident	58 Å²	58	72.5 Å²	72.5	25%	0.252	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	125.3	174.9	-162.4	170.7	-168.9	-177.9	0	110.3	V305 L306 F307 V365	V305-K318 HydrophobicContact CG1-CD 4.13Å; L306-K318 PolarHBondContact O-NZ 3.28Å; F307-K318 HydrophobicContact CE1-CB 3.62Å; F307-K318 HydrophobicContact CE2-CB 4.41Å; F307-K318 HydrophobicContact CZ-CB 3.52Å; F307-K318 HydrophobicContact CZ-CD 4.49Å; K318-V365 PolarHBondContact N-O 2.67Å; K318-V365 PolarHBondContact O-N 3.19Å
319	R	86.8	Confident	81.9	Confident	151 Å²	151	70.8 Å²	70.8	57%	0.57	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	133.3	174	-168	167.6	74.9	164.9	-0.3	109.5	E362 I363	R319-E362 VanDerWaalsContact CD-OE2 3.29Å; R319-E362 WeakPolarHBondContact CD-OE2 3.44Å; R319-E362 HydrophobicContact CG-CB 4.32Å; R319-E362 IonicContact CZ-OE1 3.45Å; R319-E362 IonicContact CZ-OE2 2.75Å; R319-E362 IonicContact NE-OE1 2.69Å; R319-E362 PolarHBondContact NE-OE1 2.89Å; R319-E362 IonicContact NE-OE2 2.79Å; R319-E362 IonicContact NH1-OE1 3.18Å; R319-E362 PolarHBondContact NH1-OE1 3.38Å; R319-E362 IonicContact NH1-OE2 3.55Å; R319-E362 PolarHBondContact NH1-OE2 2.86Å; R319-E362 IonicContact NH2-OE1 2.67Å; R319-I363 CarbonylContact C-O 3.59Å; R319-I363 WeakPolarHBondContact CA-O 3.37Å
320	I	87.8	Confident	81.7	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138	172.5	-51.1	166.2	0	0	0	106.9	K301 V305 L322 E362 I363 V365	K301-I320 WeakPolarHBondContact O-CA 3.38Å; V305-I320 HydrophobicContact CB-CD1 4.31Å; V305-I320 HydrophobicContact CG1-CD1 3.97Å; V305-I320 HydrophobicContact CG1-CG1 4.35Å; V305-I320 HydrophobicContact CG2-CD1 3.31Å; V305-I320 HydrophobicContact CG2-CG1 3.97Å; I320-L322 HydrophobicContact CG2-CD2 4.15Å; I320-E362 WeakPolarHBondContact O-CA 3.37Å; I320-I363 HydrophobicContact CB-CB 4.39Å; I320-I363 PolarHBondContact N-O 3.2Å; I320-I363 PolarHBondContact O-N 2.88Å; I320-V365 HydrophobicContact CD1-CB 4.47Å; I320-V365 HydrophobicContact CD1-CG2 3.38Å; I320-V365 HydrophobicContact CG1-CG2 4.19Å
321	V	86.5	Confident	81.6	Confident	38 Å²	38	73 Å²	73	23%	0.23	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.6	170.4	-176.2	0	0	0	0	108.4	S300 K301 C361	S300-V321 CarbonylContact C-O 3.57Å; S300-V321 WeakPolarHBondContact CA-O 3.31Å; K301-V321 HydrophobicContact CB-CB 4.47Å; K301-V321 PolarHBondContact N-O 3.27Å; K301-V321 PolarHBondContact O-N 2.87Å; V321-C361 CarbonylContact C-O 3.6Å; V321-C361 WeakPolarHBondContact CA-O 3.41Å
322	L	85.3	Confident	81.7	Confident	1 Å²	1	70 Å²	70	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	114.7	169.8	-63.1	-171	0	0	0	109.6	F298 S299 I320 S360 C361 I363 F381 F388 V390	F298-L322 HydrophobicContact CB-CB 4.47Å; F298-L322 HydrophobicContact CD1-CB 4.03Å; S299-L322 WeakPolarHBondContact O-CA 3.38Å; I320-L322 HydrophobicContact CG2-CD2 4.15Å; L322-S360 CarbonylContact O-C 3.56Å; L322-S360 VanDerWaalsContact O-CA 3.24Å; L322-S360 WeakPolarHBondContact O-CA 3.41Å; L322-C361 PolarHBondContact N-O 3.46Å; L322-C361 PolarHBondContact O-N 3.46Å; L322-I363 HydrophobicContact CD1-CD1 3.46Å; L322-I363 VanDerWaalsContact CD1-CD1 3.46Å; L322-I363 HydrophobicContact CD2-CD1 4.49Å; L322-I363 HydrophobicContact CG-CD1 3.67Å; L322-F381 HydrophobicContact CD1-CD1 4.45Å; L322-F381 HydrophobicContact CD1-CD2 4.49Å; L322-F381 HydrophobicContact CD1-CE1 4.43Å; L322-F381 HydrophobicContact CD1-CE2 4.46Å; L322-F381 HydrophobicContact CD1-CG 4.5Å; L322-F381 HydrophobicContact CD1-CZ 4.44Å; L322-F388 HydrophobicContact CD1-CE2 4.09Å; L322-F388 HydrophobicContact CD1-CZ 3.95Å; L322-V390 HydrophobicContact CD2-CG2 4.12Å
323	T	86	Confident	81.6	Confident	23 Å²	23	72.1 Å²	72.1	14%	0.141	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129.4	175	-55.3	0	0	0	0	109.7	F298 S299 I325 S360	F298-T323 CarbonylContact C-O 3.53Å; F298-T323 VanDerWaalsContact CA-O 3.28Å; F298-T323 WeakPolarHBondContact CA-O 3.4Å; S299-T323 PolarHBondContact N-O 3.44Å; S299-T323 PolarHBondContact O-N 3.34Å; T323-I325 HydrophobicContact CG2-CG2 4.35Å; T323-I325 PolarHBondContact O-N 3.13Å; T323-S360 WeakPolarHBondContact CB-OG 3.45Å; T323-S360 WeakPolarHBondContact CG2-OG 3.49Å; T323-S360 PolarHBondContact OG1-OG 3Å
324	N	84.5	Confident	82.1	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	117.2	170.4	179.3	8.2	0	0	0	109.1	P297 F298 S326 T328 L355 G358 M359	P297-N324 PolarHBondContact O-OD1 3.43Å; F298-N324 HydrophobicContact CD1-CB 4.15Å; F298-N324 HydrophobicContact CE1-CB 3.66Å; F298-N324 HydrophobicContact CZ-CB 4.13Å; N324-S326 WeakPolarHBondContact OD1-CB 3.36Å; N324-S326 PolarHBondContact OD1-N 2.81Å; N324-S326 PolarHBondContact OD1-O 2.8Å; N324-S326 PolarHBondContact OD1-OG 3.03Å; N324-T328 PolarHBondContact ND2-O 3.23Å; N324-L355 HydrophobicContact CB-CB 4.48Å; N324-L355 PolarHBondContact ND2-O 3.17Å; N324-G358 PolarHBondContact O-N 3.27Å; N324-M359 PolarHBondContact N-O 2.95Å
325	I	82.1	Confident	82.1	Confident	74 Å²	74	70.7 Å²	70.7	38%	0.379	32%	0.315	S	S	.	.			trans	-110.1	4.5	178.7	62.7	163.7	0	0	0	113.1	P296 P297 T323	P296-I325 VanDerWaalsContact O-CD1 3.28Å; P296-I325 WeakPolarHBondContact O-CD1 3.43Å; P296-I325 VanDerWaalsContact O-CG1 3.25Å; P296-I325 WeakPolarHBondContact O-CG1 3.49Å; P297-I325 PolarHBondContact O-N 2.9Å; T323-I325 HydrophobicContact CG2-CG2 4.35Å; T323-I325 PolarHBondContact O-N 3.13Å
326	S	74.9	Confident	81.9	Confident	17 Å²	17	68.9 Å²	68.9	12%	0.119	31%	0.309	C	S	.	.	S	Bend	trans	-79.2	148.3	167.2	70.6	0	0	0	0	110.7	P297 N324 T328 T357	P297-S326 PolarHBondContact O-N 3.47Å; N324-S326 WeakPolarHBondContact OD1-CB 3.36Å; N324-S326 PolarHBondContact OD1-N 2.81Å; N324-S326 PolarHBondContact OD1-O 2.8Å; N324-S326 PolarHBondContact OD1-OG 3.03Å; S326-T328 PolarHBondContact O-N 2.65Å; S326-T328 PolarHBondContact OG-O 2.81Å; S326-T357 WeakPolarHBondContact O-CG2 3.33Å; S326-T357 PolarHBondContact O-OG1 3.09Å
327	Y	75.4	Confident	81.9	Confident	199 Å²	199	67.3 Å²	67.3	78%	0.78	30%	0.304	S	S	*	.	S	Bend	trans	-72.3	11.9	-178.1	-63.5	-77.1	0	0	0	114.5	T357	Y327-T357 VanDerWaalsContact C-OG1 3.25Å; Y327-T357 PolarHBondContact O-OG1 2.78Å
328	T	75.6	Confident	81.9	Confident	64 Å²	64	61.8 Å²	61.8	39%	0.393	28%	0.284	S	S	.	.	S	Bend	trans	-138.9	153.8	-168.9	47	0	0	0	0	110.4	N324 S326 N330 T357 F385	N324-T328 PolarHBondContact ND2-O 3.23Å; S326-T328 PolarHBondContact O-N 2.65Å; S326-T328 PolarHBondContact OG-O 2.81Å; T328-N330 PolarHBondContact O-N 3.49Å; T328-T357 PolarHBondContact N-OG1 2.95Å; T328-F385 WeakPolarHBondContact OG1-CE2 3.49Å; T328-F385 WeakPolarHBondContact OG1-CZ 3.46Å
329	I	78	Confident	81.6	Confident	107 Å²	107	63 Å²	63	55%	0.549	31%	0.305	S	S	.	.			trans	-57.9	131	170.5	-62.8	170.5	0	0	0	109.7	S354	I329-S354 VanDerWaalsContact CG2-CB 3.42Å
330	N	76.7	Confident	81.1	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.011	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-137.3	151.8	-176.1	-162.7	-12.3	0	0	0	110.4	P297 F298 T328 L355 S383 T384	P297-N330 WeakPolarHBondContact CB-ND2 3.26Å; F298-N330 HydrophobicContact CE2-CB 4.24Å; F298-N330 HydrophobicContact CZ-CB 4.19Å; T328-N330 PolarHBondContact O-N 3.49Å; N330-L355 PolarHBondContact N-O 3.35Å; N330-L355 WeakPolarHBondContact O-CB 3.36Å; N330-L355 PolarHBondContact O-N 3.08Å; N330-S383 WeakPolarHBondContact OD1-CB 3.49Å; N330-T384 VanDerWaalsContact CG-OG1 3.27Å; N330-T384 PolarHBondContact OD1-N 3.43Å; N330-T384 PolarHBondContact OD1-OG1 3.31Å
331	F	78.9	Confident	80.7	Confident	98 Å²	98	58.3 Å²	58.3	43%	0.43	30%	0.299	S	S	.	.			trans	-100	150.6	168.6	58.3	-109	0	0	0	110.1	E382 S383 T384	F331-E382 HydrophobicContact CE2-CG 4.33Å; F331-S383 WeakPolarHBondContact O-CA 3.4Å; F331-T384 HydrophobicContact CD1-CG2 3.55Å; F331-T384 HydrophobicContact CE1-CG2 3.41Å; F331-T384 VanDerWaalsContact CE1-CG2 3.41Å; F331-T384 HydrophobicContact CG-CG2 4.29Å; F331-T384 HydrophobicContact CZ-CG2 4.05Å
332	C	79.7	Confident	80.2	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.02	32%	0.317	C	S	.	.			trans	-121	123.4	169.1	179.9	0	0	0	0	108	F298 F349 L355	F298-C332 HydrophobicContact CE1-CB 4.17Å; F298-C332 HydrophobicContact CE2-CB 3.98Å; F298-C332 HydrophobicContact CZ-CB 3.73Å; C332-F349 HydrophobicContact CB-CZ 4.27Å; C332-F349 WeakPolarHBondContact O-CE1 3.44Å; C332-F349 VanDerWaalsContact O-CZ 3.24Å; C332-F349 WeakPolarHBondContact O-CZ 3.34Å; C332-L355 HydrophobicContact CB-CD1 4.4Å
333	K	79.8	Confident	79.8	Confident	114 Å²	114	68.7 Å²	68.7	50%	0.496	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	125.3	178.8	175	179.3	158.6	-139.6	0	109.6	I335 F381 E382	K333-I335 PolarHBondContact O-N 3.38Å; K333-F381 CarbonylContact O-C 3.55Å; K333-F381 WeakPolarHBondContact O-CA 3.38Å; K333-E382 HydrophobicContact CB-CB 4.28Å; K333-E382 PolarHBondContact N-O 2.94Å; K333-E382 IonicContact NZ-OE2 3.25Å; K333-E382 PolarHBondContact NZ-OE2 3.41Å; K333-E382 PolarHBondContact O-N 3.48Å
334	F	83.3	Confident	79.5	Confident	65 Å²	65	68.8 Å²	68.8	29%	0.285	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	127.9	174.2	167.6	-94.5	0	0	0	110.1	I337 V347 F349 I379 F381	F334-I337 HydrophobicContact CE2-CD1 4.34Å; F334-I337 HydrophobicContact CE2-CG1 3.77Å; F334-I337 HydrophobicContact CZ-CD1 4.1Å; F334-I337 HydrophobicContact CZ-CG1 3.8Å; F334-V347 HydrophobicContact CD2-CB 4.13Å; F334-V347 HydrophobicContact CD2-CG1 3.88Å; F334-V347 HydrophobicContact CD2-CG2 4.46Å; F334-V347 HydrophobicContact CE2-CB 3.66Å; F334-V347 HydrophobicContact CE2-CG1 3.94Å; F334-V347 HydrophobicContact CE2-CG2 3.76Å; F334-V347 HydrophobicContact CZ-CB 4.09Å; F334-V347 HydrophobicContact CZ-CG2 4.39Å; F334-F349 HydrophobicContact CB-CD1 3.78Å; F334-F349 HydrophobicContact CB-CE1 4.41Å; F334-F349 HydrophobicContact CB-CG 4.43Å; F334-I379 HydrophobicContact CD2-CG2 3.78Å; F334-I379 HydrophobicContact CE2-CG2 3.71Å; F334-F381 HydrophobicContact CB-CD1 4.28Å; F334-F381 HydrophobicContact CB-CE1 4.17Å; F334-F381 HydrophobicContact CD2-CE1 4.18Å
335	I	82.5	Confident	79.4	Confident	70 Å²	70	69.2 Å²	69.2	36%	0.359	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-63.1	178.5	-53.6	170.3	0	0	0	109.9	K333 Y380 E382 P387	K333-I335 PolarHBondContact O-N 3.38Å; I335-Y380 PolarHBondContact N-O 2.89Å; I335-E382 HydrophobicContact CD1-CB 3.8Å; I335-E382 HydrophobicContact CG1-CB 3.7Å; I335-P387 HydrophobicContact CD1-CB 4.26Å
336	R	78.3	Confident	79.3	Confident	154 Å²	154	68.2 Å²	68.2	58%	0.581	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-167.3	166.5	-169	65.6	-173.4	-178.2	-159.3	1	111.2	Y380	R336-Y380 HydrophobicContact CG-CD2 3.98Å; R336-Y380 HydrophobicContact CG-CG 4.27Å; R336-Y380 PolarHBondContact O-N 3.41Å
337	I	85.6	Confident	79.7	Confident	23 Å²	23	68.6 Å²	68.6	12%	0.118	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	151.4	169.5	-57.1	162.9	0	0	0	107.6	F334 L341 I345 V347 I379	F334-I337 HydrophobicContact CE2-CD1 4.34Å; F334-I337 HydrophobicContact CE2-CG1 3.77Å; F334-I337 HydrophobicContact CZ-CD1 4.1Å; F334-I337 HydrophobicContact CZ-CG1 3.8Å; I337-L341 HydrophobicContact CG2-CB 3.49Å; I337-L341 VanDerWaalsContact CG2-CB 3.49Å; I337-I345 HydrophobicContact CD1-CB 4.17Å; I337-I345 HydrophobicContact CD1-CG2 4.05Å; I337-I345 WeakPolarHBondContact CD1-O 3.28Å; I337-V347 HydrophobicContact CD1-CG2 3.85Å; I337-V347 HydrophobicContact CG1-CG2 4.17Å; I337-I379 HydrophobicContact CG1-CG1 4.46Å
338	S	86.3	Confident	79.8	Confident	35 Å²	35	63.7 Å²	63.7	25%	0.245	34%	0.335	C	S	.	.			trans	-54.2	145	169.5	-173.6	0	0	0	0	111.5	A340 L341 K342 E378	S338-A340 VanDerWaalsContact C-N 3.29Å; S338-A340 PolarHBondContact O-N 2.88Å; S338-L341 PolarHBondContact O-N 2.99Å; S338-K342 PolarHBondContact O-N 3.45Å; S338-K342 VanDerWaalsContact O-N 3.13Å; S338-E378 PolarHBondContact N-O 3.22Å
339	A	79.4	Confident	79.9	Confident	83 Å²	83	61.9 Å²	61.9	69%	0.686	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-54.6	-42.2	-173.3	0	0	0	0	0	113	L341 K342	A339-L341 PolarHBondContact O-N 3.46Å; A339-L341 VanDerWaalsContact O-N 3.11Å; A339-K342 PolarHBondContact O-N 2.9Å
340	A	76.3	Confident	79.4	Confident	53 Å²	53	64.7 Å²	64.7	44%	0.438	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-63.8	-14.1	178.8	0	0	0	0	0	114.9	S338 F344	S338-A340 VanDerWaalsContact C-N 3.29Å; S338-A340 PolarHBondContact O-N 2.88Å; A340-F344 WeakPolarHBondContact O-CE2 3.36Å
341	L	79.1	Confident	78.7	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-115.7	-7.6	179.9	-71.4	175.3	0	0	0	113.1	I337 S338 A339 D343 F344 I345 L375 V392	I337-L341 HydrophobicContact CG2-CB 3.49Å; I337-L341 VanDerWaalsContact CG2-CB 3.49Å; S338-L341 PolarHBondContact O-N 2.99Å; A339-L341 PolarHBondContact O-N 3.46Å; A339-L341 VanDerWaalsContact O-N 3.11Å; L341-D343 VanDerWaalsContact C-N 3.32Å; L341-D343 PolarHBondContact O-N 2.83Å; L341-F344 PolarHBondContact O-N 2.82Å; L341-I345 HydrophobicContact CB-CD1 4.44Å; L341-I345 HydrophobicContact CD1-CD1 4.38Å; L341-I345 HydrophobicContact CD2-CD1 4.01Å; L341-I345 WeakPolarHBondContact O-CA 3.5Å; L341-I345 PolarHBondContact O-N 3.42Å; L341-L375 HydrophobicContact CD2-CB 3.55Å; L341-L375 HydrophobicContact CD2-CD1 4.28Å; L341-V392 HydrophobicContact CD1-CB 3.73Å; L341-V392 HydrophobicContact CD1-CG1 4.1Å; L341-V392 HydrophobicContact CD1-CG2 4.36Å
342	K	75.9	Confident	78	Confident	140 Å²	140	66.3 Å²	66.3	61%	0.609	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-39.3	-170.7	-175.3	-168.7	170.3	-158.5	0	113.4	S338 A339	S338-K342 PolarHBondContact O-N 3.45Å; S338-K342 VanDerWaalsContact O-N 3.13Å; A339-K342 PolarHBondContact O-N 2.9Å
343	D	77.6	Confident	77.5	Confident	117 Å²	117	68.9 Å²	68.9	63%	0.626	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-9.8	-171.7	-53.8	-31.6	0	0	0	113	L341	L341-D343 VanDerWaalsContact C-N 3.32Å; L341-D343 PolarHBondContact O-N 2.83Å
344	F	79.8	Confident	77.4	Confident	26 Å²	26	67.9 Å²	67.9	11%	0.114	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-21.2	176.3	-39.7	-65.7	0	0	0	112.3	A340 L341 F367 H368 L370 I371 L375	A340-F344 WeakPolarHBondContact O-CE2 3.36Å; L341-F344 PolarHBondContact O-N 2.82Å; F344-F367 HydrophobicContact CB-CD2 4.05Å; F344-F367 HydrophobicContact CB-CE2 3.8Å; F344-F367 WeakPolarHBondContact O-CA 3.44Å; F344-H368 PolarHBondContact O-N 2.93Å; F344-L370 HydrophobicContact CD1-CB 4.06Å; F344-L370 HydrophobicContact CD1-CD1 4.43Å; F344-L370 HydrophobicContact CD1-CG 4.25Å; F344-L370 HydrophobicContact CE1-CB 3.98Å; F344-I371 HydrophobicContact CE1-CD1 4.17Å; F344-I371 HydrophobicContact CE1-CG1 4.01Å; F344-I371 HydrophobicContact CZ-CD1 3.74Å; F344-I371 HydrophobicContact CZ-CG1 4.05Å; F344-L375 HydrophobicContact CB-CD1 4.43Å; F344-L375 HydrophobicContact CD2-CD1 3.45Å; F344-L375 VanDerWaalsContact CD2-CD1 3.45Å; F344-L375 HydrophobicContact CE2-CD1 3.88Å; F344-L375 HydrophobicContact CE2-CD2 4.3Å; F344-L375 HydrophobicContact CG-CD1 3.98Å
345	I	82.9	Confident	77.3	Confident	9 Å²	9	65.4 Å²	65.4	5%	0.046	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	96.8	178.2	-26.2	167.6	0	0	0	118.9	I337 L341 V347 V365 F367 V392	I337-I345 HydrophobicContact CD1-CB 4.17Å; I337-I345 HydrophobicContact CD1-CG2 4.05Å; I337-I345 WeakPolarHBondContact CD1-O 3.28Å; L341-I345 HydrophobicContact CB-CD1 4.44Å; L341-I345 HydrophobicContact CD1-CD1 4.38Å; L341-I345 HydrophobicContact CD2-CD1 4.01Å; L341-I345 WeakPolarHBondContact O-CA 3.5Å; L341-I345 PolarHBondContact O-N 3.42Å; I345-V347 HydrophobicContact CG2-CG2 4Å; I345-V365 HydrophobicContact CD1-CG1 4.44Å; I345-V365 HydrophobicContact CG2-CG1 3.48Å; I345-V365 VanDerWaalsContact CG2-CG1 3.48Å; I345-F367 HydrophobicContact CD1-CB 4.44Å; I345-F367 HydrophobicContact CD1-CD2 4.04Å; I345-F367 HydrophobicContact CG1-CB 4.16Å; I345-F367 HydrophobicContact CG1-CD2 3.61Å; I345-F367 HydrophobicContact CG1-CE2 4.49Å; I345-F367 HydrophobicContact CG1-CG 4.29Å; I345-V392 HydrophobicContact CD1-CG1 3.76Å
346	S	80.1	Confident	77.2	Confident	54 Å²	54	64.7 Å²	64.7	38%	0.378	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.5	160.8	58.7	0	0	0	0	112	I366 H368	S346-I366 PolarHBondContact N-O 2.78Å; S346-I366 WeakPolarHBondContact O-CA 3.47Å; S346-I366 PolarHBondContact O-N 2.7Å; S346-I366 PolarHBondContact OG-O 3.4Å; S346-H368 PolarHBondContact OG-CE1 3.2Å
347	V	81.7	Confident	77.3	Confident	25 Å²	25	60.9 Å²	60.9	15%	0.152	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	109.9	177.1	177	0	0	0	0	108.4	F334 I337 I345 F349 I363 V365 I379	F334-V347 HydrophobicContact CD2-CB 4.13Å; F334-V347 HydrophobicContact CD2-CG1 3.88Å; F334-V347 HydrophobicContact CD2-CG2 4.46Å; F334-V347 HydrophobicContact CE2-CB 3.66Å; F334-V347 HydrophobicContact CE2-CG1 3.94Å; F334-V347 HydrophobicContact CE2-CG2 3.76Å; F334-V347 HydrophobicContact CZ-CB 4.09Å; F334-V347 HydrophobicContact CZ-CG2 4.39Å; I337-V347 HydrophobicContact CD1-CG2 3.85Å; I337-V347 HydrophobicContact CG1-CG2 4.17Å; I345-V347 HydrophobicContact CG2-CG2 4Å; V347-F349 HydrophobicContact CG1-CB 4.07Å; V347-F349 PolarHBondContact O-N 3.38Å; V347-I363 HydrophobicContact CG1-CG2 3.52Å; V347-V365 HydrophobicContact CG2-CG2 4.29Å; V347-I379 HydrophobicContact CG2-CD1 3.98Å; V347-I379 HydrophobicContact CG2-CG1 4.35Å; V347-I379 HydrophobicContact CG2-CG2 4.35Å
348	N	78	Confident	76.9	Confident	95 Å²	95	62.1 Å²	62.1	51%	0.508	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	106.1	166.9	-175.6	15	0	0	0	108.5	L364	N348-L364 HydrophobicContact CB-CB 4.3Å; N348-L364 PolarHBondContact N-O 2.85Å; N348-L364 PolarHBondContact O-N 3.45Å
349	F	77.4	Confident	76.7	Confident	26 Å²	26	65.7 Å²	65.7	11%	0.114	41%	0.405	C	S	.	.			trans	-132	108.6	177	174.2	-111	0	0	0	108.2	C332 F334 V347 P351 C361 I363	C332-F349 HydrophobicContact CB-CZ 4.27Å; C332-F349 WeakPolarHBondContact O-CE1 3.44Å; C332-F349 VanDerWaalsContact O-CZ 3.24Å; C332-F349 WeakPolarHBondContact O-CZ 3.34Å; F334-F349 HydrophobicContact CB-CD1 3.78Å; F334-F349 HydrophobicContact CB-CE1 4.41Å; F334-F349 HydrophobicContact CB-CG 4.43Å; V347-F349 HydrophobicContact CG1-CB 4.07Å; V347-F349 PolarHBondContact O-N 3.38Å; F349-P351 HydrophobicContact CD1-CB 4.45Å; F349-P351 HydrophobicContact CE1-CB 3.85Å; F349-P351 HydrophobicContact CZ-CB 4.39Å; F349-P351 WeakPolarHBondContact O-CD 3.49Å; F349-C361 VanDerWaalsContact CE2-SG 3.54Å; F349-I363 HydrophobicContact CB-CG1 4.46Å; F349-I363 HydrophobicContact CD2-CB 4.48Å; F349-I363 HydrophobicContact CD2-CD1 4.37Å; F349-I363 HydrophobicContact CD2-CG1 3.41Å; F349-I363 VanDerWaalsContact CD2-CG1 3.41Å; F349-I363 HydrophobicContact CE2-CG1 3.93Å; F349-I363 HydrophobicContact CG-CG1 4.25Å
350	Q	68.4	Low	77	Confident	166 Å²	166	64.4 Å²	64.4	78%	0.776	39%	0.391	S	S	*	.			trans	-90.4	110.2	170.9	-167	159.3	2.9	0	0	106.9	P352	Q350-P352 WeakPolarHBondContact O-CD 3.49Å
351	P	62.1	Low	77.3	Confident	88 Å²	88	62.4 Å²	62.4	57%	0.571	37%	0.374	S	S	*	.			trans	-64.8	123.3	-169.9	24.7	-33.4	0	0	0	109.9	F349	F349-P351 HydrophobicContact CD1-CB 4.45Å; F349-P351 HydrophobicContact CE1-CB 3.85Å; F349-P351 HydrophobicContact CZ-CB 4.39Å; F349-P351 WeakPolarHBondContact O-CD 3.49Å
352	P	64.3	Low	77.5	Confident	47 Å²	47	67.3 Å²	67.3	31%	0.305	40%	0.397	S	S	.	.			trans	-68.2	166.8	165.8	34.1	-36.3	0	0	0	108.8	Q350 L355 C361	Q350-P352 WeakPolarHBondContact O-CD 3.49Å; P352-L355 HydrophobicContact CB-CD2 4.04Å; P352-L355 HydrophobicContact CG-CD1 3.88Å; P352-L355 HydrophobicContact CG-CD2 3.83Å; P352-L355 HydrophobicContact CG-CG 3.94Å; P352-C361 WeakPolarHBondContact CD-SG 3.31Å; P352-C361 HydrophobicContact CG-CB 3.98Å; P352-C361 VanDerWaalsContact CG-SG 3.58Å
353	G	69.1	Low	78	Confident	57 Å²	57	60.8 Å²	60.8	59%	0.588	37%	0.368	S	S	*	.	S	Bend	trans	-67	-160.9	166.1	0	0	0	0	0	112.6	L355	G353-L355 PolarHBondContact O-N 2.86Å; G353-L355 VanDerWaalsContact O-N 3.15Å
354	S	76.8	Confident	78.4	Confident	92 Å²	92	57.7 Å²	57.7	64%	0.643	35%	0.352	S	S	*	.			trans	-46.3	115	170.9	39	0	0	0	0	113.2	I329	I329-S354 VanDerWaalsContact CG2-CB 3.42Å
355	L	81.6	Confident	78.7	Confident	13 Å²	13	56.5 Å²	56.5	7%	0.068	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-93	111.8	176.4	-66.1	173	0	0	0	110.1	F298 N324 N330 C332 P352 G353 M359 C361	F298-L355 HydrophobicContact CE1-CD1 3.66Å; F298-L355 HydrophobicContact CZ-CD1 4.01Å; N324-L355 HydrophobicContact CB-CB 4.48Å; N324-L355 PolarHBondContact ND2-O 3.17Å; N330-L355 PolarHBondContact N-O 3.35Å; N330-L355 WeakPolarHBondContact O-CB 3.36Å; N330-L355 PolarHBondContact O-N 3.08Å; C332-L355 HydrophobicContact CB-CD1 4.4Å; P352-L355 HydrophobicContact CB-CD2 4.04Å; P352-L355 HydrophobicContact CG-CD1 3.88Å; P352-L355 HydrophobicContact CG-CD2 3.83Å; P352-L355 HydrophobicContact CG-CG 3.94Å; G353-L355 PolarHBondContact O-N 2.86Å; G353-L355 VanDerWaalsContact O-N 3.15Å; L355-M359 HydrophobicContact CD2-CB 4.29Å; L355-C361 HydrophobicContact CD1-CB 3.97Å
356	S	80.2	Confident	78.8	Confident	55 Å²	55	57.2 Å²	57.2	39%	0.385	35%	0.35	S	S	.	.			trans	-64.5	161.8	171.3	-55.4	0	0	0	0	112.5	G358 M359	S356-G358 PolarHBondContact O-N 3.02Å; S356-M359 VanDerWaalsContact O-CB 3.27Å; S356-M359 WeakPolarHBondContact O-CB 3.45Å; S356-M359 PolarHBondContact O-N 2.99Å
357	T	80.7	Confident	79	Confident	74 Å²	74	54.7 Å²	54.7	45%	0.454	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.2	128.3	172.2	-47.3	0	0	0	0	111.5	S326 Y327 T328 M359	S326-T357 WeakPolarHBondContact O-CG2 3.33Å; S326-T357 PolarHBondContact O-OG1 3.09Å; Y327-T357 VanDerWaalsContact C-OG1 3.25Å; Y327-T357 PolarHBondContact O-OG1 2.78Å; T328-T357 PolarHBondContact N-OG1 2.95Å; T357-M359 PolarHBondContact O-N 2.82Å
358	G	77.1	Confident	79.1	Confident	49 Å²	49	55.5 Å²	55.5	51%	0.505	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	-15.1	-179.2	0	0	0	0	0	115.7	N324 S356	N324-G358 PolarHBondContact O-N 3.27Å; S356-G358 PolarHBondContact O-N 3.02Å
359	M	83.2	Confident	79.3	Confident	110 Å²	110	51 Å²	51	54%	0.542	31%	0.311	S	S	.	.			trans	-67.3	148.2	172.3	-64.3	-63.9	-75.6	0	0	110.4	N324 L355 S356 T357	N324-M359 PolarHBondContact N-O 2.95Å; L355-M359 HydrophobicContact CD2-CB 4.29Å; S356-M359 VanDerWaalsContact O-CB 3.27Å; S356-M359 WeakPolarHBondContact O-CB 3.45Å; S356-M359 PolarHBondContact O-N 2.99Å; T357-M359 PolarHBondContact O-N 2.82Å
360	S	84.4	Confident	79.3	Confident	56 Å²	56	55.4 Å²	55.4	39%	0.392	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	146.3	-173.8	-60.5	0	0	0	0	112	L322 T323	L322-S360 CarbonylContact O-C 3.56Å; L322-S360 VanDerWaalsContact O-CA 3.24Å; L322-S360 WeakPolarHBondContact O-CA 3.41Å; T323-S360 WeakPolarHBondContact CB-OG 3.45Å; T323-S360 WeakPolarHBondContact CG2-OG 3.49Å; T323-S360 PolarHBondContact OG1-OG 3Å
361	C	83.4	Confident	79.8	Confident	12 Å²	12	51.1 Å²	51.1	8%	0.081	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147.4	174.5	-174.8	0	0	0	0	111	V321 L322 F349 P352 L355	V321-C361 CarbonylContact C-O 3.6Å; V321-C361 WeakPolarHBondContact CA-O 3.41Å; L322-C361 PolarHBondContact N-O 3.46Å; L322-C361 PolarHBondContact O-N 3.46Å; F349-C361 VanDerWaalsContact CE2-SG 3.54Å; P352-C361 WeakPolarHBondContact CD-SG 3.31Å; P352-C361 HydrophobicContact CG-CB 3.98Å; P352-C361 VanDerWaalsContact CG-SG 3.58Å; L355-C361 HydrophobicContact CD1-CB 3.97Å
362	E	83.6	Confident	80.6	Confident	103 Å²	103	51.6 Å²	51.6	48%	0.481	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128	176.8	-52.1	-160.1	141	0	0	111.2	R319 I320	R319-E362 VanDerWaalsContact CD-OE2 3.29Å; R319-E362 WeakPolarHBondContact CD-OE2 3.44Å; R319-E362 HydrophobicContact CG-CB 4.32Å; R319-E362 IonicContact CZ-OE1 3.45Å; R319-E362 IonicContact CZ-OE2 2.75Å; R319-E362 IonicContact NE-OE1 2.69Å; R319-E362 PolarHBondContact NE-OE1 2.89Å; R319-E362 IonicContact NE-OE2 2.79Å; R319-E362 IonicContact NH1-OE1 3.18Å; R319-E362 PolarHBondContact NH1-OE1 3.38Å; R319-E362 IonicContact NH1-OE2 3.55Å; R319-E362 PolarHBondContact NH1-OE2 2.86Å; R319-E362 IonicContact NH2-OE1 2.67Å; I320-E362 WeakPolarHBondContact O-CA 3.37Å
363	I	85.6	Confident	81.3	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.9	170	-63.9	154.4	0	0	0	108.3	R319 I320 L322 V347 F349 V365 F381	R319-I363 CarbonylContact C-O 3.59Å; R319-I363 WeakPolarHBondContact CA-O 3.37Å; I320-I363 HydrophobicContact CB-CB 4.39Å; I320-I363 PolarHBondContact N-O 3.2Å; I320-I363 PolarHBondContact O-N 2.88Å; L322-I363 HydrophobicContact CD1-CD1 3.46Å; L322-I363 VanDerWaalsContact CD1-CD1 3.46Å; L322-I363 HydrophobicContact CD2-CD1 4.49Å; L322-I363 HydrophobicContact CG-CD1 3.67Å; V347-I363 HydrophobicContact CG1-CG2 3.52Å; F349-I363 HydrophobicContact CB-CG1 4.46Å; F349-I363 HydrophobicContact CD2-CB 4.48Å; F349-I363 HydrophobicContact CD2-CD1 4.37Å; F349-I363 HydrophobicContact CD2-CG1 3.41Å; F349-I363 VanDerWaalsContact CD2-CG1 3.41Å; F349-I363 HydrophobicContact CE2-CG1 3.93Å; F349-I363 HydrophobicContact CG-CG1 4.25Å; I363-V365 HydrophobicContact CG2-CG2 3.84Å; I363-F381 HydrophobicContact CD1-CE1 3.58Å; I363-F381 HydrophobicContact CD1-CE2 4.39Å; I363-F381 HydrophobicContact CD1-CZ 3.46Å; I363-F381 VanDerWaalsContact CD1-CZ 3.46Å; I363-F381 HydrophobicContact CG1-CE1 4.46Å
364	L	85.5	Confident	81.9	Confident	53 Å²	53	55.9 Å²	55.9	28%	0.277	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	103.9	170.1	-174.5	69.3	0	0	0	110.3	K317 N348 I366	K317-L364 HydrophobicContact CB-CD1 4.18Å; N348-L364 HydrophobicContact CB-CB 4.3Å; N348-L364 PolarHBondContact N-O 2.85Å; N348-L364 PolarHBondContact O-N 3.45Å; L364-I366 HydrophobicContact CD2-CD1 4.22Å; L364-I366 HydrophobicContact CD2-CG1 4.35Å; L364-I366 HydrophobicContact CG-CG1 4.15Å
365	V	86.4	Confident	82.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	123.6	174.5	-176.7	0	0	0	0	109.2	F307 K317 K318 I320 I345 V347 I363 I379	F307-V365 HydrophobicContact CE2-CG1 4.05Å; F307-V365 HydrophobicContact CZ-CB 4.42Å; F307-V365 HydrophobicContact CZ-CG1 4.07Å; K317-V365 WeakPolarHBondContact CA-O 3.48Å; K318-V365 PolarHBondContact N-O 2.67Å; K318-V365 PolarHBondContact O-N 3.19Å; I320-V365 HydrophobicContact CD1-CB 4.47Å; I320-V365 HydrophobicContact CD1-CG2 3.38Å; I320-V365 HydrophobicContact CG1-CG2 4.19Å; I345-V365 HydrophobicContact CD1-CG1 4.44Å; I345-V365 HydrophobicContact CG2-CG1 3.48Å; I345-V365 VanDerWaalsContact CG2-CG1 3.48Å; V347-V365 HydrophobicContact CG2-CG2 4.29Å; I363-V365 HydrophobicContact CG2-CG2 3.84Å; V365-I379 HydrophobicContact CG1-CD1 4.34Å; V365-I379 HydrophobicContact CG2-CD1 3.83Å
366	I	85.5	Confident	82.4	Confident	25 Å²	25	56.8 Å²	56.8	13%	0.128	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	109.3	-178.7	-39.3	-178.4	0	0	0	109.4	Y316 K317 S346 L364 H368	Y316-I366 CarbonylContact O-C 3.55Å; Y316-I366 VanDerWaalsContact O-CA 3.28Å; Y316-I366 WeakPolarHBondContact O-CA 3.29Å; Y316-I366 WeakPolarHBondContact O-CG2 3.29Å; K317-I366 HydrophobicContact CG-CG1 4.23Å; K317-I366 HydrophobicContact CG-CG2 3.87Å; S346-I366 PolarHBondContact N-O 2.78Å; S346-I366 WeakPolarHBondContact O-CA 3.47Å; S346-I366 PolarHBondContact O-N 2.7Å; S346-I366 PolarHBondContact OG-O 3.4Å; L364-I366 HydrophobicContact CD2-CD1 4.22Å; L364-I366 HydrophobicContact CD2-CG1 4.35Å; L364-I366 HydrophobicContact CG-CG1 4.15Å; I366-H368 WeakPolarHBondContact CG2-CE1 3.31Å; I366-H368 PolarHBondContact O-ND1 2.97Å
367	F	84.9	Confident	82.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129	-178.6	174.6	-130.2	0	0	0	111	F307 F310 Y316 F344 I345 P369 L375 C394	F307-F367 HydrophobicContact CB-CD1 4.03Å; F307-F367 HydrophobicContact CB-CE1 4.36Å; F307-F367 HydrophobicContact CD1-CB 4.22Å; F307-F367 HydrophobicContact CD1-CD1 4.16Å; F307-F367 HydrophobicContact CD2-CB 4.26Å; F307-F367 HydrophobicContact CD2-CD1 4.36Å; F307-F367 HydrophobicContact CD2-CG 4.48Å; F307-F367 HydrophobicContact CE1-CB 3.95Å; F307-F367 HydrophobicContact CE2-CB 4Å; F307-F367 HydrophobicContact CG-CB 4.36Å; F307-F367 AromaticContact CG-CD1 3.96Å; F307-F367 HydrophobicContact CG-CD1 3.96Å; F307-F367 HydrophobicContact CG-CG 4.47Å; F307-F367 HydrophobicContact CZ-CB 3.83Å; F310-F367 HydrophobicContact CB-CE1 3.91Å; F310-F367 AromaticContact CD1-CE1 3.59Å; F310-F367 HydrophobicContact CD1-CE1 3.59Å; F310-F367 AromaticContact CD1-CZ 3.97Å; F310-F367 HydrophobicContact CD1-CZ 3.97Å; F310-F367 HydrophobicContact CD2-CE1 4.05Å; F310-F367 HydrophobicContact CD2-CZ 4.27Å; F310-F367 HydrophobicContact CE1-CE1 4.01Å; F310-F367 AromaticContact CE1-CZ 3.89Å; F310-F367 HydrophobicContact CE1-CZ 3.89Å; F310-F367 HydrophobicContact CE2-CE1 4.43Å; F310-F367 HydrophobicContact CE2-CZ 4.2Å; F310-F367 AromaticContact CG-CE1 3.6Å; F310-F367 HydrophobicContact CG-CE1 3.6Å; F310-F367 HydrophobicContact CG-CZ 4.16Å; F310-F367 HydrophobicContact CZ-CE1 4.39Å; F310-F367 AromaticContact CZ-CZ 3.99Å; F310-F367 HydrophobicContact CZ-CZ 3.99Å; Y316-F367 HydrophobicContact CD2-CD1 4.24Å; Y316-F367 PolarHBondContact N-O 2.79Å; Y316-F367 PolarHBondContact O-N 2.99Å; F344-F367 HydrophobicContact CB-CD2 4.05Å; F344-F367 HydrophobicContact CB-CE2 3.8Å; F344-F367 WeakPolarHBondContact O-CA 3.44Å; I345-F367 HydrophobicContact CD1-CB 4.44Å; I345-F367 HydrophobicContact CD1-CD2 4.04Å; I345-F367 HydrophobicContact CG1-CB 4.16Å; I345-F367 HydrophobicContact CG1-CD2 3.61Å; I345-F367 HydrophobicContact CG1-CE2 4.49Å; I345-F367 HydrophobicContact CG1-CG 4.29Å; F367-P369 HydrophobicContact CD1-CG 4.44Å; F367-P369 HydrophobicContact CE1-CB 4Å; F367-P369 HydrophobicContact CE1-CG 3.98Å; F367-P369 HydrophobicContact CE2-CB 4.16Å; F367-P369 HydrophobicContact CZ-CB 3.64Å; F367-P369 HydrophobicContact CZ-CG 4.12Å; F367-L375 HydrophobicContact CE2-CD1 4.13Å; F367-L375 HydrophobicContact CZ-CD1 4.38Å; F367-C394 HydrophobicContact CD1-CB 4.41Å; F367-C394 HydrophobicContact CE1-CB 3.64Å; F367-C394 VanDerWaalsContact CE1-SG 3.58Å; F367-C394 HydrophobicContact CE2-CB 4.11Å; F367-C394 HydrophobicContact CZ-CB 3.45Å; F367-C394 VanDerWaalsContact CZ-CB 3.45Å; F367-C394 VanDerWaalsContact CZ-SG 3.53Å
368	H	83.7	Confident	82.8	Confident	42 Å²	42	54.6 Å²	54.6	19%	0.194	29%	0.294	C	S	.	.			trans	-125.6	77.8	-176.6	-61.8	83.6	0	0	0	108.7	R315 F344 S346 I366 L370	R315-H368 WeakPolarHBondContact CD-NE2 3.41Å; F344-H368 PolarHBondContact O-N 2.93Å; S346-H368 PolarHBondContact OG-CE1 3.2Å; I366-H368 WeakPolarHBondContact CG2-CE1 3.31Å; I366-H368 PolarHBondContact O-ND1 2.97Å; H368-L370 PolarHBondContact O-N 3.32Å
369	P	80.9	Confident	83.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.006	27%	0.269	C	S	.	.			trans	-60.9	121.7	177.1	23.9	-34.4	0	0	0	111.6	F310 E311 G313 K314 Y316 F367	F310-P369 HydrophobicContact CD2-CB 3.38Å; F310-P369 HydrophobicContact CD2-CG 3.61Å; F310-P369 HydrophobicContact CE2-CB 3.31Å; F310-P369 HydrophobicContact CE2-CG 4.1Å; F310-P369 HydrophobicContact CG-CB 4.35Å; F310-P369 HydrophobicContact CG-CG 4.36Å; F310-P369 HydrophobicContact CZ-CB 4.22Å; E311-P369 VanDerWaalsContact O-CG 3.25Å; E311-P369 WeakPolarHBondContact O-CG 3.45Å; G313-P369 PolarHBondContact N-O 2.84Å; K314-P369 WeakPolarHBondContact O-CD 3.5Å; Y316-P369 HydrophobicContact CD2-CG 4.36Å; Y316-P369 HydrophobicContact CE2-CG 4.21Å; F367-P369 HydrophobicContact CD1-CG 4.44Å; F367-P369 HydrophobicContact CE1-CB 4Å; F367-P369 HydrophobicContact CE1-CG 3.98Å; F367-P369 HydrophobicContact CE2-CB 4.16Å; F367-P369 HydrophobicContact CZ-CB 3.64Å; F367-P369 HydrophobicContact CZ-CG 4.12Å
370	L	78.3	Confident	83.4	Confident	119 Å²	119	50.2 Å²	50.2	62%	0.623	26%	0.256	S	S	*	.			trans	-110	-13.8	171.1	-56.8	173.6	0	0	0	112.3	F344 H368	F344-L370 HydrophobicContact CD1-CB 4.06Å; F344-L370 HydrophobicContact CD1-CD1 4.43Å; F344-L370 HydrophobicContact CD1-CG 4.25Å; F344-L370 HydrophobicContact CE1-CB 3.98Å; H368-L370 PolarHBondContact O-N 3.32Å
371	I	79	Confident	83.4	Confident	76 Å²	76	47.6 Å²	47.6	39%	0.39	24%	0.238	S	C	.	.	S	Bend	trans	-122.8	145.5	178.6	-58.5	-176.6	0	0	0	108.5	F344 E373	F344-I371 HydrophobicContact CE1-CD1 4.17Å; F344-I371 HydrophobicContact CE1-CG1 4.01Å; F344-I371 HydrophobicContact CZ-CD1 3.74Å; F344-I371 HydrophobicContact CZ-CG1 4.05Å; I371-E373 HydrophobicContact CG2-CB 4.05Å; I371-E373 HydrophobicContact CG2-CG 3.82Å; I371-E373 PolarHBondContact O-N 2.81Å
372	N	78.3	Confident	83.3	Confident	98 Å²	98	50.6 Å²	50.6	52%	0.524	25%	0.251	S	S	.	.	S	Bend	trans	-96.7	58.5	179.2	-167.2	65.6	0	0	0	111.9	V312	V312-N372 HydrophobicContact CG2-CB 3.84Å
373	E	79.8	Confident	83.3	Confident	124 Å²	124	46 Å²	46	58%	0.579	23%	0.23	S	C	*	.	S	Bend	trans	-131	155.7	178.1	-70.1	178.8	175.1	0	0	110.3	F310 I371 L375	F310-E373 WeakPolarHBondContact CZ-O 3.27Å; I371-E373 HydrophobicContact CG2-CB 4.05Å; I371-E373 HydrophobicContact CG2-CG 3.82Å; I371-E373 PolarHBondContact O-N 2.81Å; E373-L375 PolarHBondContact O-N 3.35Å
374	D	82	Confident	82.8	Confident	69 Å²	69	49.1 Å²	49.1	37%	0.369	25%	0.249	S	C	.	.			trans	-69.1	129.3	171.6	-75.8	-8	0	0	0	109.6	C394 T395 I396 K398	D374-C394 WeakPolarHBondContact CA-O 3.09Å; D374-T395 VanDerWaalsContact OD1-CA 3.26Å; D374-T395 WeakPolarHBondContact OD1-CA 3.47Å; D374-I396 PolarHBondContact OD1-N 2.92Å; D374-K398 WeakPolarHBondContact OD1-CE 3.42Å; D374-K398 IonicContact OD1-NZ 3.24Å; D374-K398 WeakPolarHBondContact OD2-CE 3.11Å; D374-K398 IonicContact OD2-NZ 2.86Å; D374-K398 PolarHBondContact OD2-NZ 3.35Å
375	L	83.5	Confident	82.2	Confident	17 Å²	17	51.2 Å²	51.2	9%	0.089	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114	-179.6	-55.7	170.7	0	0	0	110	L341 F344 F367 E373 C394	L341-L375 HydrophobicContact CD2-CB 3.55Å; L341-L375 HydrophobicContact CD2-CD1 4.28Å; F344-L375 HydrophobicContact CB-CD1 4.43Å; F344-L375 HydrophobicContact CD2-CD1 3.45Å; F344-L375 VanDerWaalsContact CD2-CD1 3.45Å; F344-L375 HydrophobicContact CE2-CD1 3.88Å; F344-L375 HydrophobicContact CE2-CD2 4.3Å; F344-L375 HydrophobicContact CG-CD1 3.98Å; F367-L375 HydrophobicContact CE2-CD1 4.13Å; F367-L375 HydrophobicContact CZ-CD1 4.38Å; E373-L375 PolarHBondContact O-N 3.35Å; L375-C394 HydrophobicContact CB-CB 4.26Å; L375-C394 PolarHBondContact N-O 2.89Å; L375-C394 PolarHBondContact O-N 2.94Å
376	E	83.8	Confident	81.7	Confident	107 Å²	107	52.6 Å²	52.6	50%	0.5	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	147.8	169.3	-59.6	-147.8	171.3	0	0	111.1	R393	E376-R393 HydrophobicContact CG-CG 4.02Å; E376-R393 WeakPolarHBondContact OE1-CD 3.4Å; E376-R393 IonicContact OE1-CZ 2.76Å; E376-R393 VanDerWaalsContact OE1-CZ 3.24Å; E376-R393 IonicContact OE1-NE 3.21Å; E376-R393 PolarHBondContact OE1-NE 3.07Å; E376-R393 IonicContact OE1-NH2 3.87Å; E376-R393 PolarHBondContact OE1-NH2 3.4Å; E376-R393 IonicContact OE2-CZ 3.36Å; E376-R393 IonicContact OE2-NE 3.99Å; E376-R393 PolarHBondContact OE2-NE 3.08Å; E376-R393 IonicContact OE2-NH2 3.38Å; E376-R393 PolarHBondContact OE2-NH2 2.82Å
377	G	84.6	Confident	81.5	Confident	15 Å²	15	56.3 Å²	56.3	16%	0.155	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.5	-163.7	174.7	0	0	0	0	0	111.9	V392	G377-V392 PolarHBondContact N-O 3.34Å; G377-V392 PolarHBondContact O-N 2.93Å; G377-V392 VanDerWaalsContact O-O 3.07Å
378	E	86.2	Confident	81.6	Confident	68 Å²	68	57.3 Å²	57.3	32%	0.318	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	149.3	-171.8	-61.8	-174.6	-173.6	0	0	111.3	S338 Y380 S389 V390	S338-E378 PolarHBondContact N-O 3.22Å; E378-Y380 HydrophobicContact CB-CE2 4Å; E378-S389 WeakPolarHBondContact OE2-CB 3.47Å; E378-S389 PolarHBondContact OE2-OG 3.41Å; E378-V390 WeakPolarHBondContact CA-O 3.45Å
379	I	86.6	Confident	81.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	126.5	166.4	-56.9	161.7	0	0	0	107.7	F334 I337 V347 V365 F381 S389 V390 V392	F334-I379 HydrophobicContact CD2-CG2 3.78Å; F334-I379 HydrophobicContact CE2-CG2 3.71Å; I337-I379 HydrophobicContact CG1-CG1 4.46Å; V347-I379 HydrophobicContact CG2-CD1 3.98Å; V347-I379 HydrophobicContact CG2-CG1 4.35Å; V347-I379 HydrophobicContact CG2-CG2 4.35Å; V365-I379 HydrophobicContact CG1-CD1 4.34Å; V365-I379 HydrophobicContact CG2-CD1 3.83Å; I379-F381 HydrophobicContact CB-CE2 3.86Å; I379-F381 HydrophobicContact CB-CZ 4.15Å; I379-F381 HydrophobicContact CG2-CD2 4.32Å; I379-F381 HydrophobicContact CG2-CE1 4.16Å; I379-F381 HydrophobicContact CG2-CE2 3.46Å; I379-F381 VanDerWaalsContact CG2-CE2 3.46Å; I379-F381 HydrophobicContact CG2-CZ 3.35Å; I379-S389 CarbonylContact O-C 3.56Å; I379-S389 WeakPolarHBondContact O-CA 3.49Å; I379-V390 PolarHBondContact N-O 3.03Å; I379-V390 PolarHBondContact O-N 3.34Å; I379-V392 HydrophobicContact CD1-CG2 3.58Å; I379-V392 HydrophobicContact CG1-CG2 3.63Å
380	Y	85.8	Confident	81.9	Confident	68 Å²	68	57.6 Å²	57.6	27%	0.267	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.6	-176.2	-65.2	-93.1	0	0	0	111.6	I335 R336 E378	I335-Y380 PolarHBondContact N-O 2.89Å; R336-Y380 HydrophobicContact CG-CD2 3.98Å; R336-Y380 HydrophobicContact CG-CG 4.27Å; R336-Y380 PolarHBondContact O-N 3.41Å; E378-Y380 HydrophobicContact CB-CE2 4Å
381	F	85	Confident	82.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144.9	179.2	-60.8	-84.3	0	0	0	110.9	L322 K333 F334 I363 I379 P387 F388 V390	L322-F381 HydrophobicContact CD1-CD1 4.45Å; L322-F381 HydrophobicContact CD1-CD2 4.49Å; L322-F381 HydrophobicContact CD1-CE1 4.43Å; L322-F381 HydrophobicContact CD1-CE2 4.46Å; L322-F381 HydrophobicContact CD1-CG 4.5Å; L322-F381 HydrophobicContact CD1-CZ 4.44Å; K333-F381 CarbonylContact O-C 3.55Å; K333-F381 WeakPolarHBondContact O-CA 3.38Å; F334-F381 HydrophobicContact CB-CD1 4.28Å; F334-F381 HydrophobicContact CB-CE1 4.17Å; F334-F381 HydrophobicContact CD2-CE1 4.18Å; I363-F381 HydrophobicContact CD1-CE1 3.58Å; I363-F381 HydrophobicContact CD1-CE2 4.39Å; I363-F381 HydrophobicContact CD1-CZ 3.46Å; I363-F381 VanDerWaalsContact CD1-CZ 3.46Å; I363-F381 HydrophobicContact CG1-CE1 4.46Å; I379-F381 HydrophobicContact CB-CE2 3.86Å; I379-F381 HydrophobicContact CB-CZ 4.15Å; I379-F381 HydrophobicContact CG2-CD2 4.32Å; I379-F381 HydrophobicContact CG2-CE1 4.16Å; I379-F381 HydrophobicContact CG2-CE2 3.46Å; I379-F381 VanDerWaalsContact CG2-CE2 3.46Å; I379-F381 HydrophobicContact CG2-CZ 3.35Å; F381-P387 CarbonylContact O-C 3.58Å; F381-P387 WeakPolarHBondContact O-CA 3.2Å; F381-F388 HydrophobicContact CB-CD1 4.03Å; F381-F388 HydrophobicContact CB-CD2 4.37Å; F381-F388 HydrophobicContact CB-CE1 3.48Å; F381-F388 VanDerWaalsContact CB-CE1 3.48Å; F381-F388 HydrophobicContact CB-CE2 3.87Å; F381-F388 HydrophobicContact CB-CG 4.44Å; F381-F388 HydrophobicContact CB-CZ 3.39Å; F381-F388 HydrophobicContact CD2-CD2 4.43Å; F381-F388 AromaticContact CD2-CE2 3.84Å; F381-F388 HydrophobicContact CD2-CE2 3.84Å; F381-F388 HydrophobicContact CD2-CZ 4.12Å; F381-F388 HydrophobicContact CG-CE1 4.44Å; F381-F388 HydrophobicContact CG-CE2 4.09Å; F381-F388 AromaticContact CG-CZ 3.87Å; F381-F388 HydrophobicContact CG-CZ 3.87Å; F381-F388 PolarHBondContact N-O 2.87Å; F381-F388 PolarHBondContact O-N 3.33Å; F381-V390 HydrophobicContact CD2-CG2 4.07Å; F381-V390 HydrophobicContact CE2-CB 4.22Å; F381-V390 HydrophobicContact CE2-CG2 3.73Å
382	E	81.3	Confident	82.7	Confident	75 Å²	75	50.5 Å²	50.5	35%	0.35	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	139.3	175.3	-167.5	167.2	-128.2	0	0	109.4	F331 K333 I335	F331-E382 HydrophobicContact CE2-CG 4.33Å; K333-E382 HydrophobicContact CB-CB 4.28Å; K333-E382 PolarHBondContact N-O 2.94Å; K333-E382 IonicContact NZ-OE2 3.25Å; K333-E382 PolarHBondContact NZ-OE2 3.41Å; K333-E382 PolarHBondContact O-N 3.48Å; I335-E382 HydrophobicContact CD1-CB 3.8Å; I335-E382 HydrophobicContact CG1-CB 3.7Å
383	S	82.4	Confident	83.1	Confident	7 Å²	7	51.1 Å²	51.1	5%	0.049	27%	0.268	C	S	.	.			trans	-144.9	165.9	175.9	83.6	0	0	0	0	110.6	P297 N330 F331 F385 G386	P297-S383 WeakPolarHBondContact CG-OG 3.17Å; N330-S383 WeakPolarHBondContact OD1-CB 3.49Å; F331-S383 WeakPolarHBondContact O-CA 3.4Å; S383-F385 PolarHBondContact O-N 2.86Å; S383-F385 VanDerWaalsContact O-N 3.08Å; S383-F385 PolarHBondContact OG-N 3.47Å; S383-G386 PolarHBondContact N-O 2.89Å; S383-G386 PolarHBondContact O-N 2.93Å; S383-G386 VanDerWaalsContact O-N 3.13Å; S383-G386 PolarHBondContact OG-O 3.4Å
384	T	75.4	Confident	83.3	Confident	68 Å²	68	45.3 Å²	45.3	42%	0.417	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.4	-179.5	55.1	0	0	0	0	113.9	N330 F331	N330-T384 VanDerWaalsContact CG-OG1 3.27Å; N330-T384 PolarHBondContact OD1-N 3.43Å; N330-T384 PolarHBondContact OD1-OG1 3.31Å; F331-T384 HydrophobicContact CD1-CG2 3.55Å; F331-T384 HydrophobicContact CE1-CG2 3.41Å; F331-T384 VanDerWaalsContact CE1-CG2 3.41Å; F331-T384 HydrophobicContact CG-CG2 4.29Å; F331-T384 HydrophobicContact CZ-CG2 4.05Å
385	F	72.8	Confident	83.3	Confident	97 Å²	97	43.7 Å²	43.7	43%	0.425	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	2.7	-175.7	-62.7	-71.9	0	0	0	114.7	K294 P297 T328 S383	K294-F385 PolarHBondContact NZ-O 2.86Å; K294-F385 VanDerWaalsContact NZ-O 3.12Å; P297-F385 HydrophobicContact CB-CD2 4.49Å; T328-F385 WeakPolarHBondContact OG1-CE2 3.49Å; T328-F385 WeakPolarHBondContact OG1-CZ 3.46Å; S383-F385 PolarHBondContact O-N 2.86Å; S383-F385 VanDerWaalsContact O-N 3.08Å; S383-F385 PolarHBondContact OG-N 3.47Å
386	G	75.5	Confident	83.2	Confident	29 Å²	29	43.6 Å²	43.6	30%	0.299	23%	0.233	S	C	.	.			trans	127	172.7	-178.1	0	0	0	0	0	113.1	S383	S383-G386 PolarHBondContact N-O 2.89Å; S383-G386 PolarHBondContact O-N 2.93Å; S383-G386 VanDerWaalsContact O-N 3.13Å; S383-G386 PolarHBondContact OG-O 3.4Å
387	P	81.9	Confident	83.1	Confident	102 Å²	102	41.4 Å²	41.4	66%	0.662	22%	0.222	S	C	*	.			trans	-71.5	147.4	173.4	31	-34.6	0	0	0	111.2	I335 F381	I335-P387 HydrophobicContact CD1-CB 4.26Å; F381-P387 CarbonylContact O-C 3.58Å; F381-P387 WeakPolarHBondContact O-CA 3.2Å
388	F	86.1	Confident	82.8	Confident	21 Å²	21	44.7 Å²	44.7	9%	0.092	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	164.3	168.2	69.9	-82.3	0	0	0	109.2	P297 F298 L322 F381 V390	P297-F388 HydrophobicContact CG-CD1 3.97Å; P297-F388 HydrophobicContact CG-CG 4.5Å; F298-F388 HydrophobicContact CB-CE1 4.22Å; F298-F388 HydrophobicContact CB-CE2 3.82Å; F298-F388 HydrophobicContact CB-CZ 3.63Å; F298-F388 HydrophobicContact CD2-CD1 4.34Å; F298-F388 AromaticContact CD2-CE1 3.47Å; F298-F388 HydrophobicContact CD2-CE1 3.47Å; F298-F388 VanDerWaalsContact CD2-CE1 3.47Å; F298-F388 AromaticContact CD2-CZ 3.6Å; F298-F388 HydrophobicContact CD2-CZ 3.6Å; F298-F388 HydrophobicContact CE2-CE1 4.22Å; F298-F388 HydrophobicContact CG-CE1 4.14Å; F298-F388 HydrophobicContact CG-CE2 4.47Å; F298-F388 AromaticContact CG-CZ 3.79Å; F298-F388 HydrophobicContact CG-CZ 3.79Å; L322-F388 HydrophobicContact CD1-CE2 4.09Å; L322-F388 HydrophobicContact CD1-CZ 3.95Å; F381-F388 HydrophobicContact CB-CD1 4.03Å; F381-F388 HydrophobicContact CB-CD2 4.37Å; F381-F388 HydrophobicContact CB-CE1 3.48Å; F381-F388 VanDerWaalsContact CB-CE1 3.48Å; F381-F388 HydrophobicContact CB-CE2 3.87Å; F381-F388 HydrophobicContact CB-CG 4.44Å; F381-F388 HydrophobicContact CB-CZ 3.39Å; F381-F388 HydrophobicContact CD2-CD2 4.43Å; F381-F388 AromaticContact CD2-CE2 3.84Å; F381-F388 HydrophobicContact CD2-CE2 3.84Å; F381-F388 HydrophobicContact CD2-CZ 4.12Å; F381-F388 HydrophobicContact CG-CE1 4.44Å; F381-F388 HydrophobicContact CG-CE2 4.09Å; F381-F388 AromaticContact CG-CZ 3.87Å; F381-F388 HydrophobicContact CG-CZ 3.87Å; F381-F388 PolarHBondContact N-O 2.87Å; F381-F388 PolarHBondContact O-N 3.33Å; F388-V390 HydrophobicContact CE2-CG2 4.35Å
389	S	84.8	Confident	82.5	Confident	47 Å²	47	41.8 Å²	41.8	33%	0.329	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	157.1	179.4	59.9	0	0	0	0	112.4	E378 I379	E378-S389 WeakPolarHBondContact OE2-CB 3.47Å; E378-S389 PolarHBondContact OE2-OG 3.41Å; I379-S389 CarbonylContact O-C 3.56Å; I379-S389 WeakPolarHBondContact O-CA 3.49Å
390	V	86.6	Confident	82.4	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.4	173.7	-176.5	0	0	0	0	107.9	V305 L322 E378 I379 F381 F388	V305-V390 HydrophobicContact CG2-CG1 3.62Å; L322-V390 HydrophobicContact CD2-CG2 4.12Å; E378-V390 WeakPolarHBondContact CA-O 3.45Å; I379-V390 PolarHBondContact N-O 3.03Å; I379-V390 PolarHBondContact O-N 3.34Å; F381-V390 HydrophobicContact CD2-CG2 4.07Å; F381-V390 HydrophobicContact CE2-CB 4.22Å; F381-V390 HydrophobicContact CE2-CG2 3.73Å; F388-V390 HydrophobicContact CE2-CG2 4.35Å
391	P	87.1	Confident	82.3	Confident	45 Å²	45	42.5 Å²	42.5	29%	0.292	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	139.1	-178.3	28.6	-34.7	0	0	0	111.8	V304 V305	V304-P391 HydrophobicContact CB-CG 4.45Å; V304-P391 HydrophobicContact CG1-CG 4.38Å; V304-P391 HydrophobicContact CG2-CG 4.02Å; V305-P391 PolarHBondContact N-O 2.86Å
392	V	87.8	Confident	82.4	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.3	177.9	-171.3	0	0	0	0	108.5	V305 F307 L341 I345 G377 I379	V305-V392 HydrophobicContact CB-CB 4.27Å; V305-V392 HydrophobicContact CB-CG1 4.15Å; V305-V392 HydrophobicContact CB-CG2 4.01Å; V305-V392 HydrophobicContact CG1-CG1 4.29Å; V305-V392 HydrophobicContact CG2-CG2 4.32Å; V305-V392 WeakPolarHBondContact O-CG1 3.38Å; F307-V392 HydrophobicContact CD2-CG1 4.35Å; F307-V392 HydrophobicContact CE2-CG1 4.42Å; L341-V392 HydrophobicContact CD1-CB 3.73Å; L341-V392 HydrophobicContact CD1-CG1 4.1Å; L341-V392 HydrophobicContact CD1-CG2 4.36Å; I345-V392 HydrophobicContact CD1-CG1 3.76Å; G377-V392 PolarHBondContact N-O 3.34Å; G377-V392 PolarHBondContact O-N 2.93Å; G377-V392 VanDerWaalsContact O-O 3.07Å; I379-V392 HydrophobicContact CD1-CG2 3.58Å; I379-V392 HydrophobicContact CG1-CG2 3.63Å
393	R	86.1	Confident	82.7	Confident	112 Å²	112	45 Å²	45	42%	0.423	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	120.2	175.2	-68.9	-174.4	165.4	178.2	-17.3	109.1	V304 V305 L306 F307 E376	V304-R393 HydrophobicContact CG1-CG 4.36Å; V305-R393 PolarHBondContact O-N 3.03Å; V305-R393 VanDerWaalsContact O-N 3.12Å; L306-R393 CarbonylContact C-O 3.54Å; L306-R393 WeakPolarHBondContact CA-O 3.42Å; L306-R393 HydrophobicContact CD1-CB 3.92Å; F307-R393 PolarHBondContact N-O 2.86Å; E376-R393 HydrophobicContact CG-CG 4.02Å; E376-R393 WeakPolarHBondContact OE1-CD 3.4Å; E376-R393 IonicContact OE1-CZ 2.76Å; E376-R393 VanDerWaalsContact OE1-CZ 3.24Å; E376-R393 IonicContact OE1-NE 3.21Å; E376-R393 PolarHBondContact OE1-NE 3.07Å; E376-R393 IonicContact OE1-NH2 3.87Å; E376-R393 PolarHBondContact OE1-NH2 3.4Å; E376-R393 IonicContact OE2-CZ 3.36Å; E376-R393 IonicContact OE2-NE 3.99Å; E376-R393 PolarHBondContact OE2-NE 3.08Å; E376-R393 IonicContact OE2-NH2 3.38Å; E376-R393 PolarHBondContact OE2-NH2 2.82Å
394	C	83.8	Confident	83	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.007	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117	172.5	-59.4	0	0	0	0	107.9	F307 F310 F367 D374 L375	F307-C394 HydrophobicContact CB-CB 4.36Å; F307-C394 WeakPolarHBondContact O-CA 3.07Å; F310-C394 HydrophobicContact CD1-CB 4.01Å; F310-C394 HydrophobicContact CE1-CB 3.76Å; F367-C394 HydrophobicContact CD1-CB 4.41Å; F367-C394 HydrophobicContact CE1-CB 3.64Å; F367-C394 VanDerWaalsContact CE1-SG 3.58Å; F367-C394 HydrophobicContact CE2-CB 4.11Å; F367-C394 HydrophobicContact CZ-CB 3.45Å; F367-C394 VanDerWaalsContact CZ-CB 3.45Å; F367-C394 VanDerWaalsContact CZ-SG 3.53Å; D374-C394 WeakPolarHBondContact CA-O 3.09Å; L375-C394 HydrophobicContact CB-CB 4.26Å; L375-C394 PolarHBondContact N-O 2.89Å; L375-C394 PolarHBondContact O-N 2.94Å
395	T	82.4	Confident	83.4	Confident	36 Å²	36	48.4 Å²	48.4	22%	0.221	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.4	179.7	61.1	0	0	0	0	110.6	F307 D309 F310 D374	F307-T395 PolarHBondContact O-N 3.45Å; D309-T395 PolarHBondContact N-O 3.34Å; F310-T395 VanDerWaalsContact CD1-C 3.45Å; F310-T395 WeakPolarHBondContact CD1-O 3.13Å; F310-T395 VanDerWaalsContact CE1-C 3.49Å; F310-T395 PolarHBondContact N-O 3.27Å; D374-T395 VanDerWaalsContact OD1-CA 3.26Å; D374-T395 WeakPolarHBondContact OD1-CA 3.47Å
396	I	82.5	Confident	84	Confident	15 Å²	15	48.8 Å²	48.8	8%	0.077	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	163.8	176.1	61.6	173.8	0	0	0	111.3	F310 D374 K398	F310-I396 HydrophobicContact CE1-CG2 3.83Å; F310-I396 HydrophobicContact CE2-CG2 3.94Å; F310-I396 HydrophobicContact CZ-CG2 3.44Å; F310-I396 VanDerWaalsContact CZ-CG2 3.44Å; D374-I396 PolarHBondContact OD1-N 2.92Å; I396-K398 HydrophobicContact CD1-CG 4.34Å; I396-K398 HydrophobicContact CG1-CD 4.38Å; I396-K398 HydrophobicContact CG1-CG 3.81Å; I396-K398 PolarHBondContact O-N 2.63Å
397	K	80.3	Confident	84.4	Confident	60 Å²	60	51.3 Å²	51.3	26%	0.261	28%	0.281	S	S	.	.			trans	-61	125.5	163	-66.3	-171.6	-178.4	179.8	0	109.5	D309 E311 A430 L431	D309-K397 HydrophobicContact CB-CG 3.95Å; D309-K397 WeakPolarHBondContact O-CE 3.13Å; D309-K397 WeakPolarHBondContact O-CG 3.28Å; E311-K397 VanDerWaalsContact CD-NZ 3.31Å; E311-K397 HydrophobicContact CG-CD 4.35Å; E311-K397 VanDerWaalsContact CG-CE 3.5Å; E311-K397 IonicContact OE1-NZ 3.48Å; E311-K397 PolarHBondContact OE1-NZ 3.42Å; K397-A430 HydrophobicContact CG-CB 4.44Å; K397-L431 HydrophobicContact CB-CB 4.17Å; K397-L431 HydrophobicContact CB-CD1 4.2Å
398	K	78.3	Confident	84.6	Confident	84 Å²	84	46.9 Å²	46.9	37%	0.365	25%	0.251	S	S	.	.			trans	-123.7	150.5	175.7	-62.6	-174.3	-179	-176.6	0	110.4	D374 I396 G429 A430 L431	D374-K398 WeakPolarHBondContact OD1-CE 3.42Å; D374-K398 IonicContact OD1-NZ 3.24Å; D374-K398 WeakPolarHBondContact OD2-CE 3.11Å; D374-K398 IonicContact OD2-NZ 2.86Å; D374-K398 PolarHBondContact OD2-NZ 3.35Å; I396-K398 HydrophobicContact CD1-CG 4.34Å; I396-K398 HydrophobicContact CG1-CD 4.38Å; I396-K398 HydrophobicContact CG1-CG 3.81Å; I396-K398 PolarHBondContact O-N 2.63Å; K398-G429 CarbonylContact O-C 3.58Å; K398-G429 VanDerWaalsContact O-CA 3.26Å; K398-G429 WeakPolarHBondContact O-CA 3.39Å; K398-A430 PolarHBondContact O-N 2.81Å; K398-L431 PolarHBondContact O-N 3.13Å
399	C	80.5	Confident	84.6	Confident	7 Å²	7	49.7 Å²	49.7	5%	0.047	27%	0.268	C	S	.	.			trans	-80.3	133	161	-171.9	0	0	0	0	107.2	P401 N427 L431 S433 D586 T589	C399-P401 VanDerWaalsContact C-CD 3.47Å; C399-N427 PolarHBondContact SG-OD1 3.32Å; C399-N427 VanDerWaalsContact SG-OD1 3.39Å; C399-L431 HydrophobicContact CB-CB 4.45Å; C399-S433 VanDerWaalsContact SG-CB 3.52Å; C399-D586 HydrophobicContact CB-CB 4.39Å; C399-T589 HydrophobicContact CB-CG2 3.93Å; C399-T589 VanDerWaalsContact O-CG2 3.29Å; C399-T589 WeakPolarHBondContact O-CG2 3.42Å
400	S	83.3	Confident	84.5	Confident	59 Å²	59	47.7 Å²	47.7	41%	0.413	25%	0.253	S	S	.	.			trans	-129.3	69.5	179.7	-173.9	0	0	0	0	109.5	N427 N428	S400-N427 PolarHBondContact N-OD1 3.37Å; S400-N428 PolarHBondContact O-N 3.41Å
401	P	84.6	Confident	84.4	Confident	25 Å²	25	48.5 Å²	48.5	16%	0.162	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.3	-177.9	30	-32.7	0	0	0	111.2	C399 L425 T426 F584 T589 I592	C399-P401 VanDerWaalsContact C-CD 3.47Å; P401-L425 HydrophobicContact CB-CD1 3.99Å; P401-T426 CarbonylContact C-O 3.52Å; P401-T426 WeakPolarHBondContact CA-O 3.38Å; P401-F584 HydrophobicContact CB-CD1 4.23Å; P401-F584 HydrophobicContact CB-CD2 4.5Å; P401-F584 HydrophobicContact CB-CE1 3.47Å; P401-F584 VanDerWaalsContact CB-CE1 3.47Å; P401-F584 HydrophobicContact CB-CE2 3.82Å; P401-F584 HydrophobicContact CB-CZ 3.25Å; P401-F584 HydrophobicContact CG-CD1 4.14Å; P401-F584 HydrophobicContact CG-CD2 3.85Å; P401-F584 HydrophobicContact CG-CE1 3.82Å; P401-F584 HydrophobicContact CG-CE2 3.53Å; P401-F584 HydrophobicContact CG-CG 4.17Å; P401-F584 HydrophobicContact CG-CZ 3.52Å; P401-T589 HydrophobicContact CG-CG2 4.36Å; P401-I592 HydrophobicContact CB-CD1 4.05Å; P401-I592 HydrophobicContact CG-CD1 4.24Å; P401-I592 WeakPolarHBondContact O-CD1 3.45Å
402	E	86.9	Confident	84	Confident	115 Å²	115	50.6 Å²	50.6	54%	0.537	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	150.6	176.9	-172.6	165	-162.1	0	0	109	T426 N428	E402-T426 PolarHBondContact N-O 3.43Å; E402-T426 PolarHBondContact O-N 2.84Å; E402-N428 PolarHBondContact OE2-ND2 3.47Å
403	V	88.5	Confident	83.7	Confident	11 Å²	11	52.3 Å²	52.3	7%	0.067	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.9	-178.5	-177.3	0	0	0	0	108.6	C405 I423 T424 L425 I582 I592	V403-C405 WeakPolarHBondContact CG1-O 3.28Å; V403-C405 PolarHBondContact O-N 3.05Å; V403-I423 HydrophobicContact CG1-CB 4.1Å; V403-I423 HydrophobicContact CG1-CD1 3.93Å; V403-I423 HydrophobicContact CG1-CG1 4.44Å; V403-T424 WeakPolarHBondContact CA-O 3.45Å; V403-L425 HydrophobicContact CG2-CD1 3.83Å; V403-I582 HydrophobicContact CG2-CD1 3.69Å; V403-I592 HydrophobicContact CG2-CD1 3.97Å; V403-I592 HydrophobicContact CG2-CG2 3.97Å
404	D	87.2	Confident	83.4	Confident	97 Å²	97	48.6 Å²	48.6	52%	0.519	28%	0.275	S	S	.	.	S	Bend	trans	-56.8	-32.8	179.9	59.1	-0.2	0	0	0	114.3	I423 T424	D404-I423 WeakPolarHBondContact OD1-CA 3.43Å; D404-I423 WeakPolarHBondContact OD1-CB 3.5Å; D404-T424 PolarHBondContact N-O 3.22Å; D404-T424 VanDerWaalsContact N-O 3.08Å; D404-T424 PolarHBondContact OD1-N 2.76Å; D404-T424 WeakPolarHBondContact OD2-CB 3.37Å; D404-T424 PolarHBondContact OD2-N 3Å; D404-T424 PolarHBondContact OD2-OG1 2.8Å
405	C	84.6	Confident	83.1	Confident	51 Å²	51	49.8 Å²	49.8	35%	0.345	28%	0.282	S	S	.	.			trans	-146.1	130.4	172.1	-167.3	0	0	0	0	113.3	V403 S407 I423	V403-C405 WeakPolarHBondContact CG1-O 3.28Å; V403-C405 PolarHBondContact O-N 3.05Å; C405-S407 PolarHBondContact SG-O 2.92Å; C405-I423 HydrophobicContact CB-CG2 4.36Å
406	Q	84.6	Confident	82.5	Confident	105 Å²	105	49.6 Å²	49.6	49%	0.491	29%	0.287	S	S	.	.	S	Bend	trans	-95.6	-2.4	177.1	-64	177.8	16.3	0	0	113.5	I592 I594 H595	Q406-I592 HydrophobicContact CG-CG2 4.37Å; Q406-I594 WeakPolarHBondContact O-CA 3.43Å; Q406-H595 PolarHBondContact O-N 2.88Å
407	S	84.9	Confident	82.3	Confident	82 Å²	82	51 Å²	51	57%	0.573	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138	104.5	-177.1	59.3	0	0	0	0	111.3	C405 H595	C405-S407 PolarHBondContact SG-O 2.92Å; S407-H595 CarbonylContact C-O 3.54Å; S407-H595 WeakPolarHBondContact CA-O 3.49Å
408	I	85.1	Confident	82.4	Confident	8 Å²	8	51 Å²	51	4%	0.041	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	98.1	-178.6	-50.9	169.3	0	0	0	108.8	F410 R421 I423 M566 I594 H595 V596 S597	I408-F410 HydrophobicContact CG2-CD2 4.16Å; I408-F410 HydrophobicContact CG2-CE2 3.86Å; I408-F410 HydrophobicContact CG2-CZ 4.39Å; I408-R421 HydrophobicContact CG2-CB 4.23Å; I408-I423 HydrophobicContact CD1-CD1 4.45Å; I408-I423 HydrophobicContact CD1-CG2 3.5Å; I408-I423 HydrophobicContact CG1-CG2 3.86Å; I408-M566 HydrophobicContact CD1-CB 4.3Å; I408-M566 HydrophobicContact CD1-CG 3.63Å; I408-I594 HydrophobicContact CD1-CG2 3.87Å; I408-I594 HydrophobicContact CG1-CG2 4.17Å; I408-H595 PolarHBondContact N-O 3.09Å; I408-V596 HydrophobicContact CB-CG1 4.3Å; I408-V596 HydrophobicContact CB-CG2 4.27Å; I408-V596 HydrophobicContact CD1-CG2 4.12Å; I408-V596 WeakPolarHBondContact O-CA 3.27Å; I408-S597 PolarHBondContact O-N 3.15Å
409	D	86.2	Confident	82.7	Confident	81 Å²	81	48.3 Å²	48.3	43%	0.433	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	115.7	165.3	-177.1	37	0	0	0	110.8	G411 R421 S597	D409-G411 VanDerWaalsContact C-N 3.29Å; D409-G411 PolarHBondContact OD1-N 2.83Å; D409-G411 PolarHBondContact OD2-N 3.48Å; D409-R421 PolarHBondContact O-NH1 2.82Å; D409-R421 PolarHBondContact O-NH2 3.23Å; D409-S597 WeakPolarHBondContact CA-OG 3.46Å; D409-S597 VanDerWaalsContact CB-OG 3.32Å; D409-S597 WeakPolarHBondContact CB-OG 3.26Å; D409-S597 PolarHBondContact OD1-OG 3.29Å
410	F	84.4	Confident	83	Confident	5 Å²	5	50.5 Å²	50.5	2%	0.022	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	-29.7	171.1	-79.1	-92.1	0	0	0	111.8	I408 H413 V419 R421 L546 M566 F568 V596 S597	I408-F410 HydrophobicContact CG2-CD2 4.16Å; I408-F410 HydrophobicContact CG2-CE2 3.86Å; I408-F410 HydrophobicContact CG2-CZ 4.39Å; F410-H413 PolarHBondContact O-NE2 2.86Å; F410-H413 VanDerWaalsContact O-NE2 3.15Å; F410-V419 HydrophobicContact CD1-CB 4.16Å; F410-V419 HydrophobicContact CD1-CG1 3.88Å; F410-V419 HydrophobicContact CE1-CB 4.32Å; F410-V419 HydrophobicContact CE1-CG1 4.08Å; F410-V419 WeakPolarHBondContact CE1-O 3.41Å; F410-R421 HydrophobicContact CD1-CG 4.33Å; F410-R421 HydrophobicContact CE1-CB 4.2Å; F410-R421 HydrophobicContact CE1-CG 3.88Å; F410-R421 HydrophobicContact CZ-CB 4.21Å; F410-R421 HydrophobicContact CZ-CG 4.35Å; F410-R421 PolarHBondContact O-NH2 3.1Å; F410-R421 VanDerWaalsContact O-NH2 3.07Å; F410-L546 HydrophobicContact CD2-CD2 4.34Å; F410-L546 HydrophobicContact CE2-CD2 4.06Å; F410-M566 HydrophobicContact CE2-CB 4.45Å; F410-M566 HydrophobicContact CZ-CB 4.18Å; F410-F568 HydrophobicContact CB-CD1 3.94Å; F410-F568 HydrophobicContact CB-CE1 4.46Å; F410-F568 HydrophobicContact CB-CG 4.47Å; F410-F568 HydrophobicContact CD1-CB 3.73Å; F410-F568 HydrophobicContact CD1-CD1 4.34Å; F410-F568 HydrophobicContact CD1-CG 4.44Å; F410-F568 HydrophobicContact CD2-CB 3.99Å; F410-F568 HydrophobicContact CD2-CG 4.44Å; F410-F568 HydrophobicContact CE1-CB 3.79Å; F410-F568 HydrophobicContact CE2-CB 4.04Å; F410-F568 HydrophobicContact CG-CB 3.83Å; F410-F568 HydrophobicContact CG-CD1 4.09Å; F410-F568 HydrophobicContact CG-CG 4.19Å; F410-F568 HydrophobicContact CZ-CB 3.95Å; F410-V596 HydrophobicContact CD2-CG1 3.98Å; F410-V596 HydrophobicContact CE2-CG1 3.64Å; F410-S597 WeakPolarHBondContact CD2-O 3.21Å; F410-S597 PolarHBondContact N-O 2.86Å
411	G	82.7	Confident	83.1	Confident	20 Å²	20	53.1 Å²	53.1	21%	0.206	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	84.3	-155.8	-171.6	0	0	0	0	0	112.4	D409 V599	D409-G411 VanDerWaalsContact C-N 3.29Å; D409-G411 PolarHBondContact OD1-N 2.83Å; D409-G411 PolarHBondContact OD2-N 3.48Å; G411-V599 PolarHBondContact O-N 3.39Å
412	S	79.8	Confident	83.3	Confident	89 Å²	89	55.7 Å²	55.7	62%	0.622	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	119.8	-177.9	-66.6	0	0	0	0	112.4	V599	S412-V599 WeakPolarHBondContact CA-O 3.37Å
413	H	82.3	Confident	83.4	Confident	35 Å²	35	50.5 Å²	50.5	16%	0.162	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	158.2	179	-72.5	-75.2	0	0	0	111.8	F410 E417 F568 V599 A600 V601	F410-H413 PolarHBondContact O-NE2 2.86Å; F410-H413 VanDerWaalsContact O-NE2 3.15Å; H413-E417 WeakPolarHBondContact CB-OE2 3.47Å; H413-E417 IonicContact CE1-OE1 2.62Å; H413-E417 IonicContact CG-OE1 3.27Å; H413-E417 IonicContact CG-OE2 2.66Å; H413-E417 VanDerWaalsContact ND1-CD 3.33Å; H413-E417 IonicContact ND1-OE1 3.87Å; H413-E417 PolarHBondContact ND1-OE1 2.82Å; H413-E417 IonicContact ND1-OE2 2.69Å; H413-E417 PolarHBondContact ND1-OE2 3.36Å; H413-F568 HydrophobicContact CB-CD1 4.48Å; H413-F568 HydrophobicContact CB-CE1 4.12Å; H413-V599 PolarHBondContact N-O 2.98Å; H413-A600 WeakPolarHBondContact O-CA 3.45Å; H413-V601 PolarHBondContact O-N 3.47Å
414	V	79.3	Confident	83.4	Confident	34 Å²	34	51.4 Å²	51.4	21%	0.206	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	142.1	-178.5	-176.1	0	0	0	0	110.5	G416 E417 V601	V414-G416 PolarHBondContact O-N 2.96Å; V414-E417 PolarHBondContact N-OE2 3.37Å; V414-E417 WeakPolarHBondContact O-CB 3.42Å; V414-E417 PolarHBondContact O-N 3.37Å; V414-V601 WeakPolarHBondContact CA-O 3.38Å
415	V	77.8	Confident	83.4	Confident	26 Å²	26	46.8 Å²	46.8	16%	0.158	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	128	174.3	171	0	0	0	0	111	T571 P573 A600 V601	V415-T571 WeakPolarHBondContact CG1-O 3.47Å; V415-P573 HydrophobicContact CG2-CB 4.06Å; V415-A600 HydrophobicContact CG2-CB 4.12Å; V415-V601 WeakPolarHBondContact CG2-O 3.21Å; V415-V601 PolarHBondContact N-O 3.04Å
416	G	68.2	Low	83.6	Confident	32 Å²	32	46 Å²	46	33%	0.33	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	-9.5	-176.9	0	0	0	0	0	115.1	V414 P570	V414-G416 PolarHBondContact O-N 2.96Å; G416-P570 PolarHBondContact N-O 3.33Å
417	E	79.4	Confident	83.8	Confident	46 Å²	46	41 Å²	41	22%	0.215	25%	0.251	C	S	.	.			trans	-61.9	165.7	167.6	-159.2	178.5	153.9	0	0	110.8	H413 V414 V419	H413-E417 WeakPolarHBondContact CB-OE2 3.47Å; H413-E417 IonicContact CE1-OE1 2.62Å; H413-E417 IonicContact CG-OE1 3.27Å; H413-E417 IonicContact CG-OE2 2.66Å; H413-E417 VanDerWaalsContact ND1-CD 3.33Å; H413-E417 IonicContact ND1-OE1 3.87Å; H413-E417 PolarHBondContact ND1-OE1 2.82Å; H413-E417 IonicContact ND1-OE2 2.69Å; H413-E417 PolarHBondContact ND1-OE2 3.36Å; V414-E417 PolarHBondContact N-OE2 3.37Å; V414-E417 WeakPolarHBondContact O-CB 3.42Å; V414-E417 PolarHBondContact O-N 3.37Å; E417-V419 HydrophobicContact CG-CG2 4Å; E417-V419 WeakPolarHBondContact OE1-CG2 3.31Å
418	S	81.6	Confident	83.7	Confident	58 Å²	58	40.8 Å²	40.8	41%	0.406	24%	0.243	S	C	.	.			trans	-146.9	111.6	178.9	-62.9	0	0	0	0	109.8	F568 K569	S418-F568 WeakPolarHBondContact CA-O 3.47Å; S418-K569 WeakPolarHBondContact OG-CD 3.28Å; S418-K569 WeakPolarHBondContact OG-CE 3.38Å; S418-K569 WeakPolarHBondContact OG-CG 3.48Å; S418-K569 PolarHBondContact OG-NZ 2.9Å
419	V	84.4	Confident	83.6	Confident	28 Å²	28	40.7 Å²	40.7	17%	0.17	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133	-169.9	-174.7	0	0	0	0	108	F410 E417 F568	F410-V419 HydrophobicContact CD1-CB 4.16Å; F410-V419 HydrophobicContact CD1-CG1 3.88Å; F410-V419 HydrophobicContact CE1-CB 4.32Å; F410-V419 HydrophobicContact CE1-CG1 4.08Å; F410-V419 WeakPolarHBondContact CE1-O 3.41Å; E417-V419 HydrophobicContact CG-CG2 4Å; E417-V419 WeakPolarHBondContact OE1-CG2 3.31Å; V419-F568 PolarHBondContact N-O 3.29Å; V419-F568 PolarHBondContact O-N 2.84Å
420	S	86.6	Confident	83.2	Confident	54 Å²	54	37.8 Å²	37.8	38%	0.378	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	152.8	171.5	66.2	0	0	0	0	112.4	E565 M566	S420-E565 WeakPolarHBondContact CB-OE1 3.45Å; S420-E565 PolarHBondContact OG-OE1 3.18Å; S420-M566 CarbonylContact C-O 3.53Å; S420-M566 WeakPolarHBondContact CA-O 3.48Å; S420-M566 VanDerWaalsContact CB-O 3.28Å; S420-M566 WeakPolarHBondContact CB-O 3.38Å
421	R	86.3	Confident	83.1	Confident	113 Å²	113	40.6 Å²	40.6	43%	0.426	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142.4	169.8	-69.9	-167	-174.4	174.6	15.7	108.8	I408 D409 F410 M566	I408-R421 HydrophobicContact CG2-CB 4.23Å; D409-R421 PolarHBondContact O-NH1 2.82Å; D409-R421 PolarHBondContact O-NH2 3.23Å; F410-R421 HydrophobicContact CD1-CG 4.33Å; F410-R421 HydrophobicContact CE1-CB 4.2Å; F410-R421 HydrophobicContact CE1-CG 3.88Å; F410-R421 HydrophobicContact CZ-CB 4.21Å; F410-R421 HydrophobicContact CZ-CG 4.35Å; F410-R421 PolarHBondContact O-NH2 3.1Å; F410-R421 VanDerWaalsContact O-NH2 3.07Å; R421-M566 PolarHBondContact N-O 2.81Å; R421-M566 PolarHBondContact O-N 3.29Å
422	T	87.9	Confident	83.1	Confident	79 Å²	79	41.5 Å²	41.5	49%	0.485	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.7	177.8	56.3	0	0	0	0	110.8	L564 E565	T422-L564 WeakPolarHBondContact CA-O 3.47Å; T422-E565 HydrophobicContact CG2-CB 4.26Å; T422-E565 HydrophobicContact CG2-CG 4.42Å
423	I	89	Confident	83.4	Confident	6 Å²	6	37.4 Å²	37.4	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	158.4	162.6	53.9	171.5	0	0	0	109.8	V403 D404 C405 I408 K563 L564 M566 I594	V403-I423 HydrophobicContact CG1-CB 4.1Å; V403-I423 HydrophobicContact CG1-CD1 3.93Å; V403-I423 HydrophobicContact CG1-CG1 4.44Å; D404-I423 WeakPolarHBondContact OD1-CA 3.43Å; D404-I423 WeakPolarHBondContact OD1-CB 3.5Å; C405-I423 HydrophobicContact CB-CG2 4.36Å; I408-I423 HydrophobicContact CD1-CD1 4.45Å; I408-I423 HydrophobicContact CD1-CG2 3.5Å; I408-I423 HydrophobicContact CG1-CG2 3.86Å; I423-K563 CarbonylContact O-C 3.55Å; I423-K563 WeakPolarHBondContact O-CA 3.5Å; I423-L564 HydrophobicContact CD1-CB 4.41Å; I423-L564 HydrophobicContact CD1-CD1 4.36Å; I423-L564 HydrophobicContact CG1-CB 3.94Å; I423-L564 PolarHBondContact N-O 2.85Å; I423-L564 PolarHBondContact O-N 2.83Å; I423-M566 HydrophobicContact CD1-CE 3.92Å; I423-I594 HydrophobicContact CD1-CD1 3.41Å; I423-I594 VanDerWaalsContact CD1-CD1 3.41Å; I423-I594 HydrophobicContact CD1-CG1 4.04Å; I423-I594 HydrophobicContact CD1-CG2 4.28Å
424	T	88.4	Confident	83.6	Confident	31 Å²	31	41.3 Å²	41.3	19%	0.19	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	111.5	-178.8	-42.6	0	0	0	0	109.4	V403 D404 K563	V403-T424 WeakPolarHBondContact CA-O 3.45Å; D404-T424 PolarHBondContact N-O 3.22Å; D404-T424 VanDerWaalsContact N-O 3.08Å; D404-T424 PolarHBondContact OD1-N 2.76Å; D404-T424 WeakPolarHBondContact OD2-CB 3.37Å; D404-T424 PolarHBondContact OD2-N 3Å; D404-T424 PolarHBondContact OD2-OG1 2.8Å; T424-K563 HydrophobicContact CG2-CG 4.44Å
425	L	88.2	Confident	84	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	123.5	169.7	170.4	67.5	0	0	0	108.4	P401 V403 F435 I556 S561 V562 L564 I582 F584	P401-L425 HydrophobicContact CB-CD1 3.99Å; V403-L425 HydrophobicContact CG2-CD1 3.83Å; L425-F435 HydrophobicContact CD2-CB 4.21Å; L425-F435 HydrophobicContact CD2-CD1 4.01Å; L425-F435 HydrophobicContact CD2-CD2 3.95Å; L425-F435 HydrophobicContact CD2-CE1 4.39Å; L425-F435 HydrophobicContact CD2-CE2 4.35Å; L425-F435 HydrophobicContact CD2-CG 3.77Å; L425-I556 HydrophobicContact CD2-CD1 4Å; L425-I556 HydrophobicContact CG-CD1 3.75Å; L425-S561 CarbonylContact O-C 3.52Å; L425-S561 VanDerWaalsContact O-CA 3.28Å; L425-S561 WeakPolarHBondContact O-CA 3.47Å; L425-V562 PolarHBondContact N-O 3.42Å; L425-V562 PolarHBondContact O-N 3.04Å; L425-L564 HydrophobicContact CB-CD1 4.18Å; L425-L564 HydrophobicContact CD2-CD1 4.48Å; L425-I582 HydrophobicContact CB-CD1 4.44Å; L425-I582 HydrophobicContact CD1-CD1 4.04Å; L425-I582 HydrophobicContact CD2-CD1 4.27Å; L425-I582 HydrophobicContact CD2-CG2 4.22Å; L425-I582 HydrophobicContact CG-CD1 4.47Å; L425-F584 HydrophobicContact CD1-CE1 4.17Å; L425-F584 HydrophobicContact CD1-CZ 3.8Å; L425-F584 HydrophobicContact CD2-CE1 4.13Å; L425-F584 HydrophobicContact CD2-CZ 4.35Å
426	T	88.3	Confident	84.4	Confident	34 Å²	34	41.3 Å²	41.3	21%	0.209	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.3	178.3	-58.4	0	0	0	0	110.4	P401 E402 N428 Q560 S561	P401-T426 CarbonylContact C-O 3.52Å; P401-T426 WeakPolarHBondContact CA-O 3.38Å; E402-T426 PolarHBondContact N-O 3.43Å; E402-T426 PolarHBondContact O-N 2.84Å; T426-N428 WeakPolarHBondContact CG2-OD1 3.45Å; T426-Q560 WeakPolarHBondContact CA-O 3.38Å; T426-S561 WeakPolarHBondContact CG2-OG 3.37Å; T426-S561 WeakPolarHBondContact OG1-CB 3.49Å; T426-S561 PolarHBondContact OG1-OG 2.96Å
427	N	88.2	Confident	85.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	100.2	173.1	178.8	18.3	0	0	0	110.2	C399 S400 G429 L431 I556 G557 F559 Q560	C399-N427 PolarHBondContact SG-OD1 3.32Å; C399-N427 VanDerWaalsContact SG-OD1 3.39Å; S400-N427 PolarHBondContact N-OD1 3.37Å; N427-G429 PolarHBondContact O-N 3.11Å; N427-G429 PolarHBondContact OD1-N 3.39Å; N427-G429 VanDerWaalsContact OD1-N 3.1Å; N427-L431 PolarHBondContact ND2-O 2.97Å; N427-I556 HydrophobicContact CB-CD1 3.92Å; N427-I556 HydrophobicContact CB-CG1 3.84Å; N427-I556 HydrophobicContact CB-CG2 4.39Å; N427-G557 WeakPolarHBondContact CB-O 3.02Å; N427-G557 PolarHBondContact ND2-O 3.01Å; N427-F559 WeakPolarHBondContact O-CA 3.34Å; N427-F559 PolarHBondContact O-N 3.18Å; N427-Q560 PolarHBondContact N-O 3.22Å
428	N	84.3	Confident	85.2	Confident	77 Å²	77	39.3 Å²	39.3	41%	0.412	23%	0.23	S	C	.	.			trans	-77	4.3	178.2	-69.7	-25.6	0	0	0	113.4	S400 E402 T426 F559	S400-N428 PolarHBondContact O-N 3.41Å; E402-N428 PolarHBondContact OE2-ND2 3.47Å; T426-N428 WeakPolarHBondContact CG2-OD1 3.45Å; N428-F559 WeakPolarHBondContact O-CE1 3.31Å
429	G	81.8	Confident	84.8	Confident	7 Å²	7	39.9 Å²	39.9	7%	0.072	23%	0.232	C	C	.	.	S	Bend	trans	-107.9	159.7	-177.9	0	0	0	0	0	114	K398 N427 L431 P558	K398-G429 CarbonylContact O-C 3.58Å; K398-G429 VanDerWaalsContact O-CA 3.26Å; K398-G429 WeakPolarHBondContact O-CA 3.39Å; N427-G429 PolarHBondContact O-N 3.11Å; N427-G429 PolarHBondContact OD1-N 3.39Å; N427-G429 VanDerWaalsContact OD1-N 3.1Å; G429-L431 VanDerWaalsContact C-N 3.32Å; G429-L431 PolarHBondContact O-N 3.08Å; G429-P558 VanDerWaalsContact O-CA 3.29Å; G429-P558 WeakPolarHBondContact O-CA 3.47Å; G429-P558 WeakPolarHBondContact O-CB 3.09Å
430	A	78.6	Confident	83.7	Confident	20 Å²	20	41.4 Å²	41.4	17%	0.165	24%	0.243	C	C	.	.	S	Bend	trans	-85.2	4.4	-178.1	0	0	0	0	0	114.9	D309 K397 K398 F559	D309-A430 HydrophobicContact CB-CB 3.83Å; D309-A430 VanDerWaalsContact CG-CB 3.41Å; D309-A430 VanDerWaalsContact OD1-CB 3.23Å; D309-A430 WeakPolarHBondContact OD1-CB 3.5Å; K397-A430 HydrophobicContact CG-CB 4.44Å; K398-A430 PolarHBondContact O-N 2.81Å; A430-F559 HydrophobicContact CB-CE2 4.22Å; A430-F559 HydrophobicContact CB-CZ 4.2Å
431	L	82.3	Confident	81.9	Confident	63 Å²	63	45.3 Å²	45.3	33%	0.33	26%	0.257	S	S	.	.	S	Bend	trans	-104.6	130.6	172.5	-165.3	68.1	0	0	0	110.2	K397 K398 C399 N427 G429	K397-L431 HydrophobicContact CB-CB 4.17Å; K397-L431 HydrophobicContact CB-CD1 4.2Å; K398-L431 PolarHBondContact O-N 3.13Å; C399-L431 HydrophobicContact CB-CB 4.45Å; N427-L431 PolarHBondContact ND2-O 2.97Å; G429-L431 VanDerWaalsContact C-N 3.32Å; G429-L431 PolarHBondContact O-N 3.08Å
432	A	83.2	Confident	79.5	Confident	40 Å²	40	47.4 Å²	47.4	33%	0.331	27%	0.272	S	S	.	.			trans	-70.7	150.8	169.4	0	0	0	0	0	111.1	I556	A432-I556 WeakPolarHBondContact CA-O 3.35Å
433	S	85.4	Confident	77.2	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.014	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	155	174.1	-166.2	0	0	0	0	111.2	C399 I556 S585 D586	C399-S433 VanDerWaalsContact SG-CB 3.52Å; S433-I556 PolarHBondContact N-O 3.09Å; S433-I556 WeakPolarHBondContact O-CG2 3.19Å; S433-I556 PolarHBondContact O-N 3.44Å; S433-S585 PolarHBondContact OG-N 3.04Å; S433-S585 PolarHBondContact OG-OG 3.42Å; S433-S585 VanDerWaalsContact OG-OG 3.09Å; S433-D586 PolarHBondContact OG-N 3.4Å
434	F	86	Confident	74.6	Confident	117 Å²	117	55 Å²	55	51%	0.513	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	127.1	166.7	-73.3	-89.8	0	0	0	109.4	G554 E555 F584 S585	F434-G554 CarbonylContact C-O 3.52Å; F434-G554 WeakPolarHBondContact CA-O 3.35Å; F434-E555 HydrophobicContact CD1-CB 4.02Å; F434-E555 HydrophobicContact CD1-CG 4.4Å; F434-E555 HydrophobicContact CE1-CB 3.62Å; F434-E555 HydrophobicContact CE1-CG 3.98Å; F434-E555 HydrophobicContact CE2-CG 4.16Å; F434-E555 HydrophobicContact CZ-CB 3.98Å; F434-E555 HydrophobicContact CZ-CG 3.83Å; F434-E555 WeakPolarHBondContact CZ-OE2 3.26Å; F434-F584 CarbonylContact O-C 3.54Å; F434-F584 VanDerWaalsContact O-CA 3.31Å; F434-F584 WeakPolarHBondContact O-CA 3.47Å; F434-S585 PolarHBondContact N-OG 3.39Å; F434-S585 VanDerWaalsContact N-OG 3.07Å; F434-S585 PolarHBondContact O-N 3.44Å
435	F	88.3	Confident	72	Confident	8 Å²	8	58.3 Å²	58.3	4%	0.035	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	154.7	174.2	77.5	-87.7	0	0	0	111.4	L425 V437 V551 G553 G554 I556 V562 L564 I582 R583 F584	L425-F435 HydrophobicContact CD2-CB 4.21Å; L425-F435 HydrophobicContact CD2-CD1 4.01Å; L425-F435 HydrophobicContact CD2-CD2 3.95Å; L425-F435 HydrophobicContact CD2-CE1 4.39Å; L425-F435 HydrophobicContact CD2-CE2 4.35Å; L425-F435 HydrophobicContact CD2-CG 3.77Å; F435-V437 HydrophobicContact CD2-CG2 4Å; F435-V437 HydrophobicContact CE2-CG2 4.09Å; F435-V551 HydrophobicContact CE2-CG1 4.28Å; F435-V551 HydrophobicContact CZ-CG1 3.9Å; F435-G553 CarbonylContact O-C 3.58Å; F435-G553 WeakPolarHBondContact O-CA 3.43Å; F435-G554 WeakPolarHBondContact CD1-O 3.16Å; F435-G554 PolarHBondContact N-O 3.09Å; F435-G554 PolarHBondContact O-N 2.64Å; F435-I556 HydrophobicContact CD1-CB 4.06Å; F435-I556 HydrophobicContact CD1-CG2 4.08Å; F435-I556 HydrophobicContact CE1-CB 4.44Å; F435-V562 HydrophobicContact CE1-CB 4.48Å; F435-V562 HydrophobicContact CE1-CG1 4.26Å; F435-V562 HydrophobicContact CE1-CG2 4.3Å; F435-V562 HydrophobicContact CZ-CG1 3.94Å; F435-L564 HydrophobicContact CE2-CD2 3.6Å; F435-L564 HydrophobicContact CZ-CD2 3.91Å; F435-I582 HydrophobicContact CB-CG2 4.01Å; F435-I582 HydrophobicContact CD2-CG2 4.19Å; F435-I582 HydrophobicContact CG-CG2 4.5Å; F435-R583 CarbonylContact C-O 3.55Å; F435-R583 VanDerWaalsContact CA-O 3.27Å; F435-R583 WeakPolarHBondContact CA-O 3.34Å; F435-F584 HydrophobicContact CB-CD1 3.71Å; F435-F584 HydrophobicContact CB-CE1 3.62Å
436	S	85.8	Confident	69.2	Low	53 Å²	53	62.8 Å²	62.8	37%	0.371	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	141.8	174.8	59	0	0	0	0	109.8	I582 R583	S436-I582 WeakPolarHBondContact O-CA 3.48Å; S436-R583 PolarHBondContact N-O 2.93Å; S436-R583 PolarHBondContact O-N 3.24Å
437	V	85.1	Confident	66.6	Low	16 Å²	16	72.9 Å²	72.9	10%	0.097	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.3	-173.7	-159.5	0	0	0	0	110.3	F435 L548 R552 L564 F580 Y581 I582	F435-V437 HydrophobicContact CD2-CG2 4Å; F435-V437 HydrophobicContact CE2-CG2 4.09Å; V437-L548 HydrophobicContact CB-CD1 3.93Å; V437-L548 HydrophobicContact CB-CD2 4.04Å; V437-L548 HydrophobicContact CG1-CD1 3.89Å; V437-L548 HydrophobicContact CG1-CD2 3.66Å; V437-L548 HydrophobicContact CG1-CG 4.42Å; V437-R552 PolarHBondContact N-O 3.34Å; V437-L564 HydrophobicContact CG2-CD1 4.14Å; V437-F580 HydrophobicContact CG1-CB 4.28Å; V437-Y581 WeakPolarHBondContact CA-O 3.45Å; V437-I582 HydrophobicContact CG1-CG1 4.23Å; V437-I582 HydrophobicContact CG2-CG1 4.29Å; V437-I582 HydrophobicContact CG2-CG2 4.43Å
438	G	79.7	Confident	63.8	Low	20 Å²	20	78.6 Å²	78.6	21%	0.206	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	169.1	-179.2	0	0	0	0	0	114.7	S440 Y581	G438-S440 PolarHBondContact O-N 3.37Å; G438-Y581 PolarHBondContact N-O 3.13Å; G438-Y581 VanDerWaalsContact N-O 3.13Å; G438-Y581 PolarHBondContact O-N 3.2Å
439	T	73.8	Confident	61.1	Low	70 Å²	70	86.5 Å²	86.5	43%	0.429	48%	0.482	S	S	.	.	S	Bend	trans	-91.9	15.1	-170.5	51.7	0	0	0	0	114.7	M578 F580	T439-M578 HydrophobicContact CG2-CG 4.08Å; T439-M578 HydrophobicContact CG2-SD 3.87Å; T439-F580 HydrophobicContact CG2-CD1 3.62Å; T439-F580 HydrophobicContact CG2-CE1 3.52Å; T439-F580 HydrophobicContact CG2-CZ 4.36Å
440	S	60.7	Low	58.5	Low	60 Å²	60	91.2 Å²	91.2	42%	0.42	51%	0.514	S	S	.	.			trans	-123.7	140.2	179.4	171.9	0	0	0	0	110.9	G438 H442 R583	G438-S440 PolarHBondContact O-N 3.37Å; S440-H442 PolarHBondContact OG-N 2.95Å; S440-H442 PolarHBondContact OG-O 3.34Å; S440-R583 PolarHBondContact O-NE 3.05Å; S440-R583 PolarHBondContact O-NH2 3.16Å
441	M	48.3	Very low	56.1	Low	135 Å²	135	99.3 Å²	99.3	67%	0.665	55%	0.549	S	S	*	.	S	Bend	trans	-74.9	-24.8	175.7	-60.7	-177.8	80.6	0	0	113.1	Y581	M441-Y581 HydrophobicContact CE-CE1 4.22Å; M441-Y581 HydrophobicContact CG-CD2 4.35Å; M441-Y581 HydrophobicContact CG-CE1 3.99Å; M441-Y581 HydrophobicContact CG-CE2 3.79Å
442	H	35.8	Very low	53.5	Low	158 Å²	158	103.7 Å²	103.7	73%	0.731	57%	0.571	S	S	*	*	S	Bend	trans	-103.7	145.3	-176.2	-87.2	-91.1	0	0	0	113.8	S440 R583	S440-H442 PolarHBondContact OG-N 2.95Å; S440-H442 PolarHBondContact OG-O 3.34Å; H442-R583 PolarHBondContact O-NH2 2.84Å
443	L	40.8	Very low	50.7	Low	137 Å²	137	111.9 Å²	111.9	72%	0.717	60%	0.6	S	S	*	*			trans	-80.5	111.9	164.9	-85.2	143.3	0	0	0	110	A445	L443-A445 PolarHBondContact O-N 3.05Å
444	S	33.9	Very low	47.8	Very low	108 Å²	108	115.1 Å²	115.1	76%	0.755	63%	0.633	S	S	*	*			trans	-75.1	113.9	157.6	52.7	0	0	0	0	108.5	A446	S444-A446 VanDerWaalsContact C-N 3.31Å; S444-A446 PolarHBondContact O-N 2.78Å
445	A	34.3	Very low	45	Very low	99 Å²	99	114.9 Å²	114.9	82%	0.818	65%	0.646	S	S	*	*			trans	-74.8	73.7	-172.4	0	0	0	0	0	113.6	L443 R447	L443-A445 PolarHBondContact O-N 3.05Å; A445-R447 PolarHBondContact O-N 2.96Å
446	A	29.3	Very low	42	Very low	94 Å²	94	123 Å²	123	78%	0.777	68%	0.684	S	S	*	*			trans	-77.6	101	166.9	0	0	0	0	0	109.5	S444	S444-A446 VanDerWaalsContact C-N 3.31Å; S444-A446 PolarHBondContact O-N 2.78Å
447	R	33.1	Very low	39.1	Very low	246 Å²	246	126.9 Å²	126.9	93%	0.928	71%	0.705	S	S	*	*			trans	-67.5	138.1	176.5	-84.4	-177.6	169.7	166.4	-3	111.4	A445	A445-R447 PolarHBondContact O-N 2.96Å
448	S	29.2	Very low	36.2	Very low	120 Å²	120	130.1 Å²	130.1	84%	0.839	73%	0.734	S	S	*	*			trans	-58.6	141.9	173.8	-42.4	0	0	0	0	112.3
449	R	27.4	Very low	33.6	Very low	243 Å²	243	138.4 Å²	138.4	92%	0.917	76%	0.764	S	S	*	*			trans	-133.1	93.8	153.2	-162.6	174.9	-166	170.5	4.8	109
450	S	27.7	Very low	31.1	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	78%	0.784	S	S	*	*			trans	-74.9	138.9	174	42.4	0	0	0	0	110.5
451	Q	27	Very low	29.2	Very low	190 Å²	190	144.7 Å²	144.7	89%	0.888	81%	0.805	S	S	*	*			trans	-140.3	138.6	156.4	-117.8	174.9	-21.4	0	0	108.5
452	I	28.7	Very low	28	Very low	155 Å²	155	143.2 Å²	143.2	80%	0.795	81%	0.808	S	S	*	*			trans	-106.6	140.1	-172.8	-62.3	161.8	0	0	0	107.6
453	F	23.6	Very low	27.9	Very low	213 Å²	213	140.9 Å²	140.9	93%	0.934	81%	0.807	S	S	*	*			trans	-146.1	146.7	148.5	-114.1	-78.8	0	0	0	110.8
454	G	24.8	Very low	27.1	Very low	69 Å²	69	144 Å²	144	71%	0.711	82%	0.815	S	S	*	*			trans	-93.9	176.9	-172.1	0	0	0	0	0	114.9
455	S	28	Very low	26.5	Very low	113 Å²	113	144.8 Å²	144.8	79%	0.79	81%	0.808	S	S	*	*			trans	-79.8	146.5	178	55.1	0	0	0	0	113.7
456	Q	26	Very low	25.8	Very low	179 Å²	179	150.6 Å²	150.6	84%	0.836	81%	0.811	S	S	*	*				-162.5	134.2	119.3	-78.2	-135.3	9.8	0	0	112.9
457	V	24.3	Very low	25.6	Very low	133 Å²	133	155.1 Å²	155.1	81%	0.806	81%	0.809	S	S	*	*			trans	10	141	137.8	-176	0	0	0	0	119.1
458	A	24.8	Very low	25.2	Very low	85 Å²	85	150.6 Å²	150.6	70%	0.702	80%	0.802	S	S	*	*			cis	-176.1	177.4	-18.4	0	0	0	0	0	111.8
459	K	23.7	Very low	24.9	Very low	194 Å²	194	156.5 Å²	156.5	84%	0.843	81%	0.805	S	S	*	*			trans	102	113.6	159.1	-62.1	-172.9	176.6	-179.2	0	119.5
460	T	21.3	Very low	24.7	Very low	137 Å²	137	153.2 Å²	153.2	84%	0.84	80%	0.801	S	S	*	*			trans	46.4	132.9	141.2	57	0	0	0	0	120.2
461	S	21.2	Very low	24.4	Very low	125 Å²	125	153.8 Å²	153.8	87%	0.874	81%	0.805	S	S	*	*			cis	-145.3	-158.6	28.1	58.9	0	0	0	0	113.1
462	S	24.1	Very low	24.2	Very low	104 Å²	104	150.1 Å²	150.1	73%	0.727	80%	0.8	S	S	*	*			trans	-127.8	-177	-158.1	68.8	0	0	0	0	113
463	P	33.5	Very low	23.8	Very low	108 Å²	108	153.8 Å²	153.8	70%	0.701	81%	0.805	S	S	*	*			cis	-127.8	177.5	-19.7	37.8	-22.8	0	0	0	112.6
464	F	23	Very low	23.7	Very low	203 Å²	203	149.3 Å²	149.3	89%	0.89	80%	0.801	S	S	*	*			trans	-161.3	153.8	132.9	-130.4	-90.5	0	0	0	114.2
465	M	21.5	Very low	23.5	Very low	125 Å²	125	154.4 Å²	154.4	62%	0.616	81%	0.811	S	S	*	*			trans	-80.1	153.1	-172.4	-68.5	179.6	62.9	0	0	115.2	Y467	M465-Y467 HydrophobicContact CB-CD2 4.44Å; M465-Y467 HydrophobicContact CE-CD2 4.01Å; M465-Y467 HydrophobicContact CE-CE1 4.44Å; M465-Y467 HydrophobicContact CE-CE2 3.37Å; M465-Y467 HydrophobicContact SD-CD2 4.49Å; M465-Y467 HydrophobicContact SD-CE2 3.79Å
466	Y	20.7	Very low	23.1	Very low	221 Å²	221	153.8 Å²	153.8	87%	0.867	81%	0.807	S	S	*	*			trans	-73.9	138.4	150.4	-117.7	-101.7	0	0	0	110
467	Y	24.8	Very low	22.9	Very low	188 Å²	188	151.9 Å²	151.9	74%	0.737	80%	0.801	S	S	*	*			trans	-127.2	131.1	162.1	-103.1	-70.6	0	0	0	110.8	M465 R469	M465-Y467 HydrophobicContact CB-CD2 4.44Å; M465-Y467 HydrophobicContact CE-CD2 4.01Å; M465-Y467 HydrophobicContact CE-CE1 4.44Å; M465-Y467 HydrophobicContact CE-CE2 3.37Å; M465-Y467 HydrophobicContact SD-CD2 4.49Å; M465-Y467 HydrophobicContact SD-CE2 3.79Å; Y467-R469 PolarHBondContact O-N 3.34Å
468	I	23.6	Very low	22.8	Very low	152 Å²	152	153 Å²	153	78%	0.779	80%	0.798	S	S	*	*			trans	-79.2	118.6	176.1	-65.8	173.7	0	0	0	108.2	Q470	I468-Q470 PolarHBondContact O-N 3.27Å
469	R	22.8	Very low	22.6	Very low	243 Å²	243	155.3 Å²	155.3	92%	0.917	79%	0.794	S	S	*	*			trans	-83.9	94.2	177.9	-161.9	178.1	-165.4	-171.9	5.4	110.6	Y467	Y467-R469 PolarHBondContact O-N 3.34Å
470	Q	23.2	Very low	22.6	Very low	174 Å²	174	151.3 Å²	151.3	81%	0.813	79%	0.786	S	S	*	*			trans	-61.1	155.9	159.9	-72.3	178.8	-24.9	0	0	109.9	I468	I468-Q470 PolarHBondContact O-N 3.27Å
471	S	21.5	Very low	22.6	Very low	118 Å²	118	152 Å²	152	83%	0.825	78%	0.779	S	S	*	*			trans	-127.2	116.3	172.2	50.6	0	0	0	0	110.4
472	S	22.5	Very low	22.7	Very low	114 Å²	114	151.2 Å²	151.2	80%	0.797	78%	0.78	S	S	*	*			trans	-136.1	149.5	164.5	50.1	0	0	0	0	107
473	Y	21.6	Very low	22.7	Very low	231 Å²	231	154.7 Å²	154.7	91%	0.906	78%	0.782	S	S	*	*			trans	-101.2	129	-177.4	-73.6	-98.8	0	0	0	110.3
474	S	21.1	Very low	22.2	Very low	119 Å²	119	161.6 Å²	161.6	83%	0.832	79%	0.794	S	S	*	*			trans	-144.2	148.1	157.7	55.1	0	0	0	0	108.9
475	L	20.9	Very low	22.2	Very low	176 Å²	176	160.1 Å²	160.1	92%	0.921	79%	0.79	S	S	*	*			trans	-137.7	125.7	-178.5	-91.4	171.6	0	0	0	110.9
476	S	19.6	Very low	22.2	Very low	101 Å²	101	158.9 Å²	158.9	71%	0.706	79%	0.793	S	S	*	*			trans	-151.3	133.7	161.5	53.9	0	0	0	0	105.3
477	L	21.5	Very low	22.2	Very low	139 Å²	139	157.7 Å²	157.7	73%	0.728	79%	0.793	S	S	*	*				52.6	122.3	69.1	-49.3	170.8	0	0	0	110.1
478	E	21.2	Very low	22.1	Very low	156 Å²	156	153.1 Å²	153.1	73%	0.729	79%	0.788	S	S	*	*			cis	-157.7	175.1	4.1	-139	78.9	-86.5	0	0	107.5
479	E	22.2	Very low	22	Very low	134 Å²	134	151.2 Å²	151.2	63%	0.626	78%	0.784	S	S	*	*			cis	-160.6	-169.9	-6.3	-148.6	-78.8	96.7	0	0	107
480	V	22.3	Very low	22.1	Very low	110 Å²	110	147.8 Å²	147.8	67%	0.667	78%	0.779	S	S	*	*			trans	94.8	92.9	155.3	-169.8	0	0	0	0	118.2
481	H	22.4	Very low	22	Very low	152 Å²	152	144.9 Å²	144.9	70%	0.704	78%	0.777	S	S	*	*			trans	26.5	135.4	130.1	-65	-60.3	0	0	0	123.5
482	A	22.3	Very low	22.1	Very low	107 Å²	107	142.4 Å²	142.4	88%	0.884	77%	0.77	S	S	*	*				-140.3	139.7	128.6	0	0	0	0	0	111.2
483	K	24.9	Very low	22.3	Very low	178 Å²	178	146.5 Å²	146.5	77%	0.774	77%	0.774	S	S	*	*			trans	-98	154.2	178.3	-75.4	176.8	176.1	173.3	0	112
484	R	22.8	Very low	22.4	Very low	252 Å²	252	142 Å²	142	95%	0.951	77%	0.765	S	S	*	*			trans	-150.5	138.7	138.2	-106.6	169.3	-170.4	-174.3	1.7	110.7
485	Q	23.3	Very low	22.5	Very low	173 Å²	173	142.2 Å²	142.2	81%	0.808	76%	0.761	S	S	*	*			trans	-105.4	170.1	170.7	-65.2	174	-74.4	0	0	107.7
486	S	21.8	Very low	22.7	Very low	98 Å²	98	137.9 Å²	137.9	69%	0.685	75%	0.751	S	S	*	*				179.7	147.6	73.4	51.8	0	0	0	0	114.2
487	F	19.7	Very low	22.9	Very low	197 Å²	197	141.7 Å²	141.7	86%	0.864	76%	0.758	S	S	*	*			trans	66.2	124.3	152.7	-79.4	-126.4	0	0	0	117.3
488	S	23.2	Very low	23	Very low	91 Å²	91	141.5 Å²	141.5	64%	0.636	76%	0.757	S	S	*	*				86.8	153.5	64.4	88	0	0	0	0	112.9
489	T	21.8	Very low	23.2	Very low	112 Å²	112	139.6 Å²	139.6	69%	0.687	75%	0.751	S	S	*	*			cis	-156.6	171	17.5	-26.5	0	0	0	0	111.6
490	E	23.4	Very low	23.3	Very low	172 Å²	172	141.7 Å²	141.7	80%	0.804	76%	0.761	S	S	*	*			trans	65.6	146.2	161.1	-69.9	164.4	-165.6	0	0	118.7
491	S	21.7	Very low	23.4	Very low	113 Å²	113	140.9 Å²	140.9	79%	0.79	76%	0.76	S	S	*	*			cis	110.9	135.9	12.7	92.9	0	0	0	0	113.6
492	G	24.2	Very low	23.5	Very low	65 Å²	65	142.8 Å²	142.8	67%	0.67	77%	0.767	S	S	*	*			cis	173.1	-169.4	-4.2	0	0	0	0	0	112.4
493	K	25.9	Very low	23.4	Very low	201 Å²	201	143.2 Å²	143.2	87%	0.874	76%	0.759	S	S	*	*			trans	72	151.8	174.9	-55.2	176.6	-176.1	173.7	0	114.8
494	N	23.8	Very low	23.3	Very low	137 Å²	137	144.2 Å²	144.2	73%	0.733	76%	0.759	S	S	*	*			cis	-163.6	173.1	-4.3	-116	26.8	0	0	0	107.1
495	T	23	Very low	23.2	Very low	122 Å²	122	140.2 Å²	140.2	75%	0.748	75%	0.748	S	S	*	*			cis	-156.7	-178.3	4.3	-13.5	0	0	0	0	109.5
496	A	25.1	Very low	23.2	Very low	85 Å²	85	136.8 Å²	136.8	70%	0.702	74%	0.744	S	S	*	*			trans	66.7	114.6	171	0	0	0	0	0	116.1
497	E	24.1	Very low	23.4	Very low	182 Å²	182	139.6 Å²	139.6	85%	0.85	75%	0.75	S	S	*	*				74	135.1	57.5	-62.7	-176	178	0	0	113.4
498	L	24	Very low	23.6	Very low	134 Å²	134	136.7 Å²	136.7	70%	0.702	75%	0.749	S	S	*	*			cis	-144.4	142.6	20.3	-174.6	62.3	0	0	0	113.6
499	N	24.4	Very low	23.7	Very low	116 Å²	116	137 Å²	137	62%	0.62	75%	0.748	S	S	*	*			trans	53.6	120	164.6	-65	-16.7	0	0	0	119.8
500	Q	25.8	Very low	23.7	Very low	179 Å²	179	140 Å²	140	84%	0.836	76%	0.759	S	S	*	*				64	134.7	51.6	-55.8	-173.8	39.4	0	0	112.9
501	S	24.1	Very low	24	Very low	92 Å²	92	142.2 Å²	142.2	64%	0.643	76%	0.761	S	S	*	*			cis	-155.2	175.5	4.9	63.2	0	0	0	0	109.3
502	K	24.1	Very low	24.1	Very low	193 Å²	193	145.1 Å²	145.1	84%	0.839	76%	0.761	S	S	*	*			cis	-154.7	130	13.2	-135.6	146.8	-166.6	169.3	0	108.7
503	T	21.3	Very low	24.1	Very low	116 Å²	116	153.9 Å²	153.9	71%	0.712	77%	0.774	S	S	*	*			trans	-77.4	151	169.4	-29.3	0	0	0	0	110
504	Y	21.2	Very low	24	Very low	198 Å²	198	156.6 Å²	156.6	78%	0.776	78%	0.779	S	S	*	*				-179.2	129.4	114.6	-90.8	-51.6	0	0	0	114.9
505	K	22.1	Very low	24	Very low	169 Å²	169	154.7 Å²	154.7	74%	0.735	78%	0.782	S	S	*	*			trans	52.5	94	137.4	-73.4	167.5	-178	177.6	0	119.6
506	S	22.7	Very low	24	Very low	101 Å²	101	157 Å²	157	71%	0.706	79%	0.789	S	S	*	*				-12	147.2	110.3	71.4	0	0	0	0	116.3
507	L	26.5	Very low	23.9	Very low	156 Å²	156	159.4 Å²	159.4	82%	0.817	80%	0.795	S	S	*	*			cis	-142	157.4	19	-80.6	109.9	0	0	0	112.5
508	T	22.8	Very low	23.9	Very low	137 Å²	137	159.1 Å²	159.1	84%	0.84	80%	0.798	S	S	*	*			trans	-158.3	160.3	143.2	6.7	0	0	0	0	108.4
509	P	25.4	Very low	23.8	Very low	97 Å²	97	156.8 Å²	156.8	63%	0.63	80%	0.799	S	S	*	*			trans	-90.3	151.8	-146.6	33.8	-38.3	0	0	0	116.7
510	L	23.2	Very low	23.8	Very low	175 Å²	175	160.4 Å²	160.4	92%	0.916	81%	0.812	S	S	*	*			trans	-118.2	98.6	170.6	-87.9	165.9	0	0	0	110.8
511	W	28.2	Very low	23.7	Very low	219 Å²	219	156.6 Å²	156.6	83%	0.83	81%	0.811	S	S	*	*			trans	-125.7	46	170.5	47.5	-93.3	0	0	0	113.6
512	Q	24.4	Very low	23.7	Very low	173 Å²	173	160.1 Å²	160.1	81%	0.808	82%	0.819	S	S	*	*			trans	-144.5	86.9	164.3	-97.5	-174.9	6.1	0	0	112.2
513	R	24.3	Very low	23.8	Very low	250 Å²	250	158.7 Å²	158.7	94%	0.943	82%	0.815	S	S	*	*			trans	-164.8	72.2	158.6	-119.5	178.2	-169.8	-156.8	2.8	114.7
514	R	24.6	Very low	23.9	Very low	258 Å²	258	162.1 Å²	162.1	97%	0.974	82%	0.823	S	S	*	*			trans	-171	96.4	142.2	-111.5	169.1	169.9	154.6	-2.6	112.3
515	A	22	Very low	24	Very low	96 Å²	96	162.5 Å²	162.5	79%	0.793	83%	0.829	S	S	*	*			trans	-139	162.1	160.5	0	0	0	0	0	107.5
516	L	24	Very low	24.3	Very low	170 Å²	170	160.1 Å²	160.1	89%	0.89	83%	0.831	S	S	*	*			trans	67	89.1	-177.3	-56.1	168.8	0	0	0	115.6
517	T	22.3	Very low	24.3	Very low	137 Å²	137	159.6 Å²	159.6	84%	0.84	83%	0.832	S	S	*	*				-165.9	110.6	109.7	35.1	0	0	0	0	109.5
518	L	24.1	Very low	24.2	Very low	175 Å²	175	161.1 Å²	161.1	92%	0.916	84%	0.835	S	S	*	*			trans	170.5	102.5	134.5	-95.2	163.6	0	0	0	111.2
519	A	21.4	Very low	24.3	Very low	85 Å²	85	163.1 Å²	163.1	70%	0.702	84%	0.84	S	S	*	*			trans	-148.2	145	153.3	0	0	0	0	0	106.5
520	H	25	Very low	24.4	Very low	193 Å²	193	165.8 Å²	165.8	89%	0.894	85%	0.848	S	S	*	*			trans	95.9	77.2	-166.9	-56.4	103.9	0	0	0	115.8
521	A	23.6	Very low	24.6	Very low	99 Å²	99	162.6 Å²	162.6	82%	0.818	84%	0.838	S	S	*	*			trans	-166.3	110.5	141.4	0	0	0	0	0	108.7
522	M	23.7	Very low	24.6	Very low	165 Å²	165	161 Å²	161	81%	0.813	84%	0.839	S	S	*	*			trans	-121.4	148.2	163	-77.4	-177.2	65.1	0	0	107.9
523	H	26.2	Very low	24.9	Very low	164 Å²	164	162.7 Å²	162.7	76%	0.759	84%	0.844	S	S	*	*			trans	60.1	91.5	176	-56.6	-75.1	0	0	0	116.8
524	Q	24.7	Very low	25	Very low	188 Å²	188	156.5 Å²	156.5	88%	0.879	83%	0.833	S	S	*	*				-176.8	132.9	104.1	-98.5	172.5	-17.9	0	0	110.3
525	F	23.6	Very low	25.2	Very low	206 Å²	206	151.8 Å²	151.8	90%	0.904	83%	0.827	S	S	*	*			trans	-147.5	147.7	159.1	-103.6	-82.3	0	0	0	109
526	P	27.2	Very low	25.5	Very low	119 Å²	119	156.3 Å²	156.3	77%	0.773	83%	0.829	S	S	*	*			trans	-80.3	176.5	-172.9	-12.5	31	0	0	0	113.8
527	A	23.3	Very low	25.5	Very low	89 Å²	89	156.2 Å²	156.2	74%	0.736	82%	0.824	S	S	*	*			trans	-76.7	171.4	166.6	0	0	0	0	0	112.3
528	E	24.8	Very low	25.8	Very low	189 Å²	189	159.3 Å²	159.3	88%	0.883	82%	0.82	S	S	*	*			trans	64.9	104.7	167.3	-55.3	-165.2	132.5	0	0	118.5
529	L	25.3	Very low	26.2	Very low	178 Å²	178	153.8 Å²	153.8	93%	0.932	80%	0.796	S	S	*	*				-164.1	159.6	121.8	-102.7	166	0	0	0	110.6
530	L	25.7	Very low	26.9	Very low	153 Å²	153	158.5 Å²	158.5	80%	0.801	80%	0.797	S	S	*	*			trans	-82.3	154	-155.9	-71.9	165.7	0	0	0	116.5	H532	L530-H532 PolarHBondContact O-N 3.42Å
531	P	28.8	Very low	27.6	Very low	109 Å²	109	154.4 Å²	154.4	71%	0.708	78%	0.78	S	S	*	*			trans	-90.9	101.8	-171.4	34.8	-35.4	0	0	0	115
532	H	28.4	Very low	28.6	Very low	184 Å²	184	151.9 Å²	151.9	85%	0.852	76%	0.755	S	S	*	*			trans	-123.6	72.3	169.3	-78.9	-29.4	0	0	0	113.2	L530	L530-H532 PolarHBondContact O-N 3.42Å
533	K	29.8	Very low	29.8	Very low	210 Å²	210	148.4 Å²	148.4	91%	0.913	74%	0.739	S	S	*	*			trans	-153.9	13	170.5	-118.1	161.3	-169.9	173.3	0	118.3
534	V	27.5	Very low	31.1	Very low	119 Å²	119	145.3 Å²	145.3	72%	0.721	73%	0.728	S	S	*	*			trans	-91.6	-21	-175	-177.2	0	0	0	0	114	K536	V534-K536 PolarHBondContact O-N 3.36Å
535	L	27.9	Very low	33	Very low	160 Å²	160	136.8 Å²	136.8	84%	0.838	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-72	-23.8	-162.5	-121.5	118.1	0	0	0	116.3	Q537	L535-Q537 PolarHBondContact O-N 2.89Å
536	K	27.2	Very low	35.4	Very low	191 Å²	191	127.3 Å²	127.3	83%	0.83	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-80	-6.5	-171.4	-75.5	-166	174	-173.2	0	115.9	V534	V534-K536 PolarHBondContact O-N 3.36Å
537	Q	25.4	Very low	37.8	Very low	168 Å²	168	125.5 Å²	125.5	79%	0.785	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-106.3	-12.9	-176.1	-155.3	163.4	1.3	0	0	114	L535	L535-Q537 PolarHBondContact O-N 2.89Å
538	R	29	Very low	40.2	Very low	202 Å²	202	122 Å²	122	76%	0.762	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-29.7	174.2	-88.4	-177.4	166	178.5	-6.1	113.6	Y540 I541	R538-Y540 VanDerWaalsContact C-N 3.33Å; R538-Y540 PolarHBondContact O-N 2.91Å; R538-I541 PolarHBondContact O-N 2.79Å
539	S	30.9	Very low	42.1	Very low	59 Å²	59	113.8 Å²	113.8	41%	0.413	56%	0.561	S	S	.	*	H	α-helix	trans	-68.6	-20.6	-167.3	52	0	0	0	0	116	L543	S539-L543 WeakPolarHBondContact O-CD1 3.33Å
540	Y	36.2	Very low	44.1	Very low	184 Å²	184	114.2 Å²	114.2	72%	0.722	56%	0.561	S	S	*	*	H	α-helix	trans	-88.4	-16.3	-178.4	-71.8	-82.7	0	0	0	113.9	R538	R538-Y540 VanDerWaalsContact C-N 3.33Å; R538-Y540 PolarHBondContact O-N 2.91Å
541	I	40.7	Very low	46.5	Very low	107 Å²	107	109.5 Å²	109.5	55%	0.549	54%	0.539	S	S	.	.	H	α-helix	trans	-90.4	-42.6	-175.5	-58.7	175.8	0	0	0	110.8	R538 L543 N544	R538-I541 PolarHBondContact O-N 2.79Å; I541-L543 VanDerWaalsContact C-N 3.32Å; I541-L543 PolarHBondContact O-N 2.8Å; I541-N544 PolarHBondContact O-N 2.81Å
542	T	43.6	Very low	48.5	Very low	46 Å²	46	111.6 Å²	111.6	28%	0.282	53%	0.532	S	S	.	.	H	α-helix	trans	-65.7	-29.8	-176	47.2	0	0	0	0	113.9	N544 I545 M578	T542-N544 PolarHBondContact O-N 2.96Å; T542-I545 PolarHBondContact O-N 2.89Å; T542-M578 WeakPolarHBondContact O-CE 3.46Å
543	L	49.8	Very low	50.9	Low	92 Å²	92	104.6 Å²	104.6	48%	0.482	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-13.2	179.2	-73.5	171.4	0	0	0	115	S539 I541	S539-L543 WeakPolarHBondContact O-CD1 3.33Å; I541-L543 VanDerWaalsContact C-N 3.32Å; I541-L543 PolarHBondContact O-N 2.8Å
544	N	53.1	Low	53.5	Low	98 Å²	98	96 Å²	96	52%	0.524	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-13.7	179.1	-92.5	-53.1	0	0	0	115.4	I541 T542 K547	I541-N544 PolarHBondContact O-N 2.81Å; T542-N544 PolarHBondContact O-N 2.96Å; N544-K547 VanDerWaalsContact O-CE 3.26Å; N544-K547 WeakPolarHBondContact O-CE 3.33Å; N544-K547 PolarHBondContact O-NZ 2.9Å; N544-K547 WeakPolarHBondContact OD1-CE 3.31Å; N544-K547 PolarHBondContact OD1-NZ 3.17Å
545	I	64.8	Low	56.2	Low	10 Å²	10	95.6 Å²	95.6	5%	0.051	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-42	-171	-67.4	167.1	0	0	0	112.3	T542 F568 K569 P570 T576	T542-I545 PolarHBondContact O-N 2.89Å; I545-F568 HydrophobicContact CG2-CD2 3.83Å; I545-F568 HydrophobicContact CG2-CE2 3.52Å; I545-K569 PolarHBondContact O-N 2.79Å; I545-P570 HydrophobicContact CG2-CB 4.48Å; I545-T576 HydrophobicContact CB-CG2 4.23Å; I545-T576 HydrophobicContact CG2-CG2 3.83Å
546	L	73.8	Confident	59	Low	6 Å²	6	88 Å²	88	3%	0.031	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.6	173.3	-78.6	169.4	0	0	0	109.5	F410 L567 F568 T576 M578 F580 V596	F410-L546 HydrophobicContact CD2-CD2 4.34Å; F410-L546 HydrophobicContact CE2-CD2 4.06Å; L546-L567 WeakPolarHBondContact CA-O 3.39Å; L546-F568 HydrophobicContact CD2-CB 3.81Å; L546-F568 HydrophobicContact CD2-CD2 3.59Å; L546-F568 HydrophobicContact CD2-CG 4.07Å; L546-F568 HydrophobicContact CG-CD2 3.96Å; L546-T576 HydrophobicContact CD1-CG2 3.96Å; L546-T576 HydrophobicContact CG-CG2 4.32Å; L546-M578 HydrophobicContact CB-CB 4.19Å; L546-M578 HydrophobicContact CD1-CB 3.59Å; L546-F580 HydrophobicContact CB-CE2 4.48Å; L546-F580 HydrophobicContact CB-CZ 4.37Å; L546-V596 HydrophobicContact CD1-CB 4.23Å; L546-V596 HydrophobicContact CD1-CG1 3.88Å; L546-V596 HydrophobicContact CD2-CG1 3.71Å; L546-V596 HydrophobicContact CG-CG1 4.43Å
547	K	77.6	Confident	61.7	Low	82 Å²	82	79.4 Å²	79.4	36%	0.357	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139.5	-175.6	-71	180	176.3	166.3	0	111.7	N544 L567	N544-K547 VanDerWaalsContact O-CE 3.26Å; N544-K547 WeakPolarHBondContact O-CE 3.33Å; N544-K547 PolarHBondContact O-NZ 2.9Å; N544-K547 WeakPolarHBondContact OD1-CE 3.31Å; N544-K547 PolarHBondContact OD1-NZ 3.17Å; K547-L567 PolarHBondContact N-O 3.27Å; K547-L567 PolarHBondContact O-N 3Å
548	L	72.9	Confident	64.5	Low	16 Å²	16	74.5 Å²	74.5	8%	0.084	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	136.8	161	-73.2	154.8	0	0	0	109.6	V437 R552 M566 F580	V437-L548 HydrophobicContact CB-CD1 3.93Å; V437-L548 HydrophobicContact CB-CD2 4.04Å; V437-L548 HydrophobicContact CG1-CD1 3.89Å; V437-L548 HydrophobicContact CG1-CD2 3.66Å; V437-L548 HydrophobicContact CG1-CG 4.42Å; L548-R552 HydrophobicContact CB-CG 4.2Å; L548-R552 PolarHBondContact O-NH2 2.95Å; L548-R552 VanDerWaalsContact O-NH2 3.13Å; L548-M566 HydrophobicContact CD2-CE 3.69Å; L548-M566 HydrophobicContact CD2-SD 3.54Å; L548-M566 VanDerWaalsContact CD2-SD 3.54Å; L548-M566 HydrophobicContact CG-SD 4.24Å; L548-F580 HydrophobicContact CD1-CD1 3.72Å; L548-F580 HydrophobicContact CD1-CE1 3.87Å; L548-F580 HydrophobicContact CD2-CD1 4.42Å; L548-F580 HydrophobicContact CG-CD1 3.9Å; L548-F580 HydrophobicContact CG-CE1 3.8Å
549	G	65.9	Low	67	Low	15 Å²	15	71.6 Å²	71.6	16%	0.155	37%	0.373	C	S	.	.			trans	-67.2	-152.6	173.2	0	0	0	0	0	113.4	V551 R552 E565	G549-V551 PolarHBondContact O-N 3.14Å; G549-R552 PolarHBondContact O-NE 3.05Å; G549-E565 PolarHBondContact N-O 2.92Å
550	M	67.8	Low	69.8	Low	187 Å²	187	73.2 Å²	73.2	92%	0.921	37%	0.374	S	S	*	.	S	Bend	trans	-64.9	-37.9	-175.8	-66.1	-65	-178.4	0	0	112.8	R552	M550-R552 PolarHBondContact O-N 3.5Å
551	V	74.6	Confident	72.2	Confident	55 Å²	55	67.6 Å²	67.6	33%	0.333	36%	0.361	S	S	.	.			trans	-84.5	103.3	-178.1	-173.3	0	0	0	0	110.2	F435 G549 V562 L564	F435-V551 HydrophobicContact CE2-CG1 4.28Å; F435-V551 HydrophobicContact CZ-CG1 3.9Å; G549-V551 PolarHBondContact O-N 3.14Å; V551-V562 HydrophobicContact CG1-CG1 4.23Å; V551-L564 HydrophobicContact CB-CD2 4.21Å; V551-L564 HydrophobicContact CG1-CD2 3.62Å
552	R	72.6	Confident	74.5	Confident	152 Å²	152	63.8 Å²	63.8	57%	0.574	34%	0.343	S	S	*	.	S	Bend	trans	-110.9	-5.8	178.3	-62.5	-177.3	177.8	-169.7	-5.5	114.1	V437 L548 G549 M550	V437-R552 PolarHBondContact N-O 3.34Å; L548-R552 HydrophobicContact CB-CG 4.2Å; L548-R552 PolarHBondContact O-NH2 2.95Å; L548-R552 VanDerWaalsContact O-NH2 3.13Å; G549-R552 PolarHBondContact O-NE 3.05Å; M550-R552 PolarHBondContact O-N 3.5Å
553	G	78.4	Confident	76.6	Confident	38 Å²	38	68.2 Å²	68.2	39%	0.392	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170.5	164.8	-180	0	0	0	0	0	109.9	F435	F435-G553 CarbonylContact O-C 3.58Å; F435-G553 WeakPolarHBondContact O-CA 3.43Å
554	G	83.8	Confident	78.3	Confident	29 Å²	29	63.9 Å²	63.9	30%	0.299	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170.1	-179.1	-176.4	0	0	0	0	0	111.1	F434 F435	F434-G554 CarbonylContact C-O 3.52Å; F434-G554 WeakPolarHBondContact CA-O 3.35Å; F435-G554 WeakPolarHBondContact CD1-O 3.16Å; F435-G554 PolarHBondContact N-O 3.09Å; F435-G554 PolarHBondContact O-N 2.64Å
555	E	85.1	Confident	79.9	Confident	111 Å²	111	62.8 Å²	62.8	52%	0.519	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	140.8	168	-159.6	172.1	161.9	0	0	109.7	F434	F434-E555 HydrophobicContact CD1-CB 4.02Å; F434-E555 HydrophobicContact CD1-CG 4.4Å; F434-E555 HydrophobicContact CE1-CB 3.62Å; F434-E555 HydrophobicContact CE1-CG 3.98Å; F434-E555 HydrophobicContact CE2-CG 4.16Å; F434-E555 HydrophobicContact CZ-CB 3.98Å; F434-E555 HydrophobicContact CZ-CG 3.83Å; F434-E555 WeakPolarHBondContact CZ-OE2 3.26Å
556	I	85.7	Confident	80.9	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	109.6	164.9	-169.5	168.4	0	0	0	108.5	L425 N427 A432 S433 F435 Q560 V562	L425-I556 HydrophobicContact CD2-CD1 4Å; L425-I556 HydrophobicContact CG-CD1 3.75Å; N427-I556 HydrophobicContact CB-CD1 3.92Å; N427-I556 HydrophobicContact CB-CG1 3.84Å; N427-I556 HydrophobicContact CB-CG2 4.39Å; A432-I556 WeakPolarHBondContact CA-O 3.35Å; S433-I556 PolarHBondContact N-O 3.09Å; S433-I556 WeakPolarHBondContact O-CG2 3.19Å; S433-I556 PolarHBondContact O-N 3.44Å; F435-I556 HydrophobicContact CD1-CB 4.06Å; F435-I556 HydrophobicContact CD1-CG2 4.08Å; F435-I556 HydrophobicContact CE1-CB 4.44Å; I556-Q560 WeakPolarHBondContact CD1-O 3.47Å; I556-Q560 HydrophobicContact CG1-CB 4.22Å; I556-V562 HydrophobicContact CB-CG2 4.46Å; I556-V562 HydrophobicContact CD1-CG2 4.14Å; I556-V562 HydrophobicContact CG1-CG2 4.14Å
557	G	84	Confident	81.5	Confident	10 Å²	10	64.7 Å²	64.7	10%	0.103	34%	0.338	C	S	.	.			trans	-68.3	174.2	179	0	0	0	0	0	113	N427 Q560	N427-G557 WeakPolarHBondContact CB-O 3.02Å; N427-G557 PolarHBondContact ND2-O 3.01Å; G557-Q560 WeakPolarHBondContact O-CB 3.46Å; G557-Q560 PolarHBondContact O-N 3.07Å
558	P	83.8	Confident	81.8	Confident	65 Å²	65	60.8 Å²	60.8	42%	0.422	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	134.7	175.1	29.7	-35.4	0	0	0	110.8	G429 Q560	G429-P558 VanDerWaalsContact O-CA 3.29Å; G429-P558 WeakPolarHBondContact O-CA 3.47Å; G429-P558 WeakPolarHBondContact O-CB 3.09Å; P558-Q560 PolarHBondContact O-N 3.44Å; P558-Q560 VanDerWaalsContact O-N 3.14Å
559	F	82.6	Confident	82.3	Confident	142 Å²	142	65 Å²	65	62%	0.623	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	20.8	-178.5	-47.2	-69	0	0	0	114.9	N427 N428 A430	N427-F559 WeakPolarHBondContact O-CA 3.34Å; N427-F559 PolarHBondContact O-N 3.18Å; N428-F559 WeakPolarHBondContact O-CE1 3.31Å; A430-F559 HydrophobicContact CB-CE2 4.22Å; A430-F559 HydrophobicContact CB-CZ 4.2Å
560	Q	88.2	Confident	83	Confident	93 Å²	93	64.4 Å²	64.4	44%	0.435	33%	0.331	S	S	.	.			trans	-96	148.7	178.4	-168.3	177.5	12.7	0	0	111.5	T426 N427 I556 G557 P558	T426-Q560 WeakPolarHBondContact CA-O 3.38Å; N427-Q560 PolarHBondContact N-O 3.22Å; I556-Q560 WeakPolarHBondContact CD1-O 3.47Å; I556-Q560 HydrophobicContact CG1-CB 4.22Å; G557-Q560 WeakPolarHBondContact O-CB 3.46Å; G557-Q560 PolarHBondContact O-N 3.07Å; P558-Q560 PolarHBondContact O-N 3.44Å; P558-Q560 VanDerWaalsContact O-N 3.14Å
561	S	87.3	Confident	83.3	Confident	65 Å²	65	60.2 Å²	60.2	46%	0.455	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145	169.9	-56.1	0	0	0	0	112.4	L425 T426	L425-S561 CarbonylContact O-C 3.52Å; L425-S561 VanDerWaalsContact O-CA 3.28Å; L425-S561 WeakPolarHBondContact O-CA 3.47Å; T426-S561 WeakPolarHBondContact CG2-OG 3.37Å; T426-S561 WeakPolarHBondContact OG1-CB 3.49Å; T426-S561 PolarHBondContact OG1-OG 2.96Å
562	V	88.9	Confident	83.2	Confident	27 Å²	27	61.4 Å²	61.4	16%	0.164	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	132.4	177.5	-178.1	0	0	0	0	109.3	L425 F435 V551 I556 L564	L425-V562 PolarHBondContact N-O 3.42Å; L425-V562 PolarHBondContact O-N 3.04Å; F435-V562 HydrophobicContact CE1-CB 4.48Å; F435-V562 HydrophobicContact CE1-CG1 4.26Å; F435-V562 HydrophobicContact CE1-CG2 4.3Å; F435-V562 HydrophobicContact CZ-CG1 3.94Å; V551-V562 HydrophobicContact CG1-CG1 4.23Å; I556-V562 HydrophobicContact CB-CG2 4.46Å; I556-V562 HydrophobicContact CD1-CG2 4.14Å; I556-V562 HydrophobicContact CG1-CG2 4.14Å; V562-L564 HydrophobicContact CG1-CD2 4.19Å
563	K	87.9	Confident	83.5	Confident	140 Å²	140	57.8 Å²	57.8	61%	0.609	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.2	175.9	-66.1	-175	178.1	-175.4	0	110.6	I423 T424	I423-K563 CarbonylContact O-C 3.55Å; I423-K563 WeakPolarHBondContact O-CA 3.5Å; T424-K563 HydrophobicContact CG2-CG 4.44Å
564	L	85.9	Confident	83.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.7	177.4	-50.2	174.8	0	0	0	108.7	T422 I423 L425 F435 V437 V551 V562 I582	T422-L564 WeakPolarHBondContact CA-O 3.47Å; I423-L564 HydrophobicContact CD1-CB 4.41Å; I423-L564 HydrophobicContact CD1-CD1 4.36Å; I423-L564 HydrophobicContact CG1-CB 3.94Å; I423-L564 PolarHBondContact N-O 2.85Å; I423-L564 PolarHBondContact O-N 2.83Å; L425-L564 HydrophobicContact CB-CD1 4.18Å; L425-L564 HydrophobicContact CD2-CD1 4.48Å; F435-L564 HydrophobicContact CE2-CD2 3.6Å; F435-L564 HydrophobicContact CZ-CD2 3.91Å; V437-L564 HydrophobicContact CG2-CD1 4.14Å; V551-L564 HydrophobicContact CB-CD2 4.21Å; V551-L564 HydrophobicContact CG1-CD2 3.62Å; V562-L564 HydrophobicContact CG1-CD2 4.19Å; L564-I582 HydrophobicContact CD1-CD1 3.65Å; L564-I582 HydrophobicContact CD1-CG1 4.32Å
565	E	86.7	Confident	83.4	Confident	76 Å²	76	63 Å²	63	36%	0.355	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	128.4	178.6	-173.3	-177.8	-147.7	0	0	111.1	S420 T422 G549	S420-E565 WeakPolarHBondContact CB-OE1 3.45Å; S420-E565 PolarHBondContact OG-OE1 3.18Å; T422-E565 HydrophobicContact CG2-CB 4.26Å; T422-E565 HydrophobicContact CG2-CG 4.42Å; G549-E565 PolarHBondContact N-O 2.92Å
566	M	86.2	Confident	83.1	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.7	169.3	-59.6	-65.1	-178.1	0	0	108.8	I408 F410 S420 R421 I423 L548 F580 I594	I408-M566 HydrophobicContact CD1-CB 4.3Å; I408-M566 HydrophobicContact CD1-CG 3.63Å; F410-M566 HydrophobicContact CE2-CB 4.45Å; F410-M566 HydrophobicContact CZ-CB 4.18Å; S420-M566 CarbonylContact C-O 3.53Å; S420-M566 WeakPolarHBondContact CA-O 3.48Å; S420-M566 VanDerWaalsContact CB-O 3.28Å; S420-M566 WeakPolarHBondContact CB-O 3.38Å; R421-M566 PolarHBondContact N-O 2.81Å; R421-M566 PolarHBondContact O-N 3.29Å; I423-M566 HydrophobicContact CD1-CE 3.92Å; L548-M566 HydrophobicContact CD2-CE 3.69Å; L548-M566 HydrophobicContact CD2-SD 3.54Å; L548-M566 VanDerWaalsContact CD2-SD 3.54Å; L548-M566 HydrophobicContact CG-SD 4.24Å; M566-F580 HydrophobicContact CE-CB 4.43Å; M566-F580 HydrophobicContact CE-CD2 4.3Å; M566-F580 HydrophobicContact CE-CG 4.39Å; M566-F580 HydrophobicContact SD-CD2 4.11Å; M566-F580 HydrophobicContact SD-CE2 4.18Å; M566-I594 HydrophobicContact CE-CD1 3.79Å; M566-I594 HydrophobicContact CE-CG2 4.43Å
567	L	85.6	Confident	83.1	Confident	55 Å²	55	62.9 Å²	62.9	29%	0.288	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	122.8	-178.2	179.4	71.1	0	0	0	110.4	L546 K547	L546-L567 WeakPolarHBondContact CA-O 3.39Å; K547-L567 PolarHBondContact N-O 3.27Å; K547-L567 PolarHBondContact O-N 3Å
568	F	84.8	Confident	83	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.6	170.2	-176.1	-134.3	0	0	0	109.7	F410 H413 S418 V419 I545 L546 P570	F410-F568 HydrophobicContact CB-CD1 3.94Å; F410-F568 HydrophobicContact CB-CE1 4.46Å; F410-F568 HydrophobicContact CB-CG 4.47Å; F410-F568 HydrophobicContact CD1-CB 3.73Å; F410-F568 HydrophobicContact CD1-CD1 4.34Å; F410-F568 HydrophobicContact CD1-CG 4.44Å; F410-F568 HydrophobicContact CD2-CB 3.99Å; F410-F568 HydrophobicContact CD2-CG 4.44Å; F410-F568 HydrophobicContact CE1-CB 3.79Å; F410-F568 HydrophobicContact CE2-CB 4.04Å; F410-F568 HydrophobicContact CG-CB 3.83Å; F410-F568 HydrophobicContact CG-CD1 4.09Å; F410-F568 HydrophobicContact CG-CG 4.19Å; F410-F568 HydrophobicContact CZ-CB 3.95Å; H413-F568 HydrophobicContact CB-CD1 4.48Å; H413-F568 HydrophobicContact CB-CE1 4.12Å; S418-F568 WeakPolarHBondContact CA-O 3.47Å; V419-F568 PolarHBondContact N-O 3.29Å; V419-F568 PolarHBondContact O-N 2.84Å; I545-F568 HydrophobicContact CG2-CD2 3.83Å; I545-F568 HydrophobicContact CG2-CE2 3.52Å; L546-F568 HydrophobicContact CD2-CB 3.81Å; L546-F568 HydrophobicContact CD2-CD2 3.59Å; L546-F568 HydrophobicContact CD2-CG 4.07Å; L546-F568 HydrophobicContact CG-CD2 3.96Å; F568-P570 HydrophobicContact CD1-CG 4.4Å; F568-P570 HydrophobicContact CE1-CB 4.42Å; F568-P570 HydrophobicContact CE1-CG 3.94Å; F568-P570 HydrophobicContact CE2-CB 4.13Å; F568-P570 HydrophobicContact CE2-CG 4.39Å; F568-P570 HydrophobicContact CZ-CB 3.9Å; F568-P570 HydrophobicContact CZ-CG 3.94Å
569	K	82.4	Confident	83.1	Confident	105 Å²	105	63.1 Å²	63.1	46%	0.457	33%	0.333	S	S	.	.			trans	-136.6	78.9	177.5	-171.2	165.8	-171.6	115.8	0	109.9	S418 I545 T571	S418-K569 WeakPolarHBondContact OG-CD 3.28Å; S418-K569 WeakPolarHBondContact OG-CE 3.38Å; S418-K569 WeakPolarHBondContact OG-CG 3.48Å; S418-K569 PolarHBondContact OG-NZ 2.9Å; I545-K569 PolarHBondContact O-N 2.79Å; K569-T571 PolarHBondContact O-N 2.88Å
570	P	80.2	Confident	83.3	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	31%	0.305	C	S	.	.			trans	-67.4	128.5	-176.9	26.4	-34	0	0	0	112.5	G416 I545 F568 A600	G416-P570 PolarHBondContact N-O 3.33Å; I545-P570 HydrophobicContact CG2-CB 4.48Å; F568-P570 HydrophobicContact CD1-CG 4.4Å; F568-P570 HydrophobicContact CE1-CB 4.42Å; F568-P570 HydrophobicContact CE1-CG 3.94Å; F568-P570 HydrophobicContact CE2-CB 4.13Å; F568-P570 HydrophobicContact CE2-CG 4.39Å; F568-P570 HydrophobicContact CZ-CB 3.9Å; F568-P570 HydrophobicContact CZ-CG 3.94Å; P570-A600 HydrophobicContact CB-CB 3.41Å; P570-A600 VanDerWaalsContact CB-CB 3.41Å; P570-A600 HydrophobicContact CG-CB 4.21Å
571	T	74.4	Confident	83.2	Confident	99 Å²	99	54 Å²	54	61%	0.607	29%	0.291	S	S	*	.	S	Bend	trans	-107	-13.9	177.8	-48.8	0	0	0	0	112.7	V415 K569	V415-T571 WeakPolarHBondContact CG1-O 3.47Å; K569-T571 PolarHBondContact O-N 2.88Å
572	V	73.8	Confident	83.2	Confident	81 Å²	81	50.9 Å²	50.9	49%	0.491	27%	0.269	S	S	.	.	S	Bend	trans	-140.1	139.4	-176.8	-177.6	0	0	0	0	107.3	A600	V572-A600 VanDerWaalsContact O-CB 3.25Å; V572-A600 WeakPolarHBondContact O-CB 3.46Å
573	P	77.1	Confident	83	Confident	76 Å²	76	51.6 Å²	51.6	49%	0.494	27%	0.269	S	S	.	.	S	Bend	trans	-69.7	146.9	177.2	29.5	-35	0	0	0	111.7	V415 A600	V415-P573 HydrophobicContact CG2-CB 4.06Å; P573-A600 CarbonylContact C-O 3.59Å; P573-A600 VanDerWaalsContact CA-O 3.27Å; P573-A600 WeakPolarHBondContact CA-O 3.38Å
574	G	77.6	Confident	82.9	Confident	36 Å²	36	46.2 Å²	46.2	37%	0.371	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	135.7	165.1	-175.7	0	0	0	0	0	113.1	A600	G574-A600 PolarHBondContact N-O 3.26Å; G574-A600 WeakPolarHBondContact O-CB 3.2Å; G574-A600 PolarHBondContact O-N 3.06Å
575	E	82.3	Confident	82.6	Confident	141 Å²	141	50 Å²	50	66%	0.659	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	134.4	171.8	-177.3	178.2	-147.5	0	0	110.7	I577 V599	E575-I577 HydrophobicContact CG-CD1 4.4Å; E575-I577 HydrophobicContact CG-CG1 4.18Å; E575-V599 HydrophobicContact CG-CG2 4.46Å
576	T	80.8	Confident	82.3	Confident	9 Å²	9	47.4 Å²	47.4	6%	0.055	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.1	172.9	-57	0	0	0	0	109.6	I545 L546 S597 G598	I545-T576 HydrophobicContact CB-CG2 4.23Å; I545-T576 HydrophobicContact CG2-CG2 3.83Å; L546-T576 HydrophobicContact CD1-CG2 3.96Å; L546-T576 HydrophobicContact CG-CG2 4.32Å; T576-S597 CarbonylContact O-C 3.38Å; T576-S597 WeakPolarHBondContact O-CA 3.32Å; T576-G598 PolarHBondContact N-O 3.28Å; T576-G598 PolarHBondContact O-N 3Å
577	I	84	Confident	81.4	Confident	99 Å²	99	52.4 Å²	52.4	51%	0.508	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.9	173.7	-56.3	171.5	0	0	0	108	E575 V596	E575-I577 HydrophobicContact CG-CD1 4.4Å; E575-I577 HydrophobicContact CG-CG1 4.18Å; I577-V596 CarbonylContact C-O 3.6Å; I577-V596 WeakPolarHBondContact CA-O 3.34Å
578	M	83.3	Confident	80.7	Confident	23 Å²	23	55.5 Å²	55.5	11%	0.113	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	132.5	176.5	-173.3	73.5	73	0	0	110.1	T439 T542 L546 F580 V596	T439-M578 HydrophobicContact CG2-CG 4.08Å; T439-M578 HydrophobicContact CG2-SD 3.87Å; T542-M578 WeakPolarHBondContact O-CE 3.46Å; L546-M578 HydrophobicContact CB-CB 4.19Å; L546-M578 HydrophobicContact CD1-CB 3.59Å; M578-F580 HydrophobicContact CB-CE2 4.15Å; M578-F580 HydrophobicContact CG-CD2 4.32Å; M578-F580 HydrophobicContact CG-CE1 4.34Å; M578-F580 HydrophobicContact CG-CE2 3.77Å; M578-F580 HydrophobicContact CG-CZ 3.78Å; M578-V596 PolarHBondContact N-O 3.28Å; M578-V596 WeakPolarHBondContact O-CB 3.31Å; M578-V596 PolarHBondContact O-N 2.96Å
579	D	84.8	Confident	80.3	Confident	56 Å²	56	56.6 Å²	56.6	30%	0.299	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	127.2	173.4	-59.6	-28.5	0	0	0	110.3	Y581 H595	D579-Y581 HydrophobicContact CB-CE2 3.97Å; D579-H595 IonicContact OD1-CE1 2.76Å; D579-H595 IonicContact OD1-CG 2.65Å; D579-H595 IonicContact OD1-ND1 3.78Å; D579-H595 PolarHBondContact OD1-ND1 3.13Å; D579-H595 IonicContact OD2-ND1 2.69Å
580	F	86.6	Confident	80.2	Confident	7 Å²	7	60.2 Å²	60.2	3%	0.031	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	145.5	169.4	-63.3	-84.7	0	0	0	109.7	V437 T439 L546 L548 M566 M578 P593 I594 V596	V437-F580 HydrophobicContact CG1-CB 4.28Å; T439-F580 HydrophobicContact CG2-CD1 3.62Å; T439-F580 HydrophobicContact CG2-CE1 3.52Å; T439-F580 HydrophobicContact CG2-CZ 4.36Å; L546-F580 HydrophobicContact CB-CE2 4.48Å; L546-F580 HydrophobicContact CB-CZ 4.37Å; L548-F580 HydrophobicContact CD1-CD1 3.72Å; L548-F580 HydrophobicContact CD1-CE1 3.87Å; L548-F580 HydrophobicContact CD2-CD1 4.42Å; L548-F580 HydrophobicContact CG-CD1 3.9Å; L548-F580 HydrophobicContact CG-CE1 3.8Å; M566-F580 HydrophobicContact CE-CB 4.43Å; M566-F580 HydrophobicContact CE-CD2 4.3Å; M566-F580 HydrophobicContact CE-CG 4.39Å; M566-F580 HydrophobicContact SD-CD2 4.11Å; M566-F580 HydrophobicContact SD-CE2 4.18Å; M578-F580 HydrophobicContact CB-CE2 4.15Å; M578-F580 HydrophobicContact CG-CD2 4.32Å; M578-F580 HydrophobicContact CG-CE1 4.34Å; M578-F580 HydrophobicContact CG-CE2 3.77Å; M578-F580 HydrophobicContact CG-CZ 3.78Å; F580-P593 CarbonylContact O-C 3.53Å; F580-I594 HydrophobicContact CB-CB 4.43Å; F580-I594 HydrophobicContact CB-CD1 4.49Å; F580-I594 PolarHBondContact N-O 2.83Å; F580-I594 PolarHBondContact O-N 2.76Å; F580-V596 HydrophobicContact CD2-CB 4.35Å; F580-V596 HydrophobicContact CD2-CG2 3.68Å; F580-V596 HydrophobicContact CE2-CB 4.25Å; F580-V596 HydrophobicContact CE2-CG2 3.97Å
581	Y	86.8	Confident	80.5	Confident	36 Å²	36	63.4 Å²	63.4	14%	0.141	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	120	176.9	-62.3	-91.4	0	0	0	108.9	V437 G438 M441 D579 I592 P593	V437-Y581 WeakPolarHBondContact CA-O 3.45Å; G438-Y581 PolarHBondContact N-O 3.13Å; G438-Y581 VanDerWaalsContact N-O 3.13Å; G438-Y581 PolarHBondContact O-N 3.2Å; M441-Y581 HydrophobicContact CE-CE1 4.22Å; M441-Y581 HydrophobicContact CG-CD2 4.35Å; M441-Y581 HydrophobicContact CG-CE1 3.99Å; M441-Y581 HydrophobicContact CG-CE2 3.79Å; D579-Y581 HydrophobicContact CB-CE2 3.97Å; Y581-I592 WeakPolarHBondContact CA-O 3.44Å; Y581-P593 HydrophobicContact CD1-CB 4.21Å; Y581-P593 HydrophobicContact CE1-CB 3.98Å
582	I	87.4	Confident	81.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	118.6	163.3	-47.4	-179.2	0	0	0	107.1	V403 L425 F435 S436 V437 L564 F584 P591 I592 I594	V403-I582 HydrophobicContact CG2-CD1 3.69Å; L425-I582 HydrophobicContact CB-CD1 4.44Å; L425-I582 HydrophobicContact CD1-CD1 4.04Å; L425-I582 HydrophobicContact CD2-CD1 4.27Å; L425-I582 HydrophobicContact CD2-CG2 4.22Å; L425-I582 HydrophobicContact CG-CD1 4.47Å; F435-I582 HydrophobicContact CB-CG2 4.01Å; F435-I582 HydrophobicContact CD2-CG2 4.19Å; F435-I582 HydrophobicContact CG-CG2 4.5Å; S436-I582 WeakPolarHBondContact O-CA 3.48Å; V437-I582 HydrophobicContact CG1-CG1 4.23Å; V437-I582 HydrophobicContact CG2-CG1 4.29Å; V437-I582 HydrophobicContact CG2-CG2 4.43Å; L564-I582 HydrophobicContact CD1-CD1 3.65Å; L564-I582 HydrophobicContact CD1-CG1 4.32Å; I582-F584 HydrophobicContact CB-CE2 4.2Å; I582-F584 HydrophobicContact CB-CZ 4.13Å; I582-F584 HydrophobicContact CG2-CE1 3.92Å; I582-F584 HydrophobicContact CG2-CE2 3.77Å; I582-F584 HydrophobicContact CG2-CZ 3.36Å; I582-P591 CarbonylContact O-C 3.47Å; I582-P591 WeakPolarHBondContact O-CA 3.46Å; I582-P591 WeakPolarHBondContact O-CB 3.47Å; I582-I592 HydrophobicContact CB-CB 4.46Å; I582-I592 PolarHBondContact N-O 3.07Å; I582-I592 PolarHBondContact O-N 3.04Å; I582-I594 HydrophobicContact CD1-CD1 3.91Å; I582-I594 HydrophobicContact CG1-CD1 3.66Å
583	R	84.4	Confident	81.7	Confident	43 Å²	43	57.7 Å²	57.7	16%	0.162	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	148.7	173	-41.9	-173.4	-158.5	141.5	-10.8	109.6	F435 S436 S440 H442 P591	F435-R583 CarbonylContact C-O 3.55Å; F435-R583 VanDerWaalsContact CA-O 3.27Å; F435-R583 WeakPolarHBondContact CA-O 3.34Å; S436-R583 PolarHBondContact N-O 2.93Å; S436-R583 PolarHBondContact O-N 3.24Å; S440-R583 PolarHBondContact O-NE 3.05Å; S440-R583 PolarHBondContact O-NH2 3.16Å; H442-R583 PolarHBondContact O-NH2 2.84Å; R583-P591 HydrophobicContact CG-CB 4.36Å; R583-P591 HydrophobicContact CG-CG 4.47Å
584	F	85.1	Confident	82.3	Confident	26 Å²	26	54 Å²	54	11%	0.114	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	163.4	-177.6	-60.6	-84.3	0	0	0	110.9	P401 L425 F434 F435 I582 T589 I592	P401-F584 HydrophobicContact CB-CD1 4.23Å; P401-F584 HydrophobicContact CB-CD2 4.5Å; P401-F584 HydrophobicContact CB-CE1 3.47Å; P401-F584 VanDerWaalsContact CB-CE1 3.47Å; P401-F584 HydrophobicContact CB-CE2 3.82Å; P401-F584 HydrophobicContact CB-CZ 3.25Å; P401-F584 HydrophobicContact CG-CD1 4.14Å; P401-F584 HydrophobicContact CG-CD2 3.85Å; P401-F584 HydrophobicContact CG-CE1 3.82Å; P401-F584 HydrophobicContact CG-CE2 3.53Å; P401-F584 HydrophobicContact CG-CG 4.17Å; P401-F584 HydrophobicContact CG-CZ 3.52Å; L425-F584 HydrophobicContact CD1-CE1 4.17Å; L425-F584 HydrophobicContact CD1-CZ 3.8Å; L425-F584 HydrophobicContact CD2-CE1 4.13Å; L425-F584 HydrophobicContact CD2-CZ 4.35Å; F434-F584 CarbonylContact O-C 3.54Å; F434-F584 VanDerWaalsContact O-CA 3.31Å; F434-F584 WeakPolarHBondContact O-CA 3.47Å; F435-F584 HydrophobicContact CB-CD1 3.71Å; F435-F584 HydrophobicContact CB-CE1 3.62Å; I582-F584 HydrophobicContact CB-CE2 4.2Å; I582-F584 HydrophobicContact CB-CZ 4.13Å; I582-F584 HydrophobicContact CG2-CE1 3.92Å; I582-F584 HydrophobicContact CG2-CE2 3.77Å; I582-F584 HydrophobicContact CG2-CZ 3.36Å; F584-T589 WeakPolarHBondContact CB-OG1 3.45Å; F584-I592 HydrophobicContact CE2-CD1 3.93Å; F584-I592 HydrophobicContact CE2-CG1 4.09Å; F584-I592 HydrophobicContact CZ-CD1 4.06Å
585	S	81.4	Confident	82.7	Confident	79 Å²	79	56.7 Å²	56.7	55%	0.552	31%	0.306	S	S	*	.	S	Bend	trans	-84.2	-14.5	178.3	67.5	0	0	0	0	113.7	S433 F434	S433-S585 PolarHBondContact OG-N 3.04Å; S433-S585 PolarHBondContact OG-OG 3.42Å; S433-S585 VanDerWaalsContact OG-OG 3.09Å; F434-S585 PolarHBondContact N-OG 3.39Å; F434-S585 VanDerWaalsContact N-OG 3.07Å; F434-S585 PolarHBondContact O-N 3.44Å
586	D	78.9	Confident	83	Confident	23 Å²	23	50 Å²	50	12%	0.123	28%	0.275	C	S	.	.			trans	-81.8	116.8	175.7	178.9	-0.3	0	0	0	110.2	C399 S433 N588 T589	C399-D586 HydrophobicContact CB-CB 4.39Å; S433-D586 PolarHBondContact OG-N 3.4Å; D586-N588 PolarHBondContact O-N 2.93Å; D586-N588 VanDerWaalsContact O-N 3.1Å; D586-N588 WeakPolarHBondContact OD1-CB 3.5Å; D586-N588 PolarHBondContact OD1-N 2.84Å; D586-N588 PolarHBondContact OD1-ND2 3.38Å; D586-T589 HydrophobicContact CB-CG2 4.19Å; D586-T589 PolarHBondContact O-N 3.1Å; D586-T589 PolarHBondContact O-OG1 2.9Å
587	A	68.4	Low	83.3	Confident	105 Å²	105	51.1 Å²	51.1	87%	0.868	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.3	-179.1	0	0	0	0	0	114.1	T589	A587-T589 VanDerWaalsContact C-N 3.34Å
588	N	69.5	Low	83.3	Confident	121 Å²	121	46.4 Å²	46.4	65%	0.647	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-14.9	176.1	-60.9	-65.1	0	0	0	113.3	D586	D586-N588 PolarHBondContact O-N 2.93Å; D586-N588 VanDerWaalsContact O-N 3.1Å; D586-N588 WeakPolarHBondContact OD1-CB 3.5Å; D586-N588 PolarHBondContact OD1-N 2.84Å; D586-N588 PolarHBondContact OD1-ND2 3.38Å
589	T	77.7	Confident	83.4	Confident	23 Å²	23	47.6 Å²	47.6	14%	0.141	27%	0.267	C	S	.	.	S	Bend	trans	-96.6	128	-176.9	56.5	0	0	0	0	112	C399 P401 F584 D586 A587	C399-T589 HydrophobicContact CB-CG2 3.93Å; C399-T589 VanDerWaalsContact O-CG2 3.29Å; C399-T589 WeakPolarHBondContact O-CG2 3.42Å; P401-T589 HydrophobicContact CG-CG2 4.36Å; F584-T589 WeakPolarHBondContact CB-OG1 3.45Å; D586-T589 HydrophobicContact CB-CG2 4.19Å; D586-T589 PolarHBondContact O-N 3.1Å; D586-T589 PolarHBondContact O-OG1 2.9Å; A587-T589 VanDerWaalsContact C-N 3.34Å
590	K	80.8	Confident	83.2	Confident	181 Å²	181	45.1 Å²	45.1	79%	0.787	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-80	145.5	177.1	-66.4	179.6	-179.4	176.6	0	110.3	I592	K590-I592 PolarHBondContact O-N 2.9Å
591	P	85.1	Confident	82.9	Confident	67 Å²	67	47.8 Å²	47.8	44%	0.435	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-59.4	137.6	172.4	-23.7	34.2	0	0	0	112.1	I582 R583	I582-P591 CarbonylContact O-C 3.47Å; I582-P591 WeakPolarHBondContact O-CA 3.46Å; I582-P591 WeakPolarHBondContact O-CB 3.47Å; R583-P591 HydrophobicContact CG-CB 4.36Å; R583-P591 HydrophobicContact CG-CG 4.47Å
592	I	87.3	Confident	82.4	Confident	19 Å²	19	48 Å²	48	10%	0.097	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119.3	176.9	-58.9	171.5	0	0	0	108.3	P401 V403 Q406 Y581 I582 F584 K590	P401-I592 HydrophobicContact CB-CD1 4.05Å; P401-I592 HydrophobicContact CG-CD1 4.24Å; P401-I592 WeakPolarHBondContact O-CD1 3.45Å; V403-I592 HydrophobicContact CG2-CD1 3.97Å; V403-I592 HydrophobicContact CG2-CG2 3.97Å; Q406-I592 HydrophobicContact CG-CG2 4.37Å; Y581-I592 WeakPolarHBondContact CA-O 3.44Å; I582-I592 HydrophobicContact CB-CB 4.46Å; I582-I592 PolarHBondContact N-O 3.07Å; I582-I592 PolarHBondContact O-N 3.04Å; F584-I592 HydrophobicContact CE2-CD1 3.93Å; F584-I592 HydrophobicContact CE2-CG1 4.09Å; F584-I592 HydrophobicContact CZ-CD1 4.06Å; K590-I592 PolarHBondContact O-N 2.9Å
593	P	87	Confident	82	Confident	41 Å²	41	49.7 Å²	49.7	27%	0.266	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	146.2	171.9	32.5	-33.7	0	0	0	110.8	F580 Y581	F580-P593 CarbonylContact O-C 3.53Å; Y581-P593 HydrophobicContact CD1-CB 4.21Å; Y581-P593 HydrophobicContact CE1-CB 3.98Å
594	I	88.5	Confident	81.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	111.6	169.9	-53.7	152.9	0	0	0	106.5	Q406 I408 I423 M566 F580 I582 V596	Q406-I594 WeakPolarHBondContact O-CA 3.43Å; I408-I594 HydrophobicContact CD1-CG2 3.87Å; I408-I594 HydrophobicContact CG1-CG2 4.17Å; I423-I594 HydrophobicContact CD1-CD1 3.41Å; I423-I594 VanDerWaalsContact CD1-CD1 3.41Å; I423-I594 HydrophobicContact CD1-CG1 4.04Å; I423-I594 HydrophobicContact CD1-CG2 4.28Å; M566-I594 HydrophobicContact CE-CD1 3.79Å; M566-I594 HydrophobicContact CE-CG2 4.43Å; F580-I594 HydrophobicContact CB-CB 4.43Å; F580-I594 HydrophobicContact CB-CD1 4.49Å; F580-I594 PolarHBondContact N-O 2.83Å; F580-I594 PolarHBondContact O-N 2.76Å; I582-I594 HydrophobicContact CD1-CD1 3.91Å; I582-I594 HydrophobicContact CG1-CD1 3.66Å; I594-V596 HydrophobicContact CG2-CG2 3.87Å
595	H	86.9	Confident	82	Confident	92 Å²	92	47.3 Å²	47.3	43%	0.426	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	126.7	174.5	-61.2	-66.5	0	0	0	108.9	Q406 S407 I408 D579	Q406-H595 PolarHBondContact O-N 2.88Å; S407-H595 CarbonylContact C-O 3.54Å; S407-H595 WeakPolarHBondContact CA-O 3.49Å; I408-H595 PolarHBondContact N-O 3.09Å; D579-H595 IonicContact OD1-CE1 2.76Å; D579-H595 IonicContact OD1-CG 2.65Å; D579-H595 IonicContact OD1-ND1 3.78Å; D579-H595 PolarHBondContact OD1-ND1 3.13Å; D579-H595 IonicContact OD2-ND1 2.69Å
596	V	87.8	Confident	82.4	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.7	-178.4	-173.3	0	0	0	0	110.1	I408 F410 L546 I577 M578 F580 I594	I408-V596 HydrophobicContact CB-CG1 4.3Å; I408-V596 HydrophobicContact CB-CG2 4.27Å; I408-V596 HydrophobicContact CD1-CG2 4.12Å; I408-V596 WeakPolarHBondContact O-CA 3.27Å; F410-V596 HydrophobicContact CD2-CG1 3.98Å; F410-V596 HydrophobicContact CE2-CG1 3.64Å; L546-V596 HydrophobicContact CD1-CB 4.23Å; L546-V596 HydrophobicContact CD1-CG1 3.88Å; L546-V596 HydrophobicContact CD2-CG1 3.71Å; L546-V596 HydrophobicContact CG-CG1 4.43Å; I577-V596 CarbonylContact C-O 3.6Å; I577-V596 WeakPolarHBondContact CA-O 3.34Å; M578-V596 PolarHBondContact N-O 3.28Å; M578-V596 WeakPolarHBondContact O-CB 3.31Å; M578-V596 PolarHBondContact O-N 2.96Å; F580-V596 HydrophobicContact CD2-CB 4.35Å; F580-V596 HydrophobicContact CD2-CG2 3.68Å; F580-V596 HydrophobicContact CE2-CB 4.25Å; F580-V596 HydrophobicContact CE2-CG2 3.97Å; I594-V596 HydrophobicContact CG2-CG2 3.87Å
597	S	87.2	Confident	83.1	Confident	32 Å²	32	45.4 Å²	45.4	22%	0.224	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	152.7	179.1	59.9	0	0	0	0	111.9	I408 D409 F410 T576	I408-S597 PolarHBondContact O-N 3.15Å; D409-S597 WeakPolarHBondContact CA-OG 3.46Å; D409-S597 VanDerWaalsContact CB-OG 3.32Å; D409-S597 WeakPolarHBondContact CB-OG 3.26Å; D409-S597 PolarHBondContact OD1-OG 3.29Å; F410-S597 WeakPolarHBondContact CD2-O 3.21Å; F410-S597 PolarHBondContact N-O 2.86Å; T576-S597 CarbonylContact O-C 3.38Å; T576-S597 WeakPolarHBondContact O-CA 3.32Å
598	G	85.3	Confident	84.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	139.9	169.9	0	0	0	0	0	111.1	T576	T576-G598 PolarHBondContact N-O 3.28Å; T576-G598 PolarHBondContact O-N 3Å
599	V	84.3	Confident	85.1	Confident	48 Å²	48	41.6 Å²	41.6	29%	0.291	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.1	-179.2	179.7	0	0	0	0	109.3	G411 S412 H413 E575 V601	G411-V599 PolarHBondContact O-N 3.39Å; S412-V599 WeakPolarHBondContact CA-O 3.37Å; H413-V599 PolarHBondContact N-O 2.98Å; E575-V599 HydrophobicContact CG-CG2 4.46Å; V599-V601 HydrophobicContact CG1-CG2 4.36Å
600	A	82.1	Confident	85.6	Confident	4 Å²	4	44.4 Å²	44.4	3%	0.033	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.1	176	0	0	0	0	0	110.7	H413 V415 P570 V572 P573 G574	H413-A600 WeakPolarHBondContact O-CA 3.45Å; V415-A600 HydrophobicContact CG2-CB 4.12Å; P570-A600 HydrophobicContact CB-CB 3.41Å; P570-A600 VanDerWaalsContact CB-CB 3.41Å; P570-A600 HydrophobicContact CG-CB 4.21Å; V572-A600 VanDerWaalsContact O-CB 3.25Å; V572-A600 WeakPolarHBondContact O-CB 3.46Å; P573-A600 CarbonylContact C-O 3.59Å; P573-A600 VanDerWaalsContact CA-O 3.27Å; P573-A600 WeakPolarHBondContact CA-O 3.38Å; G574-A600 PolarHBondContact N-O 3.26Å; G574-A600 WeakPolarHBondContact O-CB 3.2Å; G574-A600 PolarHBondContact O-N 3.06Å
601	V	79.8	Confident	86.2	Confident	63 Å²	63	38.9 Å²	38.9	38%	0.382	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	138.1	178.5	-170.1	0	0	0	0	109.7	H413 V414 V415 V599	H413-V601 PolarHBondContact O-N 3.47Å; V414-V601 WeakPolarHBondContact CA-O 3.38Å; V415-V601 WeakPolarHBondContact CG2-O 3.21Å; V415-V601 PolarHBondContact N-O 3.04Å; V599-V601 HydrophobicContact CG1-CG2 4.36Å
602	S	75.4	Confident	86.6	Confident	39 Å²	39	35.7 Å²	35.7	27%	0.273	21%	0.205	S	C	.	.			trans	-62.9	145.8	173.1	59.3	0	0	0	0	110.9	R632	S602-R632 PolarHBondContact OG-NH1 2.89Å
603	N	79.8	Confident	86.9	Confident	36 Å²	36	38.3 Å²	38.3	19%	0.193	22%	0.219	C	C	.	.			trans	-44.8	130.6	174.9	-69.4	51.9	0	0	0	112.1	V605 Q704 L706	N603-V605 PolarHBondContact O-N 2.85Å; N603-Q704 PolarHBondContact ND2-NE2 2.98Å; N603-Q704 VanDerWaalsContact ND2-NE2 3.19Å; N603-L706 PolarHBondContact ND2-O 3.02Å
604	P	81.1	Confident	87.2	Confident	19 Å²	19	37.3 Å²	37.3	12%	0.123	21%	0.211	C	C	.	.	S	Bend	trans	-64	-28.5	-175	21.5	-32	0	0	0	113.5	R632 E633 F637 Q704	P604-R632 PolarHBondContact O-N 2.81Å; P604-E633 HydrophobicContact CB-CG 3.34Å; P604-E633 HydrophobicContact CG-CG 4.43Å; P604-F637 HydrophobicContact CB-CE2 4.33Å; P604-Q704 VanDerWaalsContact CD-OE1 3.23Å; P604-Q704 HydrophobicContact CG-CG 4.34Å
605	V	88.4	Confident	87.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.3	176	-177.1	0	0	0	0	110.4	N603 V629 Q630 F637 L639 V701 Q704	N603-V605 PolarHBondContact O-N 2.85Å; V605-V629 HydrophobicContact CG1-CG1 3.41Å; V605-V629 VanDerWaalsContact CG1-CG1 3.41Å; V605-Q630 WeakPolarHBondContact CA-O 3.41Å; V605-F637 HydrophobicContact CG2-CD2 3.34Å; V605-F637 HydrophobicContact CG2-CE2 3.68Å; V605-F637 HydrophobicContact CG2-CG 4.22Å; V605-L639 HydrophobicContact CG1-CD2 4.04Å; V605-V701 HydrophobicContact CB-CG1 3.97Å; V605-V701 HydrophobicContact CB-CG2 4.16Å; V605-V701 HydrophobicContact CG1-CG1 4.33Å; V605-V701 HydrophobicContact CG1-CG2 3.99Å; V605-V701 HydrophobicContact CG2-CG1 3.89Å; V605-Q704 PolarHBondContact O-NE2 3.13Å; V605-Q704 PolarHBondContact O-OE1 3Å
606	W	90.1	Very high	87.6	Confident	56 Å²	56	42.1 Å²	42.1	21%	0.212	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	159.3	179.2	74	103.1	0	0	0	112	V629 Q630 R632	W606-V629 WeakPolarHBondContact O-CA 3.3Å; W606-Q630 HydrophobicContact CH2-CB 3.75Å; W606-Q630 HydrophobicContact CH2-CG 3.53Å; W606-Q630 HydrophobicContact CZ2-CB 3.75Å; W606-Q630 HydrophobicContact CZ2-CG 3.85Å; W606-Q630 HydrophobicContact CZ3-CB 4.2Å; W606-Q630 HydrophobicContact CZ3-CG 4.22Å; W606-Q630 WeakPolarHBondContact CZ3-O 3.19Å; W606-Q630 PolarHBondContact N-O 2.91Å; W606-Q630 PolarHBondContact O-N 3.4Å; W606-R632 HydrophobicContact CH2-CG 3.68Å; W606-R632 HydrophobicContact CZ3-CB 4.15Å; W606-R632 HydrophobicContact CZ3-CG 3.57Å
607	V	91.9	Very high	87.8	Confident	7 Å²	7	42 Å²	42	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	126.7	169.7	-172.6	0	0	0	0	108.1	H609 I627 V629 V699 A708 Y710	V607-H609 VanDerWaalsContact C-N 3.28Å; V607-H609 WeakPolarHBondContact CG1-O 3.39Å; V607-H609 PolarHBondContact O-N 2.93Å; V607-I627 HydrophobicContact CG1-CG2 3.78Å; V607-V629 HydrophobicContact CG2-CG2 4.43Å; V607-V699 HydrophobicContact CG2-CG2 3.94Å; V607-A708 HydrophobicContact CG2-CB 4.25Å; V607-Y710 HydrophobicContact CG2-CD1 3.92Å; V607-Y710 HydrophobicContact CG2-CG 4.26Å
608	V	90.1	Very high	87.9	Confident	50 Å²	50	40.9 Å²	40.9	30%	0.303	22%	0.224	S	C	.	.	S	Bend	trans	-62.9	-36.8	-174.1	177.6	0	0	0	0	111.8	V628 Q630	V608-V628 HydrophobicContact CB-CB 4.26Å; V608-V628 HydrophobicContact CB-CG1 4.35Å; V608-V628 HydrophobicContact CG2-CB 4.15Å; V608-V628 HydrophobicContact CG2-CG1 3.74Å; V608-V628 PolarHBondContact N-O 2.86Å; V608-Q630 HydrophobicContact CG2-CB 3.9Å
609	H	90.9	Very high	88.2	Confident	96 Å²	96	43.1 Å²	43.1	44%	0.444	23%	0.234	S	C	.	.			trans	-115.2	96.4	174.5	-59.1	110.8	0	0	0	109.1	V607 S611	V607-H609 VanDerWaalsContact C-N 3.28Å; V607-H609 WeakPolarHBondContact CG1-O 3.39Å; V607-H609 PolarHBondContact O-N 2.93Å; H609-S611 PolarHBondContact O-N 2.66Å
610	P	88.6	Confident	88.4	Confident	81 Å²	81	44.6 Å²	44.6	53%	0.526	24%	0.24	S	C	.	.	S	Bend	trans	-76.6	-8.9	-176	31	-36.3	0	0	0	113.7	Y710 T711	P610-Y710 CarbonylContact O-C 3.5Å; P610-Y710 WeakPolarHBondContact O-CA 3.48Å; P610-T711 PolarHBondContact O-N 3.29Å; P610-T711 PolarHBondContact O-OG1 3.3Å
611	S	93.3	Very high	88.7	Confident	65 Å²	65	49 Å²	49	46%	0.455	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	119.2	167.8	173.8	0	0	0	0	107.2	H609 H713	H609-S611 PolarHBondContact O-N 2.66Å; S611-H713 PolarHBondContact OG-CD2 3.41Å; S611-H713 PolarHBondContact OG-NE2 2.84Å
612	I	93.5	Very high	89.3	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	113.2	-179.6	-61.5	179.9	0	0	0	107.3	L614 Y625 I627 L670 Y710 T711 I712 H713	I612-L614 HydrophobicContact CG2-CD2 4.07Å; I612-L614 HydrophobicContact CG2-CG 4.49Å; I612-Y625 HydrophobicContact CB-CE1 4.37Å; I612-Y625 HydrophobicContact CD1-CD1 4.14Å; I612-Y625 HydrophobicContact CD1-CE1 3.9Å; I612-Y625 HydrophobicContact CG1-CD1 4.48Å; I612-Y625 HydrophobicContact CG1-CE1 3.94Å; I612-Y625 HydrophobicContact CG2-CD1 3.58Å; I612-Y625 HydrophobicContact CG2-CD2 4.25Å; I612-Y625 HydrophobicContact CG2-CE1 3.65Å; I612-Y625 HydrophobicContact CG2-CE2 4.3Å; I612-Y625 HydrophobicContact CG2-CG 3.91Å; I612-I627 HydrophobicContact CD1-CD1 4.39Å; I612-I627 HydrophobicContact CD1-CG1 3.9Å; I612-I627 HydrophobicContact CD1-CG2 4.32Å; I612-L670 HydrophobicContact CG2-CD2 4.36Å; I612-Y710 HydrophobicContact CD1-CD2 3.68Å; I612-Y710 HydrophobicContact CD1-CE2 4.01Å; I612-Y710 HydrophobicContact CG1-CD2 4.41Å; I612-T711 PolarHBondContact N-O 3.05Å; I612-I712 HydrophobicContact CB-CG1 4.44Å; I612-I712 CarbonylContact O-C 3.56Å; I612-I712 WeakPolarHBondContact O-CA 2.93Å; I612-H713 PolarHBondContact O-N 2.99Å
613	D	93.4	Very high	90.2	Very high	73 Å²	73	51.1 Å²	51.1	39%	0.39	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	107.9	-179.2	178.1	1.7	0	0	0	110.1	K615	D613-K615 VanDerWaalsContact C-N 3.26Å; D613-K615 WeakPolarHBondContact OD1-CA 3.41Å; D613-K615 PolarHBondContact OD1-N 2.85Å; D613-K615 VanDerWaalsContact OD2-CE 3.31Å; D613-K615 WeakPolarHBondContact OD2-CE 3.46Å; D613-K615 IonicContact OD2-NZ 3.69Å; D613-K615 PolarHBondContact OD2-NZ 2.63Å
614	L	92.7	Very high	90.9	Very high	21 Å²	21	55 Å²	55	11%	0.11	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	1.1	178.4	-59	179.8	0	0	0	113.1	I612 Y625 L670 F672 I712 H713 A714	I612-L614 HydrophobicContact CG2-CD2 4.07Å; I612-L614 HydrophobicContact CG2-CG 4.49Å; L614-Y625 HydrophobicContact CD2-CD2 4.48Å; L614-Y625 HydrophobicContact CD2-CG 4.27Å; L614-L670 HydrophobicContact CD1-CD2 4.36Å; L614-L670 HydrophobicContact CD2-CD2 4.26Å; L614-F672 HydrophobicContact CD1-CB 3.92Å; L614-F672 HydrophobicContact CD1-CD1 3.6Å; L614-F672 HydrophobicContact CD1-CE1 4.28Å; L614-F672 HydrophobicContact CD1-CG 3.85Å; L614-I712 HydrophobicContact CD1-CG2 3.78Å; L614-I712 HydrophobicContact CG-CG2 4.18Å; L614-H713 PolarHBondContact N-O 3.22Å; L614-A714 HydrophobicContact CB-CB 4.12Å
615	K	92	Very high	91.5	Very high	132 Å²	132	57.4 Å²	57.4	57%	0.574	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	61.6	-146.4	-177.5	-48.8	-63.7	169.9	-175	0	111.9	D613 A714 I715	D613-K615 VanDerWaalsContact C-N 3.26Å; D613-K615 WeakPolarHBondContact OD1-CA 3.41Å; D613-K615 PolarHBondContact OD1-N 2.85Å; D613-K615 VanDerWaalsContact OD2-CE 3.31Å; D613-K615 WeakPolarHBondContact OD2-CE 3.46Å; D613-K615 IonicContact OD2-NZ 3.69Å; D613-K615 PolarHBondContact OD2-NZ 2.63Å; K615-A714 WeakPolarHBondContact O-CA 3.28Å; K615-I715 PolarHBondContact O-N 2.96Å
616	I	91.6	Very high	91.9	Very high	60 Å²	60	59.7 Å²	59.7	31%	0.308	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.7	-179.5	-57.9	168.5	0	0	0	108.6	I715 T717 I750 L751	I616-I715 CarbonylContact C-O 3.56Å; I616-I715 VanDerWaalsContact CA-O 3.29Å; I616-I715 WeakPolarHBondContact CA-O 3.41Å; I616-I715 HydrophobicContact CG1-CB 4.28Å; I616-T717 HydrophobicContact CG2-CG2 3.77Å; I616-I750 HydrophobicContact CD1-CD1 4Å; I616-I750 HydrophobicContact CD1-CG1 4.27Å; I616-I750 HydrophobicContact CG1-CD1 4.14Å; I616-I750 HydrophobicContact CG2-CD1 3.9Å; I616-I750 HydrophobicContact CG2-CG1 3.92Å; I616-L751 HydrophobicContact CB-CD2 4.19Å; I616-L751 HydrophobicContact CD1-CD2 3.67Å; I616-L751 HydrophobicContact CG2-CD1 3.87Å; I616-L751 HydrophobicContact CG2-CD2 3.95Å; I616-L751 HydrophobicContact CG2-CG 3.89Å
617	C	91.6	Very high	92.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	140.9	179.8	-64.9	0	0	0	0	110.1	Y623 F672 P674 I715 V716 T717	C617-Y623 HydrophobicContact CB-CD2 3.97Å; C617-Y623 HydrophobicContact CB-CE1 4.4Å; C617-Y623 HydrophobicContact CB-CE2 3.64Å; C617-F672 HydrophobicContact CB-CD1 4.48Å; C617-F672 HydrophobicContact CB-CE1 3.94Å; C617-P674 HydrophobicContact CB-CG 4.19Å; C617-I715 PolarHBondContact N-O 3Å; C617-V716 CarbonylContact O-C 3.51Å; C617-V716 VanDerWaalsContact O-CA 3.28Å; C617-V716 WeakPolarHBondContact O-CA 3.5Å; C617-T717 PolarHBondContact O-N 3.44Å
618	T	90.3	Very high	92.2	Very high	7 Å²	7	58.5 Å²	58.5	4%	0.043	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	144.6	174.4	63	0	0	0	0	110.1	R621 Y623 T717 S719 L751	T618-R621 PolarHBondContact O-N 2.88Å; T618-R621 VanDerWaalsContact OG1-CD 3.28Å; T618-R621 WeakPolarHBondContact OG1-CD 3.25Å; T618-R621 WeakPolarHBondContact OG1-CG 3.45Å; T618-Y623 PolarHBondContact N-OH 3.42Å; T618-Y623 PolarHBondContact OG1-OH 3.18Å; T618-Y623 VanDerWaalsContact OG1-OH 3.1Å; T618-T717 WeakPolarHBondContact CA-O 3.48Å; T618-T717 HydrophobicContact CG2-CG2 4.4Å; T618-S719 WeakPolarHBondContact CB-OG 3.5Å; T618-S719 WeakPolarHBondContact CG2-OG 3.5Å; T618-L751 HydrophobicContact CG2-CD1 4.3Å
619	F	90.6	Very high	92.4	Very high	48 Å²	48	56.1 Å²	56.1	21%	0.211	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	148	174.6	-71.1	-72.1	0	0	0	113	R621 P674 R675 Q676 L678 P679 V716 T717	F619-R621 PolarHBondContact O-N 2.69Å; F619-R621 VanDerWaalsContact O-N 3.09Å; F619-P674 CarbonylContact C-O 3.59Å; F619-P674 VanDerWaalsContact CA-O 3.31Å; F619-P674 WeakPolarHBondContact CA-O 3.44Å; F619-P674 HydrophobicContact CD1-CB 4.28Å; F619-R675 WeakPolarHBondContact CD1-O 3.43Å; F619-Q676 HydrophobicContact CB-CG 4.49Å; F619-L678 HydrophobicContact CE1-CB 4.45Å; F619-P679 HydrophobicContact CE1-CG 4.47Å; F619-P679 HydrophobicContact CZ-CG 4.27Å; F619-V716 HydrophobicContact CD1-CG1 3.71Å; F619-V716 HydrophobicContact CD2-CG1 4.15Å; F619-V716 HydrophobicContact CE1-CG1 3.46Å; F619-V716 VanDerWaalsContact CE1-CG1 3.46Å; F619-V716 HydrophobicContact CE2-CG1 3.92Å; F619-V716 HydrophobicContact CG-CG1 4.05Å; F619-V716 HydrophobicContact CZ-CB 4.35Å; F619-V716 HydrophobicContact CZ-CG1 3.57Å; F619-T717 VanDerWaalsContact CD2-O 3.26Å; F619-T717 WeakPolarHBondContact CD2-O 3.34Å; F619-T717 PolarHBondContact N-O 3.13Å; F619-T717 VanDerWaalsContact N-O 3.11Å
620	D	89.5	Confident	92.4	Very high	79 Å²	79	54.9 Å²	54.9	42%	0.422	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	13.5	178.8	-57.1	-52.5	0	0	0	116.5	P674 R675 Q676	D620-P674 PolarHBondContact N-O 3.05Å; D620-R675 VanDerWaalsContact OD1-CA 3.3Å; D620-R675 WeakPolarHBondContact OD1-CA 3.36Å; D620-Q676 WeakPolarHBondContact OD2-CG 3.2Å; D620-Q676 PolarHBondContact OD2-NE2 3.1Å
621	R	88.5	Confident	92.5	Very high	95 Å²	95	51.1 Å²	51.1	36%	0.358	25%	0.251	S	S	.	.			trans	-101.8	151.3	172.5	-66.8	-158.2	178	-115.8	-15	114	T618 F619 Y623 I673 I805	T618-R621 PolarHBondContact O-N 2.88Å; T618-R621 VanDerWaalsContact OG1-CD 3.28Å; T618-R621 WeakPolarHBondContact OG1-CD 3.25Å; T618-R621 WeakPolarHBondContact OG1-CG 3.45Å; F619-R621 PolarHBondContact O-N 2.69Å; F619-R621 VanDerWaalsContact O-N 3.09Å; R621-Y623 HydrophobicContact CB-CE2 3.82Å; R621-Y623 WeakPolarHBondContact O-CD2 3.44Å; R621-I673 WeakPolarHBondContact O-CA 3.47Å; R621-I805 VanDerWaalsContact CZ-CG2 3.42Å; R621-I805 PolarHBondContact NH2-O 2.86Å
622	L	92.1	Very high	92.1	Very high	89 Å²	89	55 Å²	55	47%	0.466	26%	0.255	S	S	.	.			trans	-91.3	117.7	179.1	173	58.9	0	0	0	112	Q624 K671 F672 I673	L622-Q624 HydrophobicContact CD1-CG 4.16Å; L622-Q624 HydrophobicContact CG-CG 4.26Å; L622-K671 HydrophobicContact CD1-CB 3.9Å; L622-K671 HydrophobicContact CD1-CD 4.47Å; L622-K671 HydrophobicContact CD1-CG 4.22Å; L622-F672 WeakPolarHBondContact CA-O 3.31Å; L622-I673 HydrophobicContact CB-CG1 4.14Å; L622-I673 HydrophobicContact CD1-CD1 4.15Å; L622-I673 HydrophobicContact CD1-CG1 3.77Å
623	Y	93.9	Very high	91.6	Very high	59 Å²	59	58.8 Å²	58.8	23%	0.231	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	146	170.9	-62.8	-89.6	0	0	0	110	C617 T618 R621 K671 F672	C617-Y623 HydrophobicContact CB-CD2 3.97Å; C617-Y623 HydrophobicContact CB-CE1 4.4Å; C617-Y623 HydrophobicContact CB-CE2 3.64Å; T618-Y623 PolarHBondContact N-OH 3.42Å; T618-Y623 PolarHBondContact OG1-OH 3.18Å; T618-Y623 VanDerWaalsContact OG1-OH 3.1Å; R621-Y623 HydrophobicContact CB-CE2 3.82Å; R621-Y623 WeakPolarHBondContact O-CD2 3.44Å; Y623-K671 WeakPolarHBondContact O-CA 3.5Å; Y623-F672 HydrophobicContact CD2-CD1 4.35Å; Y623-F672 PolarHBondContact N-O 3.23Å; Y623-F672 PolarHBondContact O-N 2.85Å
624	Q	94.4	Very high	91.2	Very high	118 Å²	118	61.5 Å²	61.5	55%	0.551	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.3	141.9	-178.5	-62.3	-170.6	4.8	0	0	111.7	L622 L670 K671	L622-Q624 HydrophobicContact CD1-CG 4.16Å; L622-Q624 HydrophobicContact CG-CG 4.26Å; Q624-L670 VanDerWaalsContact CA-O 3.31Å; Q624-L670 WeakPolarHBondContact CA-O 3.28Å; Q624-K671 HydrophobicContact CG-CG 4.37Å
625	Y	94.8	Very high	90.9	Very high	68 Å²	68	69.3 Å²	69.3	27%	0.267	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	144.5	178.1	-175.2	-89.2	0	0	0	110.7	I612 L614 Q669 L670	I612-Y625 HydrophobicContact CB-CE1 4.37Å; I612-Y625 HydrophobicContact CD1-CD1 4.14Å; I612-Y625 HydrophobicContact CD1-CE1 3.9Å; I612-Y625 HydrophobicContact CG1-CD1 4.48Å; I612-Y625 HydrophobicContact CG1-CE1 3.94Å; I612-Y625 HydrophobicContact CG2-CD1 3.58Å; I612-Y625 HydrophobicContact CG2-CD2 4.25Å; I612-Y625 HydrophobicContact CG2-CE1 3.65Å; I612-Y625 HydrophobicContact CG2-CE2 4.3Å; I612-Y625 HydrophobicContact CG2-CG 3.91Å; L614-Y625 HydrophobicContact CD2-CD2 4.48Å; L614-Y625 HydrophobicContact CD2-CG 4.27Å; Y625-Q669 PolarHBondContact O-OE1 3.45Å; Y625-L670 PolarHBondContact N-O 2.91Å; Y625-L670 WeakPolarHBondContact O-CB 3.45Å; Y625-L670 PolarHBondContact O-N 3.43Å
626	T	95.5	Very high	90.8	Very high	49 Å²	49	66.1 Å²	66.1	30%	0.301	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	109.3	178.3	-54.2	0	0	0	0	111	V628 N667 A668 Q669	T626-V628 HydrophobicContact CG2-CG2 4.43Å; T626-V628 PolarHBondContact O-N 3.31Å; T626-N667 HydrophobicContact CG2-CB 3.83Å; T626-A668 CarbonylContact C-O 3.38Å; T626-Q669 VanDerWaalsContact OG1-CD 3.28Å; T626-Q669 PolarHBondContact OG1-NE2 2.79Å; T626-Q669 PolarHBondContact OG1-OE1 2.9Å
627	I	94.5	Very high	90.7	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	117.1	171	-47.2	178.1	0	0	0	108.1	V607 I612 V629 F641 I653 N667 A668 L670 Y710	V607-I627 HydrophobicContact CG1-CG2 3.78Å; I612-I627 HydrophobicContact CD1-CD1 4.39Å; I612-I627 HydrophobicContact CD1-CG1 3.9Å; I612-I627 HydrophobicContact CD1-CG2 4.32Å; I627-V629 HydrophobicContact CG2-CG2 4.49Å; I627-F641 HydrophobicContact CB-CE1 4.48Å; I627-F641 HydrophobicContact CD1-CD1 4.41Å; I627-F641 HydrophobicContact CD1-CE1 4.25Å; I627-F641 HydrophobicContact CG2-CE1 4.1Å; I627-I653 HydrophobicContact CD1-CD1 3.89Å; I627-I653 HydrophobicContact CD1-CG1 4.25Å; I627-I653 HydrophobicContact CD1-CG2 4.4Å; I627-N667 WeakPolarHBondContact O-CA 3.29Å; I627-A668 PolarHBondContact N-O 3.46Å; I627-A668 PolarHBondContact O-N 3.02Å; I627-L670 HydrophobicContact CD1-CB 4.13Å; I627-L670 HydrophobicContact CG1-CB 4.07Å; I627-Y710 HydrophobicContact CD1-CE2 3.89Å
628	V	94.3	Very high	90.8	Very high	37 Å²	37	69.6 Å²	69.6	22%	0.224	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	120.8	175.9	-174.4	0	0	0	0	109.5	V608 T626 T665	V608-V628 HydrophobicContact CB-CB 4.26Å; V608-V628 HydrophobicContact CB-CG1 4.35Å; V608-V628 HydrophobicContact CG2-CB 4.15Å; V608-V628 HydrophobicContact CG2-CG1 3.74Å; V608-V628 PolarHBondContact N-O 2.86Å; T626-V628 HydrophobicContact CG2-CG2 4.43Å; T626-V628 PolarHBondContact O-N 3.31Å; V628-T665 HydrophobicContact CG1-CG2 4.26Å
629	V	93.9	Very high	91	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.9	172.7	-175.7	0	0	0	0	108	V605 W606 V607 I627 L639 F641 I660 T665 F666	V605-V629 HydrophobicContact CG1-CG1 3.41Å; V605-V629 VanDerWaalsContact CG1-CG1 3.41Å; W606-V629 WeakPolarHBondContact O-CA 3.3Å; V607-V629 HydrophobicContact CG2-CG2 4.43Å; I627-V629 HydrophobicContact CG2-CG2 4.49Å; V629-L639 HydrophobicContact CB-CD1 4.19Å; V629-L639 HydrophobicContact CG1-CD1 3.98Å; V629-L639 HydrophobicContact CG1-CD2 4.38Å; V629-L639 HydrophobicContact CG2-CD1 4.41Å; V629-F641 HydrophobicContact CG2-CE1 4.16Å; V629-F641 HydrophobicContact CG2-CZ 3.86Å; V629-I660 HydrophobicContact CB-CD1 4.42Å; V629-I660 HydrophobicContact CG1-CD1 4.09Å; V629-T665 CarbonylContact O-C 3.49Å; V629-T665 VanDerWaalsContact O-CA 3.3Å; V629-T665 WeakPolarHBondContact O-CA 3.47Å; V629-F666 HydrophobicContact CB-CB 4.47Å; V629-F666 PolarHBondContact N-O 3Å; V629-F666 PolarHBondContact O-N 3.2Å
630	Q	91.9	Very high	91.1	Very high	70 Å²	70	68.9 Å²	68.9	33%	0.327	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	142.2	-179.4	-170.3	173.2	7.1	0	0	111.3	V605 W606 V608 T665	V605-Q630 WeakPolarHBondContact CA-O 3.41Å; W606-Q630 HydrophobicContact CH2-CB 3.75Å; W606-Q630 HydrophobicContact CH2-CG 3.53Å; W606-Q630 HydrophobicContact CZ2-CB 3.75Å; W606-Q630 HydrophobicContact CZ2-CG 3.85Å; W606-Q630 HydrophobicContact CZ3-CB 4.2Å; W606-Q630 HydrophobicContact CZ3-CG 4.22Å; W606-Q630 WeakPolarHBondContact CZ3-O 3.19Å; W606-Q630 PolarHBondContact N-O 2.91Å; W606-Q630 PolarHBondContact O-N 3.4Å; V608-Q630 HydrophobicContact CG2-CB 3.9Å; Q630-T665 HydrophobicContact CB-CG2 4.27Å; Q630-T665 HydrophobicContact CG-CG2 4.03Å
631	S	89.9	Confident	91.4	Very high	2 Å²	2	65.3 Å²	65.3	1%	0.014	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	140.7	172.3	-176.2	0	0	0	0	110.9	E633 S664	S631-E633 PolarHBondContact OG-N 2.81Å; S631-S664 PolarHBondContact N-O 2.98Å
632	R	85.3	Confident	91.5	Very high	146 Å²	146	64.3 Å²	64.3	55%	0.551	31%	0.309	S	S	*	.			trans	-102.4	-2	166.8	-87.4	165.7	-168.8	170.6	7.8	113.6	S602 P604 W606 L663	S602-R632 PolarHBondContact OG-NH1 2.89Å; P604-R632 PolarHBondContact O-N 2.81Å; W606-R632 HydrophobicContact CH2-CG 3.68Å; W606-R632 HydrophobicContact CZ3-CB 4.15Å; W606-R632 HydrophobicContact CZ3-CG 3.57Å; R632-L663 VanDerWaalsContact O-CD2 3.3Å; R632-L663 WeakPolarHBondContact O-CD2 3.49Å
633	E	82.7	Confident	91.4	Very high	81 Å²	81	60.7 Å²	60.7	38%	0.379	29%	0.291	S	S	.	.	S	Bend	trans	-91.8	151.1	-173.6	-75.4	-66.7	161.4	0	0	113	P604 S631 R635 F637 A662 L663	P604-E633 HydrophobicContact CB-CG 3.34Å; P604-E633 HydrophobicContact CG-CG 4.43Å; S631-E633 PolarHBondContact OG-N 2.81Å; E633-R635 PolarHBondContact O-N 2.8Å; E633-R635 VanDerWaalsContact O-N 3.09Å; E633-F637 HydrophobicContact CB-CE2 3.63Å; E633-F637 HydrophobicContact CB-CZ 4.08Å; E633-F637 HydrophobicContact CG-CE2 3.68Å; E633-F637 HydrophobicContact CG-CZ 3.86Å; E633-A662 CarbonylContact O-C 3.5Å; E633-A662 VanDerWaalsContact O-CA 3.3Å; E633-A662 WeakPolarHBondContact O-CA 3.32Å; E633-L663 PolarHBondContact O-N 3.46Å
634	N	84.4	Confident	91.1	Very high	130 Å²	130	58.9 Å²	58.9	70%	0.695	29%	0.286	S	S	*	.	S	Bend	trans	-82.4	31.1	172.2	-162.1	23.2	0	0	0	112.5
635	R	87.1	Confident	90.8	Very high	184 Å²	184	57.6 Å²	57.6	69%	0.694	29%	0.288	S	S	*	.	S	Bend	trans	-141.7	150.2	-177.7	-61.9	-176.3	73.3	-178.7	2.7	110.1	E633	E633-R635 PolarHBondContact O-N 2.8Å; E633-R635 VanDerWaalsContact O-N 3.09Å
636	A	89	Confident	90.6	Very high	66 Å²	66	57 Å²	57	55%	0.545	29%	0.288	S	S	.	.			trans	-82.1	142.3	173.6	0	0	0	0	0	111.2	I660	A636-I660 CarbonylContact C-O 3.44Å; A636-I660 WeakPolarHBondContact CA-O 3.33Å; A636-I660 WeakPolarHBondContact CB-O 3.29Å
637	F	90.9	Very high	90.3	Very high	31 Å²	31	54.7 Å²	54.7	14%	0.136	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.4	177.2	-65	-67.3	0	0	0	112	P604 V605 E633 F659 I660 V701 A702	P604-F637 HydrophobicContact CB-CE2 4.33Å; V605-F637 HydrophobicContact CG2-CD2 3.34Å; V605-F637 HydrophobicContact CG2-CE2 3.68Å; V605-F637 HydrophobicContact CG2-CG 4.22Å; E633-F637 HydrophobicContact CB-CE2 3.63Å; E633-F637 HydrophobicContact CB-CZ 4.08Å; E633-F637 HydrophobicContact CG-CE2 3.68Å; E633-F637 HydrophobicContact CG-CZ 3.86Å; F637-F659 VanDerWaalsContact O-CA 3.31Å; F637-F659 WeakPolarHBondContact O-CA 3.47Å; F637-I660 HydrophobicContact CB-CG2 3.83Å; F637-I660 HydrophobicContact CD2-CG2 4.46Å; F637-I660 PolarHBondContact N-O 3Å; F637-I660 PolarHBondContact O-N 3.12Å; F637-V701 HydrophobicContact CB-CG1 3.86Å; F637-V701 HydrophobicContact CD1-CG1 4.46Å; F637-V701 HydrophobicContact CD2-CG1 4.48Å; F637-V701 HydrophobicContact CG-CG1 4.06Å; F637-A702 VanDerWaalsContact CD1-O 3.22Å; F637-A702 WeakPolarHBondContact CD1-O 3.41Å
638	K	93	Very high	90	Very high	102 Å²	102	62.1 Å²	62.1	44%	0.443	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	120.8	170.3	-173.4	177.3	179	178.5	0	109.5	F659 A702	K638-F659 HydrophobicContact CB-CD1 3.93Å; K638-F659 HydrophobicContact CB-CE1 3.67Å; K638-F659 HydrophobicContact CB-CZ 4.46Å; K638-F659 HydrophobicContact CD-CE1 4.13Å; K638-F659 HydrophobicContact CD-CZ 4.21Å; K638-F659 HydrophobicContact CG-CD1 4.29Å; K638-F659 HydrophobicContact CG-CE1 3.8Å; K638-F659 HydrophobicContact CG-CZ 4.1Å; K638-A702 HydrophobicContact CB-CB 3.93Å; K638-A702 PolarHBondContact O-N 3.38Å
639	L	93.9	Very high	89.8	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	143	172.8	-55.6	-176.1	0	0	0	110	V605 V629 R657 G658 I660 F666 V699 Q700 V701	V605-L639 HydrophobicContact CG1-CD2 4.04Å; V629-L639 HydrophobicContact CB-CD1 4.19Å; V629-L639 HydrophobicContact CG1-CD1 3.98Å; V629-L639 HydrophobicContact CG1-CD2 4.38Å; V629-L639 HydrophobicContact CG2-CD1 4.41Å; L639-R657 WeakPolarHBondContact O-CA 3.48Å; L639-G658 PolarHBondContact N-O 3.25Å; L639-G658 PolarHBondContact O-N 2.83Å; L639-G658 VanDerWaalsContact O-N 3.08Å; L639-I660 HydrophobicContact CD1-CB 4.04Å; L639-I660 HydrophobicContact CD1-CG2 4.29Å; L639-I660 HydrophobicContact CD2-CG2 3.95Å; L639-I660 HydrophobicContact CG-CB 4.29Å; L639-I660 HydrophobicContact CG-CG2 4.09Å; L639-F666 HydrophobicContact CD1-CB 3.92Å; L639-F666 HydrophobicContact CD1-CD1 3.64Å; L639-F666 HydrophobicContact CD1-CE1 4.33Å; L639-F666 HydrophobicContact CD1-CG 3.76Å; L639-V699 HydrophobicContact CB-CG1 4.17Å; L639-V699 HydrophobicContact CD2-CG1 4.24Å; L639-Q700 CarbonylContact C-O 3.6Å; L639-Q700 WeakPolarHBondContact CA-O 3.48Å; L639-V701 HydrophobicContact CD2-CB 4.46Å; L639-V701 HydrophobicContact CD2-CG1 4.2Å; L639-V701 HydrophobicContact CD2-CG2 3.83Å
640	T	94.6	Very high	89.7	Confident	40 Å²	40	66.1 Å²	66.1	25%	0.245	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	115.5	165.6	-64.5	0	0	0	0	108.6	D642 I656 R657 Q700	T640-D642 PolarHBondContact O-N 2.91Å; T640-I656 WeakPolarHBondContact CA-O 3.37Å; T640-R657 HydrophobicContact CG2-CG 4.13Å; T640-Q700 PolarHBondContact N-O 2.87Å; T640-Q700 PolarHBondContact O-N 2.59Å
641	F	93.9	Very high	89.8	Confident	3 Å²	3	63 Å²	63	1%	0.013	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	120.5	174.5	-66.3	-93.6	0	0	0	108.4	I627 V629 I653 I656 F666 A668 V699	I627-F641 HydrophobicContact CB-CE1 4.48Å; I627-F641 HydrophobicContact CD1-CD1 4.41Å; I627-F641 HydrophobicContact CD1-CE1 4.25Å; I627-F641 HydrophobicContact CG2-CE1 4.1Å; V629-F641 HydrophobicContact CG2-CE1 4.16Å; V629-F641 HydrophobicContact CG2-CZ 3.86Å; F641-I653 HydrophobicContact CB-CB 4.43Å; F641-I653 HydrophobicContact CB-CD1 3.99Å; F641-I653 HydrophobicContact CB-CG2 4.09Å; F641-I653 HydrophobicContact CD1-CD1 4.1Å; F641-I653 HydrophobicContact CD1-CG2 4.04Å; F641-I653 HydrophobicContact CD2-CG2 4.05Å; F641-I653 HydrophobicContact CG-CD1 4.32Å; F641-I653 HydrophobicContact CG-CG2 3.79Å; F641-I656 PolarHBondContact N-O 2.93Å; F641-I656 WeakPolarHBondContact O-CG2 3.44Å; F641-F666 HydrophobicContact CE2-CD1 4.42Å; F641-F666 HydrophobicContact CE2-CE1 4.02Å; F641-F666 HydrophobicContact CZ-CD1 4.5Å; F641-F666 HydrophobicContact CZ-CE1 4.47Å; F641-A668 HydrophobicContact CD2-CB 4.43Å; F641-A668 HydrophobicContact CE1-CB 4.16Å; F641-A668 HydrophobicContact CE2-CB 3.69Å; F641-A668 HydrophobicContact CZ-CB 3.53Å; F641-V699 HydrophobicContact CD1-CG1 4.34Å; F641-V699 HydrophobicContact CD1-CG2 3.65Å; F641-V699 HydrophobicContact CE1-CG1 4.29Å; F641-V699 HydrophobicContact CE1-CG2 3.59Å; F641-V699 HydrophobicContact CZ-CG1 4.42Å; F641-V699 HydrophobicContact CZ-CG2 4.42Å
642	D	91.5	Very high	90	Very high	74 Å²	74	68 Å²	68	40%	0.396	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	134.7	174	-168.7	15.8	0	0	0	109.8	T640 M697 T698	T640-D642 PolarHBondContact O-N 2.91Å; D642-M697 WeakPolarHBondContact O-CE 3.29Å; D642-T698 PolarHBondContact N-O 3.13Å
643	V	90.3	Very high	90.5	Very high	14 Å²	14	61 Å²	61	9%	0.085	30%	0.298	C	S	.	.			trans	-127.1	110.3	-177	-176.1	0	0	0	0	108	R648 L651 I653 M697	V643-R648 HydrophobicContact CG1-CG 4.03Å; V643-R648 PolarHBondContact O-NE 2.71Å; V643-R648 PolarHBondContact O-NH2 3.36Å; V643-L651 HydrophobicContact CG1-CD2 4.06Å; V643-I653 HydrophobicContact CG2-CD1 4.1Å; V643-I653 HydrophobicContact CG2-CG1 4.46Å; V643-M697 HydrophobicContact CB-CE 4.3Å; V643-M697 HydrophobicContact CG1-CE 4.28Å; V643-M697 HydrophobicContact CG2-CE 4Å
644	C	88.3	Confident	91	Very high	21 Å²	21	60.5 Å²	60.5	14%	0.142	30%	0.297	C	S	.	.			trans	-50	132.4	179.5	-54.9	0	0	0	0	110.5	E646 M647	C644-E646 VanDerWaalsContact CB-OE2 3.3Å; C644-E646 WeakPolarHBondContact CB-OE2 3.43Å; C644-E646 PolarHBondContact O-N 3.09Å; C644-E646 VanDerWaalsContact O-N 3.15Å; C644-M647 PolarHBondContact O-N 3.5Å
645	P	88	Confident	91.4	Very high	90 Å²	90	57 Å²	57	58%	0.584	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-54.6	-36	-172.8	20.8	-32.5	0	0	0	113.8	M647 R648	P645-M647 PolarHBondContact O-N 3.05Å; P645-R648 PolarHBondContact O-N 2.89Å
646	E	88.8	Confident	91.7	Very high	56 Å²	56	52.4 Å²	52.4	26%	0.262	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-53.5	-39.1	175.5	-55.3	94.8	140.3	0	0	112.2	C644 D681 A682 Y685	C644-E646 VanDerWaalsContact CB-OE2 3.3Å; C644-E646 WeakPolarHBondContact CB-OE2 3.43Å; C644-E646 PolarHBondContact O-N 3.09Å; C644-E646 VanDerWaalsContact O-N 3.15Å; E646-D681 WeakPolarHBondContact CB-O 3.46Å; E646-A682 HydrophobicContact CB-CB 4.37Å; E646-Y685 HydrophobicContact CB-CE2 4.43Å; E646-Y685 HydrophobicContact CG-CE2 4.19Å; E646-Y685 VanDerWaalsContact OE1-CE2 3.31Å; E646-Y685 WeakPolarHBondContact OE1-CE2 3.35Å; E646-Y685 PolarHBondContact OE1-OH 2.84Å
647	M	90.4	Very high	91.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-90.4	-9.8	-173.8	-67	-56.9	-60.9	0	0	114.2	C644 P645 K649 H650 L651 F672 L678 A682 L693 V695	C644-M647 PolarHBondContact O-N 3.5Å; P645-M647 PolarHBondContact O-N 3.05Å; M647-K649 PolarHBondContact O-N 2.86Å; M647-K649 VanDerWaalsContact O-N 3.09Å; M647-H650 HydrophobicContact CE-CB 4.17Å; M647-H650 CarbonylContact O-C 3.54Å; M647-H650 WeakPolarHBondContact O-CA 3.16Å; M647-H650 PolarHBondContact O-N 3.42Å; M647-L651 HydrophobicContact CB-CB 4.1Å; M647-L651 HydrophobicContact CE-CB 4.2Å; M647-L651 HydrophobicContact CE-CD1 4.09Å; M647-L651 WeakPolarHBondContact O-CB 3.33Å; M647-L651 PolarHBondContact O-N 2.64Å; M647-F672 HydrophobicContact CE-CE2 3.99Å; M647-L678 HydrophobicContact CE-CD1 3.9Å; M647-L678 HydrophobicContact SD-CD1 3.86Å; M647-A682 HydrophobicContact SD-CB 3.76Å; M647-L693 HydrophobicContact CE-CD1 4.27Å; M647-L693 HydrophobicContact CE-CD2 4.01Å; M647-L693 HydrophobicContact SD-CD1 4.26Å; M647-V695 HydrophobicContact CE-CG2 4.02Å; M647-V695 HydrophobicContact CG-CG1 3.93Å; M647-V695 HydrophobicContact CG-CG2 3.91Å; M647-V695 HydrophobicContact SD-CG2 3.85Å
648	R	88.3	Confident	92	Very high	158 Å²	158	56.7 Å²	56.7	60%	0.596	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.9	-170.8	-67.6	179.8	-175.3	175.8	1.9	115	V643 P645 H650	V643-R648 HydrophobicContact CG1-CG 4.03Å; V643-R648 PolarHBondContact O-NE 2.71Å; V643-R648 PolarHBondContact O-NH2 3.36Å; P645-R648 PolarHBondContact O-N 2.89Å; R648-H650 VanDerWaalsContact C-N 3.33Å
649	K	90.6	Very high	91.9	Very high	117 Å²	117	58.5 Å²	58.5	51%	0.509	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-22.2	173.8	-66	172	178.6	177.3	0	113.3	M647 R675 D681	M647-K649 PolarHBondContact O-N 2.86Å; M647-K649 VanDerWaalsContact O-N 3.09Å; K649-R675 PolarHBondContact O-NE 2.68Å; K649-D681 WeakPolarHBondContact CD-OD2 3.4Å; K649-D681 VanDerWaalsContact NZ-CG 3.3Å; K649-D681 IonicContact NZ-OD1 3.43Å; K649-D681 PolarHBondContact NZ-OD1 2.74Å; K649-D681 IonicContact NZ-OD2 2.65Å; K649-D681 PolarHBondContact NZ-OD2 3.22Å
650	H	91.9	Very high	91.9	Very high	3 Å²	3	58.5 Å²	58.5	1%	0.014	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-16.6	-166.9	-51.3	-66.2	0	0	0	113.4	M647 R648 F672 I673 R675 S677 L678 D681	M647-H650 HydrophobicContact CE-CB 4.17Å; M647-H650 CarbonylContact O-C 3.54Å; M647-H650 WeakPolarHBondContact O-CA 3.16Å; M647-H650 PolarHBondContact O-N 3.42Å; R648-H650 VanDerWaalsContact C-N 3.33Å; H650-F672 CarbonylContact O-C 3.51Å; H650-F672 WeakPolarHBondContact O-CA 3.31Å; H650-F672 WeakPolarHBondContact O-CD2 3.3Å; H650-I673 VanDerWaalsContact CA-O 3.25Å; H650-I673 WeakPolarHBondContact CA-O 3.2Å; H650-I673 WeakPolarHBondContact CB-O 3.43Å; H650-I673 CarbonylContact O-C 3.56Å; H650-I673 PolarHBondContact O-N 3.45Å; H650-R675 PolarHBondContact ND1-N 3.44Å; H650-S677 PolarHBondContact CE1-OG 3.28Å; H650-S677 VanDerWaalsContact CE1-OG 3.28Å; H650-L678 HydrophobicContact CB-CD1 4.28Å; H650-L678 PolarHBondContact CE1-N 3.27Å; H650-D681 IonicContact CE1-OD2 3.95Å; H650-D681 IonicContact NE2-OD2 3.68Å; H650-D681 PolarHBondContact NE2-OD2 3.25Å
651	L	93.5	Very high	91.7	Very high	6 Å²	6	63.1 Å²	63.1	3%	0.031	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	125.6	-167.9	-167.1	148.9	0	0	0	110	V643 M647 I653 L670 K671 F672 M697 I712	V643-L651 HydrophobicContact CG1-CD2 4.06Å; M647-L651 HydrophobicContact CB-CB 4.1Å; M647-L651 HydrophobicContact CE-CB 4.2Å; M647-L651 HydrophobicContact CE-CD1 4.09Å; M647-L651 WeakPolarHBondContact O-CB 3.33Å; M647-L651 PolarHBondContact O-N 2.64Å; L651-I653 HydrophobicContact CD2-CD1 4.4Å; L651-I653 HydrophobicContact CD2-CG1 4.2Å; L651-L670 HydrophobicContact CD1-CD1 4.06Å; L651-L670 HydrophobicContact CD2-CD1 3.59Å; L651-L670 HydrophobicContact CG-CD1 3.67Å; L651-K671 WeakPolarHBondContact CA-O 3.33Å; L651-F672 HydrophobicContact CB-CD2 4.42Å; L651-F672 HydrophobicContact CD1-CD2 4.22Å; L651-M697 HydrophobicContact CD2-CE 3.78Å; L651-I712 HydrophobicContact CD1-CD1 3.79Å
652	Q	93.6	Very high	91.4	Very high	105 Å²	105	65 Å²	65	49%	0.491	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	136.7	-179	-173.5	-176.3	41.6	0	0	109.3	I654 K671	Q652-I654 HydrophobicContact CG-CD1 4.45Å; Q652-I654 HydrophobicContact CG-CG1 4.04Å; Q652-K671 HydrophobicContact CB-CB 4.44Å; Q652-K671 PolarHBondContact N-O 3.27Å; Q652-K671 PolarHBondContact O-N 2.98Å
653	I	95.1	Very high	91.2	Very high	1 Å²	1	67 Å²	67	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	130.2	174.1	-62.5	173	0	0	0	108	I627 F641 V643 L651 I656 A668 Q669 L670 M697 Y710	I627-I653 HydrophobicContact CD1-CD1 3.89Å; I627-I653 HydrophobicContact CD1-CG1 4.25Å; I627-I653 HydrophobicContact CD1-CG2 4.4Å; F641-I653 HydrophobicContact CB-CB 4.43Å; F641-I653 HydrophobicContact CB-CD1 3.99Å; F641-I653 HydrophobicContact CB-CG2 4.09Å; F641-I653 HydrophobicContact CD1-CD1 4.1Å; F641-I653 HydrophobicContact CD1-CG2 4.04Å; F641-I653 HydrophobicContact CD2-CG2 4.05Å; F641-I653 HydrophobicContact CG-CD1 4.32Å; F641-I653 HydrophobicContact CG-CG2 3.79Å; V643-I653 HydrophobicContact CG2-CD1 4.1Å; V643-I653 HydrophobicContact CG2-CG1 4.46Å; L651-I653 HydrophobicContact CD2-CD1 4.4Å; L651-I653 HydrophobicContact CD2-CG1 4.2Å; I653-I656 WeakPolarHBondContact O-CG1 3.31Å; I653-I656 PolarHBondContact O-N 3.36Å; I653-A668 HydrophobicContact CG2-CB 3.79Å; I653-Q669 CarbonylContact C-O 3.57Å; I653-Q669 WeakPolarHBondContact CA-O 3.42Å; I653-L670 HydrophobicContact CD1-CD1 4.41Å; I653-L670 HydrophobicContact CG1-CD1 3.81Å; I653-M697 HydrophobicContact CD1-CE 3.82Å; I653-Y710 WeakPolarHBondContact CD1-OH 3.26Å
654	I	93.5	Very high	91.3	Very high	69 Å²	69	67.7 Å²	67.7	35%	0.354	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.4	-177.3	-53	-175.8	0	0	0	109.8	Q652 Q669 K671	Q652-I654 HydrophobicContact CG-CD1 4.45Å; Q652-I654 HydrophobicContact CG-CG1 4.04Å; I654-Q669 PolarHBondContact N-O 2.75Å; I654-Q669 PolarHBondContact O-N 3.38Å; I654-K671 HydrophobicContact CD1-CD 3.91Å
655	P	94.2	Very high	91.5	Very high	58 Å²	58	70.4 Å²	70.4	38%	0.377	35%	0.349	S	S	.	.	S	Bend	cis	-82.3	148.1	-6.5	36.5	-36.4	0	0	0	112.1	R657 F666	P655-R657 WeakPolarHBondContact CB-O 3.39Å; P655-R657 PolarHBondContact O-N 3.27Å; P655-F666 HydrophobicContact CG-CE1 4.34Å; P655-F666 HydrophobicContact CG-CZ 3.76Å
656	I	92.6	Very high	91.8	Very high	87 Å²	87	67.8 Å²	67.8	45%	0.446	33%	0.328	S	S	.	.	S	Bend	trans	-65.6	-28.7	176.2	-57.5	177.4	0	0	0	111.5	T640 F641 I653	T640-I656 WeakPolarHBondContact CA-O 3.37Å; F641-I656 PolarHBondContact N-O 2.93Å; F641-I656 WeakPolarHBondContact O-CG2 3.44Å; I653-I656 WeakPolarHBondContact O-CG1 3.31Å; I653-I656 PolarHBondContact O-N 3.36Å
657	R	93.5	Very high	92.1	Very high	177 Å²	177	69.4 Å²	69.4	67%	0.668	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.7	178.7	-61.9	177.7	-179.2	163.8	1.4	109	L639 T640 P655	L639-R657 WeakPolarHBondContact O-CA 3.48Å; T640-R657 HydrophobicContact CG2-CG 4.13Å; P655-R657 WeakPolarHBondContact CB-O 3.39Å; P655-R657 PolarHBondContact O-N 3.27Å
658	G	92	Very high	92.3	Very high	10 Å²	10	69.4 Å²	69.4	10%	0.103	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	177.2	179.4	0	0	0	0	0	112.1	L639	L639-G658 PolarHBondContact N-O 3.25Å; L639-G658 PolarHBondContact O-N 2.83Å; L639-G658 VanDerWaalsContact O-N 3.08Å
659	F	92.3	Very high	92.7	Very high	139 Å²	139	65.5 Å²	65.5	61%	0.61	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125	123.3	171.2	-65.8	-90.6	0	0	0	108.5	F637 K638 F666	F637-F659 VanDerWaalsContact O-CA 3.31Å; F637-F659 WeakPolarHBondContact O-CA 3.47Å; K638-F659 HydrophobicContact CB-CD1 3.93Å; K638-F659 HydrophobicContact CB-CE1 3.67Å; K638-F659 HydrophobicContact CB-CZ 4.46Å; K638-F659 HydrophobicContact CD-CE1 4.13Å; K638-F659 HydrophobicContact CD-CZ 4.21Å; K638-F659 HydrophobicContact CG-CD1 4.29Å; K638-F659 HydrophobicContact CG-CE1 3.8Å; K638-F659 HydrophobicContact CG-CZ 4.1Å; F659-F666 WeakPolarHBondContact O-CD2 3.41Å
660	I	92.2	Very high	92.9	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	136.8	168.9	-168.3	162.6	0	0	0	107.8	V629 A636 F637 L639 S664 F666	V629-I660 HydrophobicContact CB-CD1 4.42Å; V629-I660 HydrophobicContact CG1-CD1 4.09Å; A636-I660 CarbonylContact C-O 3.44Å; A636-I660 WeakPolarHBondContact CA-O 3.33Å; A636-I660 WeakPolarHBondContact CB-O 3.29Å; F637-I660 HydrophobicContact CB-CG2 3.83Å; F637-I660 HydrophobicContact CD2-CG2 4.46Å; F637-I660 PolarHBondContact N-O 3Å; F637-I660 PolarHBondContact O-N 3.12Å; L639-I660 HydrophobicContact CD1-CB 4.04Å; L639-I660 HydrophobicContact CD1-CG2 4.29Å; L639-I660 HydrophobicContact CD2-CG2 3.95Å; L639-I660 HydrophobicContact CG-CB 4.29Å; L639-I660 HydrophobicContact CG-CG2 4.09Å; I660-S664 WeakPolarHBondContact CD1-O 3.08Å; I660-S664 WeakPolarHBondContact CG1-OG 3.28Å; I660-F666 HydrophobicContact CB-CB 3.91Å; I660-F666 HydrophobicContact CD1-CB 3.81Å; I660-F666 HydrophobicContact CG1-CB 3.83Å
661	Q	90.4	Very high	93	Very high	138 Å²	138	63 Å²	63	65%	0.645	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-88.6	172.2	-177.6	-70.4	-178.2	-22.4	0	0	111.1	L663 S664	Q661-L663 PolarHBondContact O-N 3.36Å; Q661-S664 PolarHBondContact N-OG 3.32Å; Q661-S664 VanDerWaalsContact N-OG 3.08Å; Q661-S664 PolarHBondContact O-N 2.98Å; Q661-S664 PolarHBondContact O-OG 3.44Å
662	A	87.8	Confident	93.1	Very high	41 Å²	41	62.8 Å²	62.8	34%	0.339	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	130.1	173.1	0	0	0	0	0	110.5	E633 S664	E633-A662 CarbonylContact O-C 3.5Å; E633-A662 VanDerWaalsContact O-CA 3.3Å; E633-A662 WeakPolarHBondContact O-CA 3.32Å; A662-S664 PolarHBondContact O-N 3.45Å
663	L	87.5	Confident	93.2	Very high	118 Å²	118	60.3 Å²	60.3	62%	0.618	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	17.2	179.4	-57.8	176.9	0	0	0	115.6	R632 E633 Q661	R632-L663 VanDerWaalsContact O-CD2 3.3Å; R632-L663 WeakPolarHBondContact O-CD2 3.49Å; E633-L663 PolarHBondContact O-N 3.46Å; Q661-L663 PolarHBondContact O-N 3.36Å
664	S	92.6	Very high	93.1	Very high	28 Å²	28	60.2 Å²	60.2	20%	0.196	30%	0.304	C	S	.	.			trans	-99.3	166.9	-172.2	101.4	0	0	0	0	113.6	S631 I660 Q661 A662	S631-S664 PolarHBondContact N-O 2.98Å; I660-S664 WeakPolarHBondContact CD1-O 3.08Å; I660-S664 WeakPolarHBondContact CG1-OG 3.28Å; Q661-S664 PolarHBondContact N-OG 3.32Å; Q661-S664 VanDerWaalsContact N-OG 3.08Å; Q661-S664 PolarHBondContact O-N 2.98Å; Q661-S664 PolarHBondContact O-OG 3.44Å; A662-S664 PolarHBondContact O-N 3.45Å
665	T	93.4	Very high	93	Very high	77 Å²	77	62.4 Å²	62.4	47%	0.472	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	156.1	159	50	0	0	0	0	110.8	V628 V629 Q630	V628-T665 HydrophobicContact CG1-CG2 4.26Å; V629-T665 CarbonylContact O-C 3.49Å; V629-T665 VanDerWaalsContact O-CA 3.3Å; V629-T665 WeakPolarHBondContact O-CA 3.47Å; Q630-T665 HydrophobicContact CB-CG2 4.27Å; Q630-T665 HydrophobicContact CG-CG2 4.03Å
666	F	94.3	Very high	92.7	Very high	35 Å²	35	66.3 Å²	66.3	15%	0.154	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	132.9	169.6	-176.8	-86.3	0	0	0	109.4	V629 L639 F641 P655 F659 I660 A668	V629-F666 HydrophobicContact CB-CB 4.47Å; V629-F666 PolarHBondContact N-O 3Å; V629-F666 PolarHBondContact O-N 3.2Å; L639-F666 HydrophobicContact CD1-CB 3.92Å; L639-F666 HydrophobicContact CD1-CD1 3.64Å; L639-F666 HydrophobicContact CD1-CE1 4.33Å; L639-F666 HydrophobicContact CD1-CG 3.76Å; F641-F666 HydrophobicContact CE2-CD1 4.42Å; F641-F666 HydrophobicContact CE2-CE1 4.02Å; F641-F666 HydrophobicContact CZ-CD1 4.5Å; F641-F666 HydrophobicContact CZ-CE1 4.47Å; P655-F666 HydrophobicContact CG-CE1 4.34Å; P655-F666 HydrophobicContact CG-CZ 3.76Å; F659-F666 WeakPolarHBondContact O-CD2 3.41Å; I660-F666 HydrophobicContact CB-CB 3.91Å; I660-F666 HydrophobicContact CD1-CB 3.81Å; I660-F666 HydrophobicContact CG1-CB 3.83Å; F666-A668 HydrophobicContact CE1-CB 4.23Å
667	N	94.8	Very high	92.6	Very high	90 Å²	90	64.1 Å²	64.1	48%	0.481	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.9	-175.1	-65.4	-15.8	0	0	0	110.1	T626 I627	T626-N667 HydrophobicContact CG2-CB 3.83Å; I627-N667 WeakPolarHBondContact O-CA 3.29Å
668	A	94.6	Very high	92.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.4	172.8	0	0	0	0	0	110.5	T626 I627 F641 I653 F666	T626-A668 CarbonylContact C-O 3.38Å; I627-A668 PolarHBondContact N-O 3.46Å; I627-A668 PolarHBondContact O-N 3.02Å; F641-A668 HydrophobicContact CD2-CB 4.43Å; F641-A668 HydrophobicContact CE1-CB 4.16Å; F641-A668 HydrophobicContact CE2-CB 3.69Å; F641-A668 HydrophobicContact CZ-CB 3.53Å; I653-A668 HydrophobicContact CG2-CB 3.79Å; F666-A668 HydrophobicContact CE1-CB 4.23Å
669	Q	95.5	Very high	92.2	Very high	77 Å²	77	57 Å²	57	36%	0.36	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	112.9	176.4	-62.7	-59.8	-9.6	0	0	110.5	Y625 T626 I653 I654	Y625-Q669 PolarHBondContact O-OE1 3.45Å; T626-Q669 VanDerWaalsContact OG1-CD 3.28Å; T626-Q669 PolarHBondContact OG1-NE2 2.79Å; T626-Q669 PolarHBondContact OG1-OE1 2.9Å; I653-Q669 CarbonylContact C-O 3.57Å; I653-Q669 WeakPolarHBondContact CA-O 3.42Å; I654-Q669 PolarHBondContact N-O 2.75Å; I654-Q669 PolarHBondContact O-N 3.38Å
670	L	95.1	Very high	92	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	124.4	164.6	178.4	64.8	0	0	0	108.5	I612 L614 Q624 Y625 I627 L651 I653 I712	I612-L670 HydrophobicContact CG2-CD2 4.36Å; L614-L670 HydrophobicContact CD1-CD2 4.36Å; L614-L670 HydrophobicContact CD2-CD2 4.26Å; Q624-L670 VanDerWaalsContact CA-O 3.31Å; Q624-L670 WeakPolarHBondContact CA-O 3.28Å; Y625-L670 PolarHBondContact N-O 2.91Å; Y625-L670 WeakPolarHBondContact O-CB 3.45Å; Y625-L670 PolarHBondContact O-N 3.43Å; I627-L670 HydrophobicContact CD1-CB 4.13Å; I627-L670 HydrophobicContact CG1-CB 4.07Å; L651-L670 HydrophobicContact CD1-CD1 4.06Å; L651-L670 HydrophobicContact CD2-CD1 3.59Å; L651-L670 HydrophobicContact CG-CD1 3.67Å; I653-L670 HydrophobicContact CD1-CD1 4.41Å; I653-L670 HydrophobicContact CG1-CD1 3.81Å; L670-I712 HydrophobicContact CD1-CD1 4.03Å; L670-I712 HydrophobicContact CD2-CD1 3.85Å; L670-I712 HydrophobicContact CD2-CG1 4.44Å; L670-I712 HydrophobicContact CD2-CG2 4.42Å
671	K	95.3	Very high	91.9	Very high	67 Å²	67	60.6 Å²	60.6	29%	0.291	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.5	167.2	-67.1	-175.3	177.9	178.8	0	108.3	L622 Y623 Q624 L651 Q652 I654	L622-K671 HydrophobicContact CD1-CB 3.9Å; L622-K671 HydrophobicContact CD1-CD 4.47Å; L622-K671 HydrophobicContact CD1-CG 4.22Å; Y623-K671 WeakPolarHBondContact O-CA 3.5Å; Q624-K671 HydrophobicContact CG-CG 4.37Å; L651-K671 WeakPolarHBondContact CA-O 3.33Å; Q652-K671 HydrophobicContact CB-CB 4.44Å; Q652-K671 PolarHBondContact N-O 3.27Å; Q652-K671 PolarHBondContact O-N 2.98Å; I654-K671 HydrophobicContact CD1-CD 3.91Å
672	F	95.6	Very high	91.7	Very high	1 Å²	1	54.1 Å²	54.1	0%	0.004	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.8	179.4	177.7	-122.6	0	0	0	109.8	L614 C617 L622 Y623 M647 H650 L651 P674 L693 A714 V716	L614-F672 HydrophobicContact CD1-CB 3.92Å; L614-F672 HydrophobicContact CD1-CD1 3.6Å; L614-F672 HydrophobicContact CD1-CE1 4.28Å; L614-F672 HydrophobicContact CD1-CG 3.85Å; C617-F672 HydrophobicContact CB-CD1 4.48Å; C617-F672 HydrophobicContact CB-CE1 3.94Å; L622-F672 WeakPolarHBondContact CA-O 3.31Å; Y623-F672 HydrophobicContact CD2-CD1 4.35Å; Y623-F672 PolarHBondContact N-O 3.23Å; Y623-F672 PolarHBondContact O-N 2.85Å; M647-F672 HydrophobicContact CE-CE2 3.99Å; H650-F672 CarbonylContact O-C 3.51Å; H650-F672 WeakPolarHBondContact O-CA 3.31Å; H650-F672 WeakPolarHBondContact O-CD2 3.3Å; L651-F672 HydrophobicContact CB-CD2 4.42Å; L651-F672 HydrophobicContact CD1-CD2 4.22Å; F672-P674 HydrophobicContact CD1-CG 4.34Å; F672-P674 HydrophobicContact CE1-CB 4Å; F672-P674 HydrophobicContact CE1-CG 3.71Å; F672-P674 HydrophobicContact CE2-CB 4.18Å; F672-P674 HydrophobicContact CZ-CB 3.6Å; F672-P674 HydrophobicContact CZ-CG 3.87Å; F672-L693 HydrophobicContact CE1-CD2 4.41Å; F672-L693 HydrophobicContact CE2-CD2 3.71Å; F672-L693 HydrophobicContact CZ-CD2 3.44Å; F672-L693 VanDerWaalsContact CZ-CD2 3.44Å; F672-A714 HydrophobicContact CE1-CB 4.13Å; F672-V716 HydrophobicContact CZ-CG2 4.24Å
673	I	94.8	Very high	91.6	Very high	52 Å²	52	59.2 Å²	59.2	27%	0.267	29%	0.293	S	S	.	.			trans	-133.4	86.6	177.2	-53	174.1	0	0	0	106.8	R621 L622 H650 R675	R621-I673 WeakPolarHBondContact O-CA 3.47Å; L622-I673 HydrophobicContact CB-CG1 4.14Å; L622-I673 HydrophobicContact CD1-CD1 4.15Å; L622-I673 HydrophobicContact CD1-CG1 3.77Å; H650-I673 VanDerWaalsContact CA-O 3.25Å; H650-I673 WeakPolarHBondContact CA-O 3.2Å; H650-I673 WeakPolarHBondContact CB-O 3.43Å; H650-I673 CarbonylContact O-C 3.56Å; H650-I673 PolarHBondContact O-N 3.45Å; I673-R675 HydrophobicContact CG2-CG 4.4Å; I673-R675 PolarHBondContact O-N 3.39Å; I673-R675 VanDerWaalsContact O-N 3.07Å
674	P	92.9	Very high	91.6	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.296	C	S	.	.			trans	-65.7	110.6	175.8	25.4	-29.6	0	0	0	108.5	C617 F619 D620 F672 L678 V716	C617-P674 HydrophobicContact CB-CG 4.19Å; F619-P674 CarbonylContact C-O 3.59Å; F619-P674 VanDerWaalsContact CA-O 3.31Å; F619-P674 WeakPolarHBondContact CA-O 3.44Å; F619-P674 HydrophobicContact CD1-CB 4.28Å; D620-P674 PolarHBondContact N-O 3.05Å; F672-P674 HydrophobicContact CD1-CG 4.34Å; F672-P674 HydrophobicContact CE1-CB 4Å; F672-P674 HydrophobicContact CE1-CG 3.71Å; F672-P674 HydrophobicContact CE2-CB 4.18Å; F672-P674 HydrophobicContact CZ-CB 3.6Å; F672-P674 HydrophobicContact CZ-CG 3.87Å; P674-L678 HydrophobicContact CB-CD2 3.87Å; P674-V716 HydrophobicContact CB-CG1 3.67Å; P674-V716 HydrophobicContact CB-CG2 4.15Å; P674-V716 HydrophobicContact CG-CG1 3.99Å
675	R	91.6	Very high	91.4	Very high	114 Å²	114	61.4 Å²	61.4	43%	0.43	29%	0.293	S	S	.	.			trans	-90.6	161.9	178.1	-52.5	171.4	-178.8	-91.3	2.7	109.6	F619 D620 K649 H650 I673 S677 L678	F619-R675 WeakPolarHBondContact CD1-O 3.43Å; D620-R675 VanDerWaalsContact OD1-CA 3.3Å; D620-R675 WeakPolarHBondContact OD1-CA 3.36Å; K649-R675 PolarHBondContact O-NE 2.68Å; H650-R675 PolarHBondContact ND1-N 3.44Å; I673-R675 HydrophobicContact CG2-CG 4.4Å; I673-R675 PolarHBondContact O-N 3.39Å; I673-R675 VanDerWaalsContact O-N 3.07Å; R675-S677 PolarHBondContact O-N 2.95Å; R675-L678 WeakPolarHBondContact O-CB 3.15Å; R675-L678 PolarHBondContact O-N 3.43Å
676	Q	88.1	Confident	91.2	Very high	140 Å²	140	58.5 Å²	58.5	65%	0.654	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-16.1	174.3	-66.2	168.9	42.1	0	0	114.6	F619 D620 P679	F619-Q676 HydrophobicContact CB-CG 4.49Å; D620-Q676 WeakPolarHBondContact OD2-CG 3.2Å; D620-Q676 PolarHBondContact OD2-NE2 3.1Å; Q676-P679 WeakPolarHBondContact O-CD 3.33Å
677	S	90.6	Very high	91	Very high	42 Å²	42	60 Å²	60	29%	0.294	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-10.3	172.4	70.6	0	0	0	0	114.8	H650 R675 P679 K680 D681	H650-S677 PolarHBondContact CE1-OG 3.28Å; H650-S677 VanDerWaalsContact CE1-OG 3.28Å; R675-S677 PolarHBondContact O-N 2.95Å; S677-P679 VanDerWaalsContact C-CD 3.45Å; S677-K680 WeakPolarHBondContact O-CA 3.15Å; S677-K680 WeakPolarHBondContact O-CB 3.41Å; S677-K680 PolarHBondContact O-N 3.13Å; S677-D681 WeakPolarHBondContact CB-OD2 3.38Å; S677-D681 PolarHBondContact O-N 2.67Å; S677-D681 PolarHBondContact OG-OD2 3Å
678	L	89.6	Confident	90.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-52.2	-43.3	-178.4	179.8	72.2	0	0	0	113.8	F619 M647 H650 P674 R675 K680 D681 A682 F686 L693 V716	F619-L678 HydrophobicContact CE1-CB 4.45Å; M647-L678 HydrophobicContact CE-CD1 3.9Å; M647-L678 HydrophobicContact SD-CD1 3.86Å; H650-L678 HydrophobicContact CB-CD1 4.28Å; H650-L678 PolarHBondContact CE1-N 3.27Å; P674-L678 HydrophobicContact CB-CD2 3.87Å; R675-L678 WeakPolarHBondContact O-CB 3.15Å; R675-L678 PolarHBondContact O-N 3.43Å; L678-K680 PolarHBondContact O-N 3.02Å; L678-K680 VanDerWaalsContact O-N 3.13Å; L678-D681 PolarHBondContact O-N 3Å; L678-A682 HydrophobicContact CD1-CB 3.77Å; L678-A682 PolarHBondContact O-N 2.61Å; L678-F686 HydrophobicContact CD2-CD2 4Å; L678-F686 HydrophobicContact CD2-CE2 4.15Å; L678-F686 HydrophobicContact CD2-CG 4.49Å; L678-F686 HydrophobicContact CG-CD2 4.39Å; L678-F686 HydrophobicContact CG-CG 4.41Å; L678-L693 HydrophobicContact CD1-CD1 4.45Å; L678-V716 HydrophobicContact CD2-CG2 3.96Å
679	P	87.8	Confident	90	Very high	38 Å²	38	66.8 Å²	66.8	25%	0.247	33%	0.327	C	S	.	.	H	α-helix	trans	-67.9	-11	177.9	-17.1	31.8	0	0	0	114.2	F619 Q676 S677 Q683 F686	F619-P679 HydrophobicContact CE1-CG 4.47Å; F619-P679 HydrophobicContact CZ-CG 4.27Å; Q676-P679 WeakPolarHBondContact O-CD 3.33Å; S677-P679 VanDerWaalsContact C-CD 3.45Å; P679-Q683 WeakPolarHBondContact O-CG 3.39Å; P679-F686 HydrophobicContact CB-CD1 3.92Å; P679-F686 HydrophobicContact CB-CE1 3.78Å; P679-F686 HydrophobicContact CG-CD1 4.16Å; P679-F686 HydrophobicContact CG-CE1 3.65Å; P679-F686 HydrophobicContact CG-CZ 4.41Å
680	K	88.4	Confident	89.5	Confident	171 Å²	171	67 Å²	67	74%	0.743	33%	0.333	S	S	*	.	H	α-helix	trans	-103.1	-38.3	175.5	-58.6	-178.5	-178.1	178.8	0	111.4	S677 L678	S677-K680 WeakPolarHBondContact O-CA 3.15Å; S677-K680 WeakPolarHBondContact O-CB 3.41Å; S677-K680 PolarHBondContact O-N 3.13Å; L678-K680 PolarHBondContact O-N 3.02Å; L678-K680 VanDerWaalsContact O-N 3.13Å
681	D	88.9	Confident	89.2	Confident	43 Å²	43	67.3 Å²	67.3	23%	0.23	34%	0.337	C	S	.	.	H	α-helix	trans	-75	-31.7	-179.1	-75.1	-44.5	0	0	0	113.3	E646 K649 H650 S677 L678	E646-D681 WeakPolarHBondContact CB-O 3.46Å; K649-D681 WeakPolarHBondContact CD-OD2 3.4Å; K649-D681 VanDerWaalsContact NZ-CG 3.3Å; K649-D681 IonicContact NZ-OD1 3.43Å; K649-D681 PolarHBondContact NZ-OD1 2.74Å; K649-D681 IonicContact NZ-OD2 2.65Å; K649-D681 PolarHBondContact NZ-OD2 3.22Å; H650-D681 IonicContact CE1-OD2 3.95Å; H650-D681 IonicContact NE2-OD2 3.68Å; H650-D681 PolarHBondContact NE2-OD2 3.25Å; S677-D681 WeakPolarHBondContact CB-OD2 3.38Å; S677-D681 PolarHBondContact O-N 2.67Å; S677-D681 PolarHBondContact OG-OD2 3Å; L678-D681 PolarHBondContact O-N 3Å
682	A	86.7	Confident	89	Confident	1 Å²	1	67 Å²	67	1%	0.008	34%	0.34	C	S	.	.			trans	-128	27.9	-166.7	0	0	0	0	0	115.2	E646 M647 L678 K684 Y685 F686	E646-A682 HydrophobicContact CB-CB 4.37Å; M647-A682 HydrophobicContact SD-CB 3.76Å; L678-A682 HydrophobicContact CD1-CB 3.77Å; L678-A682 PolarHBondContact O-N 2.61Å; A682-K684 PolarHBondContact O-N 3.21Å; A682-Y685 PolarHBondContact O-N 3.02Å; A682-F686 PolarHBondContact O-N 2.82Å
683	Q	84.7	Confident	88.9	Confident	148 Å²	148	66.9 Å²	66.9	69%	0.692	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	-27.1	-176.5	-70.1	-179.3	-20.3	0	0	116.2	P679 Y685	P679-Q683 WeakPolarHBondContact O-CG 3.39Å; Q683-Y685 VanDerWaalsContact C-N 3.34Å
684	K	88.8	Confident	88.8	Confident	159 Å²	159	69.2 Å²	69.2	69%	0.691	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-22.8	178.2	-176.2	-177.9	167.9	-154.4	0	113.8	A682	A682-K684 PolarHBondContact O-N 3.21Å
685	Y	87.9	Confident	88.9	Confident	33 Å²	33	69.2 Å²	69.2	13%	0.129	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-5.2	-173.8	-51.8	-60.8	0	0	0	112.9	E646 A682 Q683 L693 E694 P696	E646-Y685 HydrophobicContact CB-CE2 4.43Å; E646-Y685 HydrophobicContact CG-CE2 4.19Å; E646-Y685 VanDerWaalsContact OE1-CE2 3.31Å; E646-Y685 WeakPolarHBondContact OE1-CE2 3.35Å; E646-Y685 PolarHBondContact OE1-OH 2.84Å; A682-Y685 PolarHBondContact O-N 3.02Å; Q683-Y685 VanDerWaalsContact C-N 3.34Å; Y685-L693 CarbonylContact O-C 3.58Å; Y685-L693 WeakPolarHBondContact O-CA 3.35Å; Y685-E694 WeakPolarHBondContact CB-O 3.25Å; Y685-E694 PolarHBondContact O-N 3.29Å; Y685-P696 HydrophobicContact CD1-CG 4.35Å; Y685-P696 HydrophobicContact CE1-CG 4.02Å
686	F	90.4	Very high	89	Confident	16 Å²	16	67.1 Å²	67.1	7%	0.07	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-127.3	119.6	-177.3	-176.9	-98.2	0	0	0	110.5	L678 P679 A682 G691 V692 L693 V716	L678-F686 HydrophobicContact CD2-CD2 4Å; L678-F686 HydrophobicContact CD2-CE2 4.15Å; L678-F686 HydrophobicContact CD2-CG 4.49Å; L678-F686 HydrophobicContact CG-CD2 4.39Å; L678-F686 HydrophobicContact CG-CG 4.41Å; P679-F686 HydrophobicContact CB-CD1 3.92Å; P679-F686 HydrophobicContact CB-CE1 3.78Å; P679-F686 HydrophobicContact CG-CD1 4.16Å; P679-F686 HydrophobicContact CG-CE1 3.65Å; P679-F686 HydrophobicContact CG-CZ 4.41Å; A682-F686 PolarHBondContact O-N 2.82Å; F686-G691 VanDerWaalsContact CE2-O 3.29Å; F686-G691 WeakPolarHBondContact CE2-O 3.44Å; F686-V692 WeakPolarHBondContact CA-O 3.5Å; F686-L693 HydrophobicContact CB-CD1 3.96Å; F686-L693 HydrophobicContact CD2-CB 3.96Å; F686-L693 HydrophobicContact CD2-CD1 3.98Å; F686-L693 HydrophobicContact CG-CD1 4.46Å; F686-V716 HydrophobicContact CE2-CB 3.78Å; F686-V716 HydrophobicContact CE2-CG2 3.86Å; F686-V716 HydrophobicContact CZ-CB 4.24Å
687	D	89.9	Confident	89.2	Confident	67 Å²	67	60.6 Å²	60.6	36%	0.358	32%	0.32	S	S	.	.			trans	-84.8	121.4	170.7	177.4	-2	0	0	0	109.4	D689 T690 G691 V692	D687-D689 VanDerWaalsContact C-N 3.3Å; D687-D689 PolarHBondContact O-N 2.88Å; D687-D689 PolarHBondContact OD1-N 3.2Å; D687-T690 WeakPolarHBondContact CB-OG1 3.31Å; D687-T690 PolarHBondContact OD1-N 3.46Å; D687-T690 WeakPolarHBondContact OD2-CB 3.41Å; D687-T690 VanDerWaalsContact OD2-CG2 3.29Å; D687-T690 WeakPolarHBondContact OD2-CG2 3.1Å; D687-T690 PolarHBondContact OD2-OG1 2.8Å; D687-G691 CarbonylContact O-C 3.27Å; D687-G691 WeakPolarHBondContact O-CA 3.37Å; D687-G691 PolarHBondContact O-N 3.14Å; D687-V692 PolarHBondContact N-O 2.71Å
688	S	83.8	Confident	89.3	Confident	86 Å²	86	60 Å²	60	60%	0.601	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-26.9	178.7	48.3	0	0	0	0	114
689	D	84	Confident	89.5	Confident	146 Å²	146	60 Å²	60	78%	0.781	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-32.4	-163.5	-59.9	5.3	0	0	0	110.3	D687	D687-D689 VanDerWaalsContact C-N 3.3Å; D687-D689 PolarHBondContact O-N 2.88Å; D687-D689 PolarHBondContact OD1-N 3.2Å
690	T	84.8	Confident	89.7	Confident	81 Å²	81	62.3 Å²	62.3	50%	0.497	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-14	169.7	66.3	0	0	0	0	113.7	D687 V692	D687-T690 WeakPolarHBondContact CB-OG1 3.31Å; D687-T690 PolarHBondContact OD1-N 3.46Å; D687-T690 WeakPolarHBondContact OD2-CB 3.41Å; D687-T690 VanDerWaalsContact OD2-CG2 3.29Å; D687-T690 WeakPolarHBondContact OD2-CG2 3.1Å; D687-T690 PolarHBondContact OD2-OG1 2.8Å; T690-V692 PolarHBondContact O-N 2.9Å; T690-V692 WeakPolarHBondContact OG1-CB 3.37Å; T690-V692 WeakPolarHBondContact OG1-CG2 3.36Å; T690-V692 PolarHBondContact OG1-N 2.87Å
691	G	87.7	Confident	89.8	Confident	8 Å²	8	54.7 Å²	54.7	8%	0.082	29%	0.29	C	S	.	.			trans	70.4	9.6	-173.2	0	0	0	0	0	114.3	F686 D687 I715 V716	F686-G691 VanDerWaalsContact CE2-O 3.29Å; F686-G691 WeakPolarHBondContact CE2-O 3.44Å; D687-G691 CarbonylContact O-C 3.27Å; D687-G691 WeakPolarHBondContact O-CA 3.37Å; D687-G691 PolarHBondContact O-N 3.14Å; G691-I715 CarbonylContact O-C 3.59Å; G691-I715 WeakPolarHBondContact O-CA 3.17Å; G691-V716 PolarHBondContact O-N 2.86Å
692	V	92.7	Very high	89.7	Confident	60 Å²	60	55.3 Å²	55.3	36%	0.364	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	127.4	-176.5	176.6	0	0	0	0	110.8	F686 D687 T690 I715	F686-V692 WeakPolarHBondContact CA-O 3.5Å; D687-V692 PolarHBondContact N-O 2.71Å; T690-V692 PolarHBondContact O-N 2.9Å; T690-V692 WeakPolarHBondContact OG1-CB 3.37Å; T690-V692 WeakPolarHBondContact OG1-CG2 3.36Å; T690-V692 PolarHBondContact OG1-N 2.87Å; V692-I715 HydrophobicContact CG2-CG1 4.42Å
693	L	93.2	Very high	89.3	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.3	171.9	-176.9	69.8	0	0	0	109.3	M647 F672 L678 Y685 F686 V695 H713 A714 V716	M647-L693 HydrophobicContact CE-CD1 4.27Å; M647-L693 HydrophobicContact CE-CD2 4.01Å; M647-L693 HydrophobicContact SD-CD1 4.26Å; F672-L693 HydrophobicContact CE1-CD2 4.41Å; F672-L693 HydrophobicContact CE2-CD2 3.71Å; F672-L693 HydrophobicContact CZ-CD2 3.44Å; F672-L693 VanDerWaalsContact CZ-CD2 3.44Å; L678-L693 HydrophobicContact CD1-CD1 4.45Å; Y685-L693 CarbonylContact O-C 3.58Å; Y685-L693 WeakPolarHBondContact O-CA 3.35Å; F686-L693 HydrophobicContact CB-CD1 3.96Å; F686-L693 HydrophobicContact CD2-CB 3.96Å; F686-L693 HydrophobicContact CD2-CD1 3.98Å; F686-L693 HydrophobicContact CG-CD1 4.46Å; L693-V695 HydrophobicContact CD1-CG2 3.76Å; L693-V695 HydrophobicContact CD2-CG2 4.31Å; L693-V695 HydrophobicContact CG-CG2 3.91Å; L693-H713 VanDerWaalsContact O-CA 3.28Å; L693-H713 WeakPolarHBondContact O-CA 3.26Å; L693-A714 HydrophobicContact CB-CB 4.25Å; L693-A714 HydrophobicContact CD2-CB 4.3Å; L693-A714 PolarHBondContact N-O 3.35Å; L693-A714 PolarHBondContact O-N 2.95Å; L693-V716 HydrophobicContact CB-CG2 4.46Å
694	E	93.1	Very high	89.2	Confident	101 Å²	101	53.1 Å²	53.1	47%	0.472	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	103.1	168.8	-179.5	169.3	-175.8	0	0	110.8	Y685 P696 I712 H713	Y685-E694 WeakPolarHBondContact CB-O 3.25Å; Y685-E694 PolarHBondContact O-N 3.29Å; E694-P696 WeakPolarHBondContact O-CD 3.48Å; E694-I712 WeakPolarHBondContact CA-O 3.21Å; E694-H713 IonicContact OE1-CE1 2.85Å; E694-H713 PolarHBondContact OE1-CE1 2.96Å
695	V	93.5	Very high	88.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	113.7	-179.7	-171.7	0	0	0	0	110.5	M647 L693 M697 T711 I712	M647-V695 HydrophobicContact CE-CG2 4.02Å; M647-V695 HydrophobicContact CG-CG1 3.93Å; M647-V695 HydrophobicContact CG-CG2 3.91Å; M647-V695 HydrophobicContact SD-CG2 3.85Å; L693-V695 HydrophobicContact CD1-CG2 3.76Å; L693-V695 HydrophobicContact CD2-CG2 4.31Å; L693-V695 HydrophobicContact CG-CG2 3.91Å; V695-M697 HydrophobicContact CB-CG 4.46Å; V695-M697 HydrophobicContact CG1-CG 3.89Å; V695-M697 HydrophobicContact CG1-SD 3.62Å; V695-T711 WeakPolarHBondContact O-CA 3.32Å; V695-I712 PolarHBondContact N-O 2.87Å; V695-I712 PolarHBondContact O-N 2.79Å
696	P	93.6	Very high	88.4	Confident	69 Å²	69	51.8 Å²	51.8	45%	0.448	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	120.1	170.2	30.8	-32	0	0	0	110.5	Y685 E694 T711	Y685-P696 HydrophobicContact CD1-CG 4.35Å; Y685-P696 HydrophobicContact CE1-CG 4.02Å; E694-P696 WeakPolarHBondContact O-CD 3.48Å; P696-T711 HydrophobicContact CB-CG2 4.49Å
697	M	92.4	Very high	88.3	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.015	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	160.4	-174	-62.8	-76.4	-76.2	0	0	111.1	D642 V643 L651 I653 V695 Y710 I712	D642-M697 WeakPolarHBondContact O-CE 3.29Å; V643-M697 HydrophobicContact CB-CE 4.3Å; V643-M697 HydrophobicContact CG1-CE 4.28Å; V643-M697 HydrophobicContact CG2-CE 4Å; L651-M697 HydrophobicContact CD2-CE 3.78Å; I653-M697 HydrophobicContact CD1-CE 3.82Å; V695-M697 HydrophobicContact CB-CG 4.46Å; V695-M697 HydrophobicContact CG1-CG 3.89Å; V695-M697 HydrophobicContact CG1-SD 3.62Å; M697-Y710 CarbonylContact C-O 3.41Å; M697-Y710 WeakPolarHBondContact CA-O 3.33Å; M697-Y710 HydrophobicContact CB-CD1 4.05Å; M697-Y710 HydrophobicContact CB-CD2 4.07Å; M697-Y710 HydrophobicContact CB-CE1 3.57Å; M697-Y710 HydrophobicContact CB-CE2 3.62Å; M697-Y710 HydrophobicContact CB-CG 4.27Å; M697-Y710 HydrophobicContact CG-CE2 4.17Å; M697-Y710 PolarHBondContact N-O 2.92Å; M697-Y710 PolarHBondContact O-N 2.69Å; M697-I712 HydrophobicContact CE-CD1 4.29Å; M697-I712 HydrophobicContact CG-CD1 3.79Å; M697-I712 HydrophobicContact CG-CG1 4.11Å
698	T	93.4	Very high	88.3	Confident	30 Å²	30	49.9 Å²	49.9	18%	0.184	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	149.4	178.4	76.3	0	0	0	0	113.2	D642 Q700 A708 K709	D642-T698 PolarHBondContact N-O 3.13Å; T698-Q700 PolarHBondContact OG1-NE2 3.35Å; T698-A708 CarbonylContact C-O 3.48Å; T698-A708 WeakPolarHBondContact CA-O 3.29Å; T698-K709 HydrophobicContact CG2-CG 4.35Å
699	V	93.6	Very high	88.6	Confident	0 Å²	0	53 Å²	53	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	113.8	164.7	-165.6	0	0	0	0	107.7	V607 L639 F641 V701 P707 A708 Y710	V607-V699 HydrophobicContact CG2-CG2 3.94Å; L639-V699 HydrophobicContact CB-CG1 4.17Å; L639-V699 HydrophobicContact CD2-CG1 4.24Å; F641-V699 HydrophobicContact CD1-CG1 4.34Å; F641-V699 HydrophobicContact CD1-CG2 3.65Å; F641-V699 HydrophobicContact CE1-CG1 4.29Å; F641-V699 HydrophobicContact CE1-CG2 3.59Å; F641-V699 HydrophobicContact CZ-CG1 4.42Å; F641-V699 HydrophobicContact CZ-CG2 4.42Å; V699-V701 HydrophobicContact CG1-CG2 4.43Å; V699-P707 WeakPolarHBondContact O-CA 3.4Å; V699-P707 WeakPolarHBondContact O-CB 3.35Å; V699-A708 HydrophobicContact CB-CB 4.32Å; V699-A708 PolarHBondContact N-O 3.01Å; V699-A708 PolarHBondContact O-N 3.48Å; V699-Y710 HydrophobicContact CG2-CD1 4.09Å; V699-Y710 HydrophobicContact CG2-CE1 3.65Å
700	Q	92.4	Very high	89.1	Confident	87 Å²	87	46.3 Å²	46.3	41%	0.407	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	125.9	170.8	-57.7	-62.3	-25.9	0	0	108.2	L639 T640 T698	L639-Q700 CarbonylContact C-O 3.6Å; L639-Q700 WeakPolarHBondContact CA-O 3.48Å; T640-Q700 PolarHBondContact N-O 2.87Å; T640-Q700 PolarHBondContact O-N 2.59Å; T698-Q700 PolarHBondContact OG1-NE2 3.35Å
701	V	91.3	Very high	89.5	Confident	10 Å²	10	44 Å²	44	6%	0.061	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	116.4	-177.6	-175.9	0	0	0	0	107.9	V605 F637 L639 V699 G703 Q704	V605-V701 HydrophobicContact CB-CG1 3.97Å; V605-V701 HydrophobicContact CB-CG2 4.16Å; V605-V701 HydrophobicContact CG1-CG1 4.33Å; V605-V701 HydrophobicContact CG1-CG2 3.99Å; V605-V701 HydrophobicContact CG2-CG1 3.89Å; F637-V701 HydrophobicContact CB-CG1 3.86Å; F637-V701 HydrophobicContact CD1-CG1 4.46Å; F637-V701 HydrophobicContact CD2-CG1 4.48Å; F637-V701 HydrophobicContact CG-CG1 4.06Å; L639-V701 HydrophobicContact CD2-CB 4.46Å; L639-V701 HydrophobicContact CD2-CG1 4.2Å; L639-V701 HydrophobicContact CD2-CG2 3.83Å; V699-V701 HydrophobicContact CG1-CG2 4.43Å; V701-G703 PolarHBondContact O-N 2.86Å; V701-G703 VanDerWaalsContact O-N 3.16Å; V701-Q704 HydrophobicContact CB-CB 3.87Å; V701-Q704 HydrophobicContact CG1-CB 4.14Å; V701-Q704 PolarHBondContact O-N 3.11Å
702	A	86.2	Confident	89.9	Confident	57 Å²	57	43.7 Å²	43.7	47%	0.471	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	119.6	-177.5	0	0	0	0	0	111	F637 K638	F637-A702 VanDerWaalsContact CD1-O 3.22Å; F637-A702 WeakPolarHBondContact CD1-O 3.41Å; K638-A702 HydrophobicContact CB-CB 3.93Å; K638-A702 PolarHBondContact O-N 3.38Å
703	G	78.6	Confident	90	Very high	81 Å²	81	43 Å²	43	84%	0.835	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.9	-2.8	-177	0	0	0	0	0	115.5	V701	V701-G703 PolarHBondContact O-N 2.86Å; V701-G703 VanDerWaalsContact O-N 3.16Å
704	Q	83.1	Confident	90	Very high	21 Å²	21	43.1 Å²	43.1	10%	0.098	26%	0.255	C	S	.	.			trans	-97.6	127.3	173.7	-162.4	171.3	-85.1	0	0	110.8	N603 P604 V605 V701 L706	N603-Q704 PolarHBondContact ND2-NE2 2.98Å; N603-Q704 VanDerWaalsContact ND2-NE2 3.19Å; P604-Q704 VanDerWaalsContact CD-OE1 3.23Å; P604-Q704 HydrophobicContact CG-CG 4.34Å; V605-Q704 PolarHBondContact O-NE2 3.13Å; V605-Q704 PolarHBondContact O-OE1 3Å; V701-Q704 HydrophobicContact CB-CB 3.87Å; V701-Q704 HydrophobicContact CG1-CB 4.14Å; V701-Q704 PolarHBondContact O-N 3.11Å; Q704-L706 VanDerWaalsContact C-N 3.29Å; Q704-L706 WeakPolarHBondContact CG-O 3.47Å; Q704-L706 PolarHBondContact NE2-O 2.83Å; Q704-L706 PolarHBondContact O-N 3.48Å
705	V	77	Confident	90.1	Very high	99 Å²	99	41.3 Å²	41.3	60%	0.6	25%	0.248	S	C	*	.	S	Bend	trans	-63.3	-32.8	-175.3	-178.4	0	0	0	0	113
706	L	81.1	Confident	90	Very high	66 Å²	66	41.6 Å²	41.6	35%	0.346	25%	0.25	S	C	.	.	S	Bend	trans	-121	130.5	177	-70.5	176.5	0	0	0	110.3	N603 Q704	N603-L706 PolarHBondContact ND2-O 3.02Å; Q704-L706 VanDerWaalsContact C-N 3.29Å; Q704-L706 WeakPolarHBondContact CG-O 3.47Å; Q704-L706 PolarHBondContact NE2-O 2.83Å; Q704-L706 PolarHBondContact O-N 3.48Å
707	P	88.2	Confident	89.9	Confident	32 Å²	32	38.9 Å²	38.9	21%	0.208	23%	0.231	C	C	.	.			trans	-67.1	148.1	177.2	29	-35.3	0	0	0	111.1	V699 K709	V699-P707 WeakPolarHBondContact O-CA 3.4Å; V699-P707 WeakPolarHBondContact O-CB 3.35Å; P707-K709 PolarHBondContact O-N 2.8Å
708	A	90.1	Very high	89.7	Confident	10 Å²	10	40 Å²	40	8%	0.083	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	113.7	177.2	0	0	0	0	0	109.3	V607 T698 V699	V607-A708 HydrophobicContact CG2-CB 4.25Å; T698-A708 CarbonylContact C-O 3.48Å; T698-A708 WeakPolarHBondContact CA-O 3.29Å; V699-A708 HydrophobicContact CB-CB 4.32Å; V699-A708 PolarHBondContact N-O 3.01Å; V699-A708 PolarHBondContact O-N 3.48Å
709	K	90.8	Very high	89.4	Confident	152 Å²	152	38.9 Å²	38.9	66%	0.661	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	145.3	-178	-58.6	-174.8	-179.3	-178.5	0	111	T698 P707	T698-K709 HydrophobicContact CG2-CG 4.35Å; P707-K709 PolarHBondContact O-N 2.8Å
710	Y	93.9	Very high	89.2	Confident	5 Å²	5	42 Å²	42	2%	0.02	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	152.2	170.5	64.3	-73.2	0	0	0	109.8	V607 P610 I612 I627 I653 M697 V699 I712	V607-Y710 HydrophobicContact CG2-CD1 3.92Å; V607-Y710 HydrophobicContact CG2-CG 4.26Å; P610-Y710 CarbonylContact O-C 3.5Å; P610-Y710 WeakPolarHBondContact O-CA 3.48Å; I612-Y710 HydrophobicContact CD1-CD2 3.68Å; I612-Y710 HydrophobicContact CD1-CE2 4.01Å; I612-Y710 HydrophobicContact CG1-CD2 4.41Å; I627-Y710 HydrophobicContact CD1-CE2 3.89Å; I653-Y710 WeakPolarHBondContact CD1-OH 3.26Å; M697-Y710 CarbonylContact C-O 3.41Å; M697-Y710 WeakPolarHBondContact CA-O 3.33Å; M697-Y710 HydrophobicContact CB-CD1 4.05Å; M697-Y710 HydrophobicContact CB-CD2 4.07Å; M697-Y710 HydrophobicContact CB-CE1 3.57Å; M697-Y710 HydrophobicContact CB-CE2 3.62Å; M697-Y710 HydrophobicContact CB-CG 4.27Å; M697-Y710 HydrophobicContact CG-CE2 4.17Å; M697-Y710 PolarHBondContact N-O 2.92Å; M697-Y710 PolarHBondContact O-N 2.69Å; V699-Y710 HydrophobicContact CG2-CD1 4.09Å; V699-Y710 HydrophobicContact CG2-CE1 3.65Å; Y710-I712 HydrophobicContact CD2-CG1 4.24Å; Y710-I712 HydrophobicContact CE2-CD1 4.05Å; Y710-I712 HydrophobicContact CE2-CG1 4.04Å
711	T	94.6	Very high	89.2	Confident	34 Å²	34	38.2 Å²	38.2	21%	0.209	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	145.2	175.2	48.5	0	0	0	0	110.5	P610 I612 V695 P696 H713	P610-T711 PolarHBondContact O-N 3.29Å; P610-T711 PolarHBondContact O-OG1 3.3Å; I612-T711 PolarHBondContact N-O 3.05Å; V695-T711 WeakPolarHBondContact O-CA 3.32Å; P696-T711 HydrophobicContact CB-CG2 4.49Å; T711-H713 WeakPolarHBondContact CB-NE2 3.37Å; T711-H713 PolarHBondContact OG1-NE2 2.65Å
712	I	94.6	Very high	89.3	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.2	170.9	-57	175	0	0	0	107.5	I612 L614 L651 L670 E694 V695 M697 Y710	I612-I712 HydrophobicContact CB-CG1 4.44Å; I612-I712 CarbonylContact O-C 3.56Å; I612-I712 WeakPolarHBondContact O-CA 2.93Å; L614-I712 HydrophobicContact CD1-CG2 3.78Å; L614-I712 HydrophobicContact CG-CG2 4.18Å; L651-I712 HydrophobicContact CD1-CD1 3.79Å; L670-I712 HydrophobicContact CD1-CD1 4.03Å; L670-I712 HydrophobicContact CD2-CD1 3.85Å; L670-I712 HydrophobicContact CD2-CG1 4.44Å; L670-I712 HydrophobicContact CD2-CG2 4.42Å; E694-I712 WeakPolarHBondContact CA-O 3.21Å; V695-I712 PolarHBondContact N-O 2.87Å; V695-I712 PolarHBondContact O-N 2.79Å; M697-I712 HydrophobicContact CE-CD1 4.29Å; M697-I712 HydrophobicContact CG-CD1 3.79Å; M697-I712 HydrophobicContact CG-CG1 4.11Å; Y710-I712 HydrophobicContact CD2-CG1 4.24Å; Y710-I712 HydrophobicContact CE2-CD1 4.05Å; Y710-I712 HydrophobicContact CE2-CG1 4.04Å
713	H	94.4	Very high	89.6	Confident	45 Å²	45	41.6 Å²	41.6	21%	0.208	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.6	177.8	-49.4	-88.6	0	0	0	109.8	S611 I612 L614 L693 E694 T711	S611-H713 PolarHBondContact OG-CD2 3.41Å; S611-H713 PolarHBondContact OG-NE2 2.84Å; I612-H713 PolarHBondContact O-N 2.99Å; L614-H713 PolarHBondContact N-O 3.22Å; L693-H713 VanDerWaalsContact O-CA 3.28Å; L693-H713 WeakPolarHBondContact O-CA 3.26Å; E694-H713 IonicContact OE1-CE1 2.85Å; E694-H713 PolarHBondContact OE1-CE1 2.96Å; T711-H713 WeakPolarHBondContact CB-NE2 3.37Å; T711-H713 PolarHBondContact OG1-NE2 2.65Å
714	A	94.6	Very high	90.4	Very high	3 Å²	3	40.8 Å²	40.8	3%	0.025	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	160.3	169.1	0	0	0	0	0	109.7	L614 K615 F672 L693	L614-A714 HydrophobicContact CB-CB 4.12Å; K615-A714 WeakPolarHBondContact O-CA 3.28Å; F672-A714 HydrophobicContact CE1-CB 4.13Å; L693-A714 HydrophobicContact CB-CB 4.25Å; L693-A714 HydrophobicContact CD2-CB 4.3Å; L693-A714 PolarHBondContact N-O 3.35Å; L693-A714 PolarHBondContact O-N 2.95Å
715	I	94.2	Very high	90.7	Very high	63 Å²	63	42.4 Å²	42.4	32%	0.323	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	113.9	165.5	-52.4	177.4	0	0	0	106.8	K615 I616 C617 G691 V692 I750	K615-I715 PolarHBondContact O-N 2.96Å; I616-I715 CarbonylContact C-O 3.56Å; I616-I715 VanDerWaalsContact CA-O 3.29Å; I616-I715 WeakPolarHBondContact CA-O 3.41Å; I616-I715 HydrophobicContact CG1-CB 4.28Å; C617-I715 PolarHBondContact N-O 3Å; G691-I715 CarbonylContact O-C 3.59Å; G691-I715 WeakPolarHBondContact O-CA 3.17Å; V692-I715 HydrophobicContact CG2-CG1 4.42Å; I715-I750 HydrophobicContact CB-CD1 4.42Å; I715-I750 HydrophobicContact CG2-CD1 3.51Å
716	V	92.4	Very high	91.4	Very high	7 Å²	7	45.4 Å²	45.4	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	129.8	-176.1	-167.3	0	0	0	0	110.1	C617 F619 F672 P674 L678 F686 G691 L693	C617-V716 CarbonylContact O-C 3.51Å; C617-V716 VanDerWaalsContact O-CA 3.28Å; C617-V716 WeakPolarHBondContact O-CA 3.5Å; F619-V716 HydrophobicContact CD1-CG1 3.71Å; F619-V716 HydrophobicContact CD2-CG1 4.15Å; F619-V716 HydrophobicContact CE1-CG1 3.46Å; F619-V716 VanDerWaalsContact CE1-CG1 3.46Å; F619-V716 HydrophobicContact CE2-CG1 3.92Å; F619-V716 HydrophobicContact CG-CG1 4.05Å; F619-V716 HydrophobicContact CZ-CB 4.35Å; F619-V716 HydrophobicContact CZ-CG1 3.57Å; F672-V716 HydrophobicContact CZ-CG2 4.24Å; P674-V716 HydrophobicContact CB-CG1 3.67Å; P674-V716 HydrophobicContact CB-CG2 4.15Å; P674-V716 HydrophobicContact CG-CG1 3.99Å; L678-V716 HydrophobicContact CD2-CG2 3.96Å; F686-V716 HydrophobicContact CE2-CB 3.78Å; F686-V716 HydrophobicContact CE2-CG2 3.86Å; F686-V716 HydrophobicContact CZ-CB 4.24Å; G691-V716 PolarHBondContact O-N 2.86Å; L693-V716 HydrophobicContact CB-CG2 4.46Å
717	T	90.9	Very high	92	Very high	11 Å²	11	47.3 Å²	47.3	7%	0.067	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	159.1	-178	-163.7	0	0	0	0	111.6	I616 C617 T618 F619 I750 L751	I616-T717 HydrophobicContact CG2-CG2 3.77Å; C617-T717 PolarHBondContact O-N 3.44Å; T618-T717 WeakPolarHBondContact CA-O 3.48Å; T618-T717 HydrophobicContact CG2-CG2 4.4Å; F619-T717 VanDerWaalsContact CD2-O 3.26Å; F619-T717 WeakPolarHBondContact CD2-O 3.34Å; F619-T717 PolarHBondContact N-O 3.13Å; F619-T717 VanDerWaalsContact N-O 3.11Å; T717-I750 HydrophobicContact CG2-CG1 4Å; T717-I750 PolarHBondContact OG1-N 2.78Å; T717-I750 VanDerWaalsContact OG1-N 3.13Å; T717-L751 HydrophobicContact CG2-CD1 4.49Å
718	S	88.1	Confident	92.3	Very high	26 Å²	26	45.8 Å²	45.8	18%	0.182	23%	0.23	C	C	.	.			trans	-71.1	161.2	169.3	179.3	0	0	0	0	111.1	D720 S749	S718-D720 WeakPolarHBondContact OG-CB 3.42Å; S718-D720 PolarHBondContact OG-N 2.59Å; S718-D720 PolarHBondContact OG-OD2 3.27Å; S718-S749 WeakPolarHBondContact O-CB 3.21Å
719	S	87.9	Confident	92.4	Very high	7 Å²	7	49.1 Å²	49.1	5%	0.049	25%	0.246	C	C	.	.			trans	-120.5	29.3	162.9	-58.4	0	0	0	0	111.2	T618 R807 F809	T618-S719 WeakPolarHBondContact CB-OG 3.5Å; T618-S719 WeakPolarHBondContact CG2-OG 3.5Å; S719-R807 PolarHBondContact O-NH1 2.9Å; S719-F809 WeakPolarHBondContact O-CZ 3.47Å
720	D	89.4	Confident	92.5	Very high	67 Å²	67	42.3 Å²	42.3	36%	0.358	22%	0.217	S	C	.	.			trans	-80.6	136.3	176.7	-60.3	-43.7	0	0	0	110.4	S718 M748 R807 F809	S718-D720 WeakPolarHBondContact OG-CB 3.42Å; S718-D720 PolarHBondContact OG-N 2.59Å; S718-D720 PolarHBondContact OG-OD2 3.27Å; D720-M748 WeakPolarHBondContact O-CB 3.49Å; D720-M748 PolarHBondContact O-N 3.02Å; D720-M748 VanDerWaalsContact O-N 3.17Å; D720-R807 IonicContact OD1-CZ 3.83Å; D720-R807 IonicContact OD1-NH1 3.6Å; D720-R807 PolarHBondContact OD1-NH1 2.81Å; D720-R807 IonicContact OD1-NH2 3.63Å; D720-R807 PolarHBondContact OD1-NH2 3.19Å; D720-F809 HydrophobicContact CB-CE1 4.44Å
721	L	91.8	Very high	92.2	Very high	7 Å²	7	43.4 Å²	43.4	4%	0.037	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.6	162.6	-57.9	-179.3	0	0	0	107.1	L745 T746 N747 Q753 F755 L775 F809	L721-L745 HydrophobicContact CB-CD1 3.86Å; L721-T746 WeakPolarHBondContact CA-O 3.32Å; L721-N747 HydrophobicContact CD2-CB 4Å; L721-Q753 HydrophobicContact CD2-CB 4.22Å; L721-F755 HydrophobicContact CD1-CB 3.87Å; L721-L775 HydrophobicContact CD2-CD1 4.13Å; L721-F809 HydrophobicContact CB-CD1 4.28Å; L721-F809 HydrophobicContact CB-CD2 4.03Å; L721-F809 HydrophobicContact CB-CE1 4.28Å; L721-F809 HydrophobicContact CB-CE2 4.02Å; L721-F809 HydrophobicContact CB-CG 4.16Å; L721-F809 HydrophobicContact CB-CZ 4.16Å; L721-F809 HydrophobicContact CD1-CD2 4.11Å; L721-F809 HydrophobicContact CD1-CE2 4.06Å; L721-F809 HydrophobicContact CG-CD2 4.23Å; L721-F809 HydrophobicContact CG-CE2 3.9Å; L721-F809 HydrophobicContact CG-CZ 4.24Å; L721-F809 VanDerWaalsContact N-CE1 3.27Å; L721-F809 WeakPolarHBondContact O-CD1 3.24Å
722	Q	92.7	Very high	91.7	Very high	109 Å²	109	48.6 Å²	48.6	51%	0.509	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.6	-175.5	-179.7	167.9	-7.3	0	0	111	L745 T746 M748	Q722-L745 WeakPolarHBondContact O-CA 2.77Å; Q722-T746 PolarHBondContact N-O 3.04Å; Q722-T746 PolarHBondContact O-N 3.46Å; Q722-M748 HydrophobicContact CB-CG 4.07Å; Q722-M748 HydrophobicContact CB-SD 4.29Å
723	F	93.7	Very high	91.3	Very high	29 Å²	29	48.7 Å²	48.7	13%	0.127	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	143.6	164.3	-66.9	-70.3	0	0	0	110.4	Q725 V743 R744 L745 F757 C801 F809 L811	F723-Q725 WeakPolarHBondContact CB-O 3.43Å; F723-Q725 PolarHBondContact O-N 2.92Å; F723-V743 HydrophobicContact CD1-CG1 3.87Å; F723-R744 WeakPolarHBondContact CA-O 3.16Å; F723-L745 HydrophobicContact CD1-CB 4.43Å; F723-L745 HydrophobicContact CD1-CD1 3.86Å; F723-L745 HydrophobicContact CE1-CB 4.34Å; F723-L745 HydrophobicContact CE1-CD1 3.68Å; F723-L745 HydrophobicContact CE1-CD2 4.49Å; F723-L745 HydrophobicContact CE1-CG 4.39Å; F723-L745 HydrophobicContact CE2-CD1 4.45Å; F723-L745 HydrophobicContact CG-CD1 4.34Å; F723-L745 HydrophobicContact CZ-CD1 4Å; F723-F757 AromaticContact CE1-CZ 3.87Å; F723-F757 HydrophobicContact CE1-CZ 3.87Å; F723-F757 HydrophobicContact CZ-CE1 4.2Å; F723-F757 AromaticContact CZ-CZ 3.81Å; F723-F757 HydrophobicContact CZ-CZ 3.81Å; F723-C801 HydrophobicContact CE2-CB 4.46Å; F723-C801 HydrophobicContact CZ-CB 3.87Å; F723-F809 HydrophobicContact CE2-CB 4.07Å; F723-L811 HydrophobicContact CB-CD1 4.41Å; F723-L811 HydrophobicContact CD1-CD2 4.05Å; F723-L811 HydrophobicContact CD2-CB 4.18Å; F723-L811 HydrophobicContact CD2-CD1 4.39Å; F723-L811 HydrophobicContact CE1-CD2 4.04Å; F723-L811 HydrophobicContact CE2-CB 3.94Å; F723-L811 HydrophobicContact CG-CD1 4.26Å; F723-L811 HydrophobicContact CG-CD2 4.4Å; F723-L811 HydrophobicContact CZ-CB 4.17Å; F723-L811 HydrophobicContact CZ-CD2 4.38Å
724	D	93.9	Very high	90.8	Very high	63 Å²	63	47.5 Å²	47.5	34%	0.337	25%	0.248	S	C	.	.	S	Bend	trans	-75.4	-14.5	172.7	77.8	-33.6	0	0	0	113.8	V743 R744	D724-V743 WeakPolarHBondContact OD1-CG1 3.32Å; D724-R744 HydrophobicContact CB-CB 4.04Å; D724-R744 PolarHBondContact N-O 3.46Å; D724-R744 PolarHBondContact OD1-N 3.39Å; D724-R744 IonicContact OD2-CZ 2.66Å; D724-R744 IonicContact OD2-NE 2.81Å; D724-R744 PolarHBondContact OD2-NE 3.46Å; D724-R744 IonicContact OD2-NH2 2.63Å; D724-R744 PolarHBondContact OD2-NH2 2.99Å
725	Q	90.8	Very high	90.3	Very high	56 Å²	56	49.3 Å²	49.3	26%	0.262	26%	0.257	S	S	.	.			trans	-120.2	134.9	178.3	-70.8	162.8	63.5	0	0	110.4	F723 T742 V743 L811	F723-Q725 WeakPolarHBondContact CB-O 3.43Å; F723-Q725 PolarHBondContact O-N 2.92Å; Q725-T742 PolarHBondContact NE2-O 2.88Å; Q725-T742 VanDerWaalsContact NE2-O 3.07Å; Q725-V743 HydrophobicContact CB-CG1 4.43Å; Q725-L811 VanDerWaalsContact O-CD1 3.3Å; Q725-L811 WeakPolarHBondContact O-CD1 3.2Å
726	I	91.3	Very high	89.8	Confident	162 Å²	162	53.3 Å²	53.3	83%	0.831	27%	0.269	S	S	*	.	S	Bend	trans	-79.8	-27.7	177.8	-57.8	173.9	0	0	0	111.2	P812	I726-P812 WeakPolarHBondContact O-CD 3.28Å
727	Q	93.9	Very high	89.4	Confident	106 Å²	106	58.7 Å²	58.7	50%	0.495	29%	0.294	S	S	.	.			trans	-151.5	146.1	176.4	175.4	173.2	12	0	0	108.9	P812	Q727-P812 WeakPolarHBondContact CA-O 3.49Å; Q727-P812 HydrophobicContact CB-CB 4.36Å; Q727-P812 HydrophobicContact CG-CB 4.18Å
728	V	94.3	Very high	89.3	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.3	172.4	-176.1	0	0	0	0	109.7	F730 T741 V743 L785 L811 P812 C813 R814	V728-F730 HydrophobicContact CG1-CD1 4.3Å; V728-F730 HydrophobicContact CG1-CE1 3.86Å; V728-F730 HydrophobicContact CG1-CE2 4.06Å; V728-F730 HydrophobicContact CG1-CZ 3.71Å; V728-T741 HydrophobicContact CG1-CG2 3.94Å; V728-V743 HydrophobicContact CG2-CG2 3.7Å; V728-L785 HydrophobicContact CG1-CD1 4.47Å; V728-L785 HydrophobicContact CG2-CD1 4.02Å; V728-L811 HydrophobicContact CG2-CD1 4.14Å; V728-L811 HydrophobicContact CG2-CD2 3.88Å; V728-L811 HydrophobicContact CG2-CG 4.08Å; V728-P812 PolarHBondContact N-O 3.42Å; V728-C813 CarbonylContact O-C 3.33Å; V728-C813 WeakPolarHBondContact O-CA 3.39Å; V728-R814 PolarHBondContact O-N 3.25Å
729	D	93.3	Very high	89.5	Confident	80 Å²	80	63.5 Å²	63.5	43%	0.428	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.1	167.6	-160	-32.2	0	0	0	109.2	G731 R814	D729-G731 VanDerWaalsContact C-N 3.33Å; D729-G731 WeakPolarHBondContact OD1-CA 3.16Å; D729-G731 PolarHBondContact OD1-N 3.05Å; D729-R814 CarbonylContact C-O 3.53Å; D729-R814 WeakPolarHBondContact CA-O 3.46Å; D729-R814 IonicContact OD2-NH1 3.65Å
730	F	91.9	Very high	89.8	Confident	9 Å²	9	69.5 Å²	69.5	4%	0.039	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-4.3	177.1	-60.3	-74.2	0	0	0	112.8	V728 V739 T741 I764 L785 F787 F797 C813 R814	V728-F730 HydrophobicContact CG1-CD1 4.3Å; V728-F730 HydrophobicContact CG1-CE1 3.86Å; V728-F730 HydrophobicContact CG1-CE2 4.06Å; V728-F730 HydrophobicContact CG1-CZ 3.71Å; F730-V739 HydrophobicContact CB-CB 4.48Å; F730-V739 HydrophobicContact CB-CG1 4.26Å; F730-V739 HydrophobicContact CD1-CG1 4.19Å; F730-T741 WeakPolarHBondContact CD1-OG1 3.49Å; F730-I764 HydrophobicContact CE2-CD1 3.74Å; F730-I764 HydrophobicContact CZ-CD1 3.72Å; F730-L785 HydrophobicContact CE1-CB 3.84Å; F730-L785 HydrophobicContact CZ-CB 3.76Å; F730-L785 HydrophobicContact CZ-CD1 4.24Å; F730-F787 HydrophobicContact CB-CB 4.1Å; F730-F787 HydrophobicContact CB-CD1 3.6Å; F730-F787 HydrophobicContact CB-CE1 4.29Å; F730-F787 HydrophobicContact CB-CG 4.07Å; F730-F787 HydrophobicContact CD1-CB 3.67Å; F730-F787 HydrophobicContact CD1-CG 4.47Å; F730-F787 HydrophobicContact CD2-CB 3.87Å; F730-F787 HydrophobicContact CD2-CD1 4.27Å; F730-F787 HydrophobicContact CD2-CD2 4.39Å; F730-F787 AromaticContact CD2-CG 3.95Å; F730-F787 HydrophobicContact CD2-CG 3.95Å; F730-F787 HydrophobicContact CE1-CB 4.02Å; F730-F787 HydrophobicContact CE2-CB 4.23Å; F730-F787 HydrophobicContact CG-CB 3.6Å; F730-F787 AromaticContact CG-CD1 3.99Å; F730-F787 HydrophobicContact CG-CD1 3.99Å; F730-F787 AromaticContact CG-CG 3.91Å; F730-F787 HydrophobicContact CG-CG 3.91Å; F730-F787 HydrophobicContact CZ-CB 4.3Å; F730-F797 HydrophobicContact CE2-CZ 4.02Å; F730-C813 HydrophobicContact CE2-CB 4.16Å; F730-R814 VanDerWaalsContact CD2-O 3.23Å; F730-R814 WeakPolarHBondContact CD2-O 3.45Å; F730-R814 PolarHBondContact N-O 3.17Å
731	G	88.6	Confident	90	Very high	28 Å²	28	67.8 Å²	67.8	29%	0.289	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.5	-145.7	-178.9	0	0	0	0	0	113.1	D729 V816	D729-G731 VanDerWaalsContact C-N 3.33Å; D729-G731 WeakPolarHBondContact OD1-CA 3.16Å; D729-G731 PolarHBondContact OD1-N 3.05Å; G731-V816 PolarHBondContact O-N 3.5Å
732	H	83.3	Confident	90.2	Very high	142 Å²	142	70.2 Å²	70.2	66%	0.657	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.2	-179.7	-63.7	-72.2	0	0	0	111.6	V816 F818	H732-V816 WeakPolarHBondContact CA-O 3.47Å; H732-F818 HydrophobicContact CB-CD1 4.04Å; H732-F818 HydrophobicContact CB-CE1 3.98Å
733	C	86.3	Confident	90.3	Very high	2 Å²	2	65.1 Å²	65.1	1%	0.014	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.1	178.4	-175.3	0	0	0	0	111.3	V739 F787 P789 V816 G817 F818	C733-V739 HydrophobicContact CB-CG2 3.78Å; C733-F787 HydrophobicContact CB-CD1 3.88Å; C733-F787 HydrophobicContact CB-CE1 3.89Å; C733-P789 HydrophobicContact CB-CG 3.9Å; C733-P789 VanDerWaalsContact SG-CD 3.55Å; C733-V816 PolarHBondContact N-O 2.94Å; C733-G817 CarbonylContact O-C 3.58Å; C733-G817 WeakPolarHBondContact O-CA 3.15Å; C733-F818 VanDerWaalsContact C-CD1 3.45Å; C733-F818 VanDerWaalsContact C-CE1 3.44Å; C733-F818 VanDerWaalsContact O-CD1 3.23Å; C733-F818 WeakPolarHBondContact O-CD1 3.18Å; C733-F818 PolarHBondContact O-N 3.48Å
734	S	82.6	Confident	90.3	Very high	21 Å²	21	69.3 Å²	69.3	15%	0.147	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139.6	173.7	169	0	0	0	0	110.4	Y736 H737 F818 P820	S734-Y736 PolarHBondContact O-N 3.48Å; S734-Y736 PolarHBondContact OG-N 3.07Å; S734-H737 PolarHBondContact O-N 3.14Å; S734-F818 WeakPolarHBondContact CA-O 3.39Å; S734-P820 WeakPolarHBondContact OG-CD 3.42Å
735	I	85.9	Confident	90.3	Very high	41 Å²	41	66.3 Å²	66.3	21%	0.21	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-11.8	176.2	67.2	167.7	0	0	0	114.6	P789 P792 F818 H819	I735-P789 VanDerWaalsContact CA-O 3.31Å; I735-P789 WeakPolarHBondContact CA-O 3.39Å; I735-P789 WeakPolarHBondContact CB-O 3.32Å; I735-P789 WeakPolarHBondContact CG2-O 3.42Å; I735-P792 HydrophobicContact CG2-CB 4.49Å; I735-F818 PolarHBondContact N-O 3.2Å; I735-H819 WeakPolarHBondContact CD1-ND1 3.34Å
736	Y	82	Confident	90.5	Very high	147 Å²	147	65 Å²	65	58%	0.576	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	4.4	174.6	-56.1	-64.7	0	0	0	113.4	S734 H819 P820	S734-Y736 PolarHBondContact O-N 3.48Å; S734-Y736 PolarHBondContact OG-N 3.07Å; Y736-H819 AromaticContact CE2-CE1 3.93Å; Y736-H819 AromaticContact CE2-NE2 3.89Å; Y736-H819 AromaticContact CZ-CE1 3.9Å; Y736-H819 PolarHBondContact OH-CE1 3.29Å; Y736-P820 HydrophobicContact CD2-CG 3.64Å; Y736-P820 HydrophobicContact CE2-CG 3.98Å
737	H	84.2	Confident	90.6	Very high	120 Å²	120	57.3 Å²	57.3	56%	0.556	28%	0.275	S	S	*	.	S	Bend	trans	-129.7	-174.9	-178	-155	55	0	0	0	110.8	S734	S734-H737 PolarHBondContact O-N 3.14Å
738	F	90.1	Very high	90.4	Very high	97 Å²	97	55.7 Å²	55.7	43%	0.425	27%	0.268	S	S	.	.			trans	-136.6	152.2	172.6	61.5	-93.5	0	0	0	110.2	I786 F787 R788	F738-I786 HydrophobicContact CB-CG2 3.91Å; F738-I786 HydrophobicContact CD2-CG2 3.72Å; F738-I786 HydrophobicContact CG-CG2 4.03Å; F738-F787 CarbonylContact C-O 3.55Å; F738-F787 WeakPolarHBondContact CA-O 3.47Å; F738-F787 WeakPolarHBondContact CB-O 3.22Å; F738-R788 HydrophobicContact CB-CG 3.77Å
739	V	92.3	Very high	90.2	Very high	41 Å²	41	55.7 Å²	55.7	25%	0.248	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.3	165.9	170.7	0	0	0	0	107.7	F730 C733 I786 F787	F730-V739 HydrophobicContact CB-CB 4.48Å; F730-V739 HydrophobicContact CB-CG1 4.26Å; F730-V739 HydrophobicContact CD1-CG1 4.19Å; C733-V739 HydrophobicContact CB-CG2 3.78Å; V739-I786 CarbonylContact O-C 3.57Å; V739-I786 WeakPolarHBondContact O-CA 3.48Å; V739-F787 PolarHBondContact N-O 2.94Å; V739-F787 PolarHBondContact O-N 3.39Å
740	R	93.2	Very high	90	Very high	132 Å²	132	55.3 Å²	55.3	50%	0.498	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.4	175.3	169.9	174.9	159.4	151.9	-8.3	108.5	D784 L785 I786	R740-D784 HydrophobicContact CG-CB 4.24Å; R740-D784 IonicContact CZ-OD1 3.38Å; R740-D784 IonicContact CZ-OD2 2.84Å; R740-D784 IonicContact NE-OD1 2.71Å; R740-D784 PolarHBondContact NE-OD1 3.32Å; R740-D784 IonicContact NE-OD2 3.09Å; R740-D784 IonicContact NH1-OD1 2.64Å; R740-D784 IonicContact NH1-OD2 2.63Å; R740-D784 PolarHBondContact NH1-OD2 3.41Å; R740-D784 IonicContact NH2-OD1 3.3Å; R740-D784 PolarHBondContact NH2-OD1 3.38Å; R740-D784 IonicContact NH2-OD2 3.36Å; R740-D784 PolarHBondContact NH2-OD2 2.94Å; R740-L785 WeakPolarHBondContact CA-O 3.44Å; R740-I786 HydrophobicContact CB-CG1 4.35Å; R740-I786 HydrophobicContact CG-CG1 4.32Å
741	T	94.1	Very high	90	Very high	32 Å²	32	57.5 Å²	57.5	20%	0.196	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126.4	173.8	-54.2	0	0	0	0	108.8	V728 F730 L785	V728-T741 HydrophobicContact CG1-CG2 3.94Å; F730-T741 WeakPolarHBondContact CD1-OG1 3.49Å; T741-L785 PolarHBondContact N-O 2.98Å; T741-L785 PolarHBondContact O-N 2.85Å
742	T	95	Very high	90.2	Very high	58 Å²	58	59.9 Å²	59.9	36%	0.356	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.8	178.5	-47.7	0	0	0	0	110.1	Q725 E782 L783 D784	Q725-T742 PolarHBondContact NE2-O 2.88Å; Q725-T742 VanDerWaalsContact NE2-O 3.07Å; T742-E782 HydrophobicContact CG2-CB 3.93Å; T742-E782 HydrophobicContact CG2-CG 4.28Å; T742-L783 CarbonylContact C-O 3.47Å; T742-L783 WeakPolarHBondContact CA-O 3.38Å; T742-D784 PolarHBondContact OG1-OD1 3.06Å
743	V	94.8	Very high	90.6	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.5	178.2	-175.6	0	0	0	0	108	F723 D724 Q725 V728 L783 L785 L811	F723-V743 HydrophobicContact CD1-CG1 3.87Å; D724-V743 WeakPolarHBondContact OD1-CG1 3.32Å; Q725-V743 HydrophobicContact CB-CG1 4.43Å; V728-V743 HydrophobicContact CG2-CG2 3.7Å; V743-L783 PolarHBondContact N-O 3.18Å; V743-L783 PolarHBondContact O-N 3.28Å; V743-L785 HydrophobicContact CG2-CD1 3.69Å; V743-L785 HydrophobicContact CG2-CG 4.21Å; V743-L811 HydrophobicContact CG1-CD2 4.13Å; V743-L811 HydrophobicContact CG2-CD2 4.42Å
744	R	94.7	Very high	90.9	Very high	116 Å²	116	57.6 Å²	57.6	44%	0.438	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.7	177.4	-73	172.6	-59.9	158.4	7.8	110.7	F723 D724 T780 L781 E782	F723-R744 WeakPolarHBondContact CA-O 3.16Å; D724-R744 HydrophobicContact CB-CB 4.04Å; D724-R744 PolarHBondContact N-O 3.46Å; D724-R744 PolarHBondContact OD1-N 3.39Å; D724-R744 IonicContact OD2-CZ 2.66Å; D724-R744 IonicContact OD2-NE 2.81Å; D724-R744 PolarHBondContact OD2-NE 3.46Å; D724-R744 IonicContact OD2-NH2 2.63Å; D724-R744 PolarHBondContact OD2-NH2 2.99Å; R744-T780 HydrophobicContact CB-CG2 3.66Å; R744-T780 HydrophobicContact CG-CG2 3.98Å; R744-L781 WeakPolarHBondContact CA-O 3.44Å; R744-E782 HydrophobicContact CG-CG 3.74Å
745	L	94.5	Very high	91.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.2	174.9	-178.1	61.9	0	0	0	109.2	L721 Q722 F723 F755 L775 T780 L781 L783	L721-L745 HydrophobicContact CB-CD1 3.86Å; Q722-L745 WeakPolarHBondContact O-CA 2.77Å; F723-L745 HydrophobicContact CD1-CB 4.43Å; F723-L745 HydrophobicContact CD1-CD1 3.86Å; F723-L745 HydrophobicContact CE1-CB 4.34Å; F723-L745 HydrophobicContact CE1-CD1 3.68Å; F723-L745 HydrophobicContact CE1-CD2 4.49Å; F723-L745 HydrophobicContact CE1-CG 4.39Å; F723-L745 HydrophobicContact CE2-CD1 4.45Å; F723-L745 HydrophobicContact CG-CD1 4.34Å; F723-L745 HydrophobicContact CZ-CD1 4Å; L745-F755 HydrophobicContact CD2-CD2 3.82Å; L745-F755 HydrophobicContact CD2-CE2 4.18Å; L745-F755 HydrophobicContact CD2-CG 4.03Å; L745-L775 HydrophobicContact CD2-CD1 4.01Å; L745-L775 HydrophobicContact CG-CD1 3.89Å; L745-T780 WeakPolarHBondContact O-CA 3.38Å; L745-L781 PolarHBondContact N-O 3.11Å; L745-L781 PolarHBondContact O-N 3.31Å; L745-L783 HydrophobicContact CB-CD1 3.75Å; L745-L783 HydrophobicContact CD2-CD1 3.89Å; L745-L783 HydrophobicContact CG-CD1 4.47Å
746	T	94.6	Very high	91.8	Very high	30 Å²	30	55.5 Å²	55.5	18%	0.184	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	132.4	-176.3	-55.2	0	0	0	0	111.1	L721 Q722 M748 E779 T780	L721-T746 WeakPolarHBondContact CA-O 3.32Å; Q722-T746 PolarHBondContact N-O 3.04Å; Q722-T746 PolarHBondContact O-N 3.46Å; T746-M748 HydrophobicContact CG2-SD 3.82Å; T746-E779 WeakPolarHBondContact CA-O 3.41Å; T746-T780 WeakPolarHBondContact CG2-OG1 3.42Å; T746-T780 WeakPolarHBondContact OG1-CG2 3.47Å; T746-T780 PolarHBondContact OG1-OG1 3.42Å
747	N	93.7	Very high	92.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	105.2	172.9	172.1	13.7	0	0	0	110.7	L721 S749 L751 Q753 L775 L776 Q778 E779	L721-N747 HydrophobicContact CD2-CB 4Å; N747-S749 PolarHBondContact O-N 3.42Å; N747-S749 WeakPolarHBondContact OD1-CB 3.43Å; N747-S749 PolarHBondContact OD1-N 3.44Å; N747-S749 PolarHBondContact OD1-OG 3.47Å; N747-L751 PolarHBondContact ND2-O 3.29Å; N747-Q753 PolarHBondContact OD1-NE2 3.48Å; N747-L775 HydrophobicContact CB-CB 3.68Å; N747-L775 HydrophobicContact CB-CD1 4.15Å; N747-L775 HydrophobicContact CB-CG 4.44Å; N747-L775 PolarHBondContact ND2-O 2.62Å; N747-L776 PolarHBondContact ND2-O 3.15Å; N747-Q778 VanDerWaalsContact O-CA 3.25Å; N747-Q778 WeakPolarHBondContact O-CA 3.27Å; N747-Q778 PolarHBondContact O-N 2.97Å; N747-E779 PolarHBondContact N-O 2.97Å
748	M	89.8	Confident	92.6	Very high	71 Å²	71	46.1 Å²	46.1	35%	0.35	23%	0.234	S	C	.	.			trans	-75.9	0.4	-176.9	-57.9	-55.3	-64	0	0	114.1	D720 Q722 T746 Q778	D720-M748 WeakPolarHBondContact O-CB 3.49Å; D720-M748 PolarHBondContact O-N 3.02Å; D720-M748 VanDerWaalsContact O-N 3.17Å; Q722-M748 HydrophobicContact CB-CG 4.07Å; Q722-M748 HydrophobicContact CB-SD 4.29Å; T746-M748 HydrophobicContact CG2-SD 3.82Å; M748-Q778 VanDerWaalsContact C-NE2 3.26Å; M748-Q778 PolarHBondContact O-NE2 3.01Å
749	S	89.6	Confident	92.5	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.007	25%	0.246	C	C	.	.	S	Bend	trans	-94.9	164.3	-177.5	82.9	0	0	0	0	113.5	S718 N747 L751 Q753 P777 Q778	S718-S749 WeakPolarHBondContact O-CB 3.21Å; N747-S749 PolarHBondContact O-N 3.42Å; N747-S749 WeakPolarHBondContact OD1-CB 3.43Å; N747-S749 PolarHBondContact OD1-N 3.44Å; N747-S749 PolarHBondContact OD1-OG 3.47Å; S749-L751 PolarHBondContact OG-N 3.1Å; S749-L751 VanDerWaalsContact OG-N 3.14Å; S749-L751 PolarHBondContact OG-O 3.49Å; S749-Q753 PolarHBondContact OG-NE2 3.09Å; S749-P777 WeakPolarHBondContact O-CA 3.48Å; S749-Q778 PolarHBondContact O-N 3.11Å; S749-Q778 PolarHBondContact O-NE2 3.2Å
750	I	89.4	Confident	92.5	Very high	71 Å²	71	45.5 Å²	45.5	36%	0.364	25%	0.247	S	C	.	.	S	Bend	trans	-85.9	9.7	168.8	69.5	177	0	0	0	113.3	I616 I715 T717 P777	I616-I750 HydrophobicContact CD1-CD1 4Å; I616-I750 HydrophobicContact CD1-CG1 4.27Å; I616-I750 HydrophobicContact CG1-CD1 4.14Å; I616-I750 HydrophobicContact CG2-CD1 3.9Å; I616-I750 HydrophobicContact CG2-CG1 3.92Å; I715-I750 HydrophobicContact CB-CD1 4.42Å; I715-I750 HydrophobicContact CG2-CD1 3.51Å; T717-I750 HydrophobicContact CG2-CG1 4Å; T717-I750 PolarHBondContact OG1-N 2.78Å; T717-I750 VanDerWaalsContact OG1-N 3.13Å; I750-P777 WeakPolarHBondContact O-CG 3.48Å
751	L	91	Very high	92.5	Very high	55 Å²	55	40.6 Å²	40.6	29%	0.288	23%	0.232	S	C	.	.	S	Bend	trans	-116.7	150	-178.4	-66.2	176.7	0	0	0	110.7	I616 T618 T717 N747 S749 Q753	I616-L751 HydrophobicContact CB-CD2 4.19Å; I616-L751 HydrophobicContact CD1-CD2 3.67Å; I616-L751 HydrophobicContact CG2-CD1 3.87Å; I616-L751 HydrophobicContact CG2-CD2 3.95Å; I616-L751 HydrophobicContact CG2-CG 3.89Å; T618-L751 HydrophobicContact CG2-CD1 4.3Å; T717-L751 HydrophobicContact CG2-CD1 4.49Å; N747-L751 PolarHBondContact ND2-O 3.29Å; S749-L751 PolarHBondContact OG-N 3.1Å; S749-L751 VanDerWaalsContact OG-N 3.14Å; S749-L751 PolarHBondContact OG-O 3.49Å; L751-Q753 PolarHBondContact O-N 3.12Å
752	P	92.3	Very high	92.4	Very high	79 Å²	79	46.5 Å²	46.5	51%	0.513	26%	0.257	S	S	.	.			trans	-60.1	134.9	163	-18.9	31.8	0	0	0	110	T774 L775	P752-T774 HydrophobicContact CB-CG2 4.09Å; P752-L775 CarbonylContact C-O 3.5Å; P752-L775 VanDerWaalsContact CA-O 3.25Å; P752-L775 WeakPolarHBondContact CA-O 3.38Å
753	Q	92.3	Very high	92.2	Very high	7 Å²	7	46.3 Å²	46.3	3%	0.033	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.9	175.1	-72.7	-164.9	67.3	0	0	110.4	L721 N747 S749 L751 T774 L775	L721-Q753 HydrophobicContact CD2-CB 4.22Å; N747-Q753 PolarHBondContact OD1-NE2 3.48Å; S749-Q753 PolarHBondContact OG-NE2 3.09Å; L751-Q753 PolarHBondContact O-N 3.12Å; Q753-T774 WeakPolarHBondContact O-CA 3.2Å; Q753-L775 PolarHBondContact N-O 2.76Å; Q753-L775 PolarHBondContact O-N 2.8Å
754	D	93.3	Very high	92.2	Very high	89 Å²	89	46.8 Å²	46.8	48%	0.476	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	143.4	165	-59.9	-42.5	0	0	0	109.9	G773 T774 S803 G804	D754-G773 CarbonylContact C-O 3.57Å; D754-G773 WeakPolarHBondContact CA-O 3.44Å; D754-T774 WeakPolarHBondContact OD1-CB 3.34Å; D754-T774 VanDerWaalsContact OD1-CG2 3.31Å; D754-T774 WeakPolarHBondContact OD1-CG2 3.4Å; D754-T774 PolarHBondContact OD1-OG1 2.89Å; D754-S803 CarbonylContact O-C 3.54Å; D754-S803 VanDerWaalsContact O-CA 3.26Å; D754-S803 WeakPolarHBondContact O-CA 3.42Å; D754-G804 PolarHBondContact O-N 2.88Å
755	F	94.1	Very high	92.1	Very high	11 Å²	11	44 Å²	44	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	152.8	174.6	78.3	-86.9	0	0	0	110.6	L721 L745 F757 G771 F772 G773 L775 L781 L783 K802	L721-F755 HydrophobicContact CD1-CB 3.87Å; L745-F755 HydrophobicContact CD2-CD2 3.82Å; L745-F755 HydrophobicContact CD2-CE2 4.18Å; L745-F755 HydrophobicContact CD2-CG 4.03Å; F755-F757 HydrophobicContact CD2-CD2 4.47Å; F755-F757 HydrophobicContact CD2-CE2 4.37Å; F755-F757 HydrophobicContact CE2-CD2 4.48Å; F755-F757 HydrophobicContact CE2-CE2 4.34Å; F755-G771 WeakPolarHBondContact CE2-O 3.34Å; F755-F772 WeakPolarHBondContact O-CA 3.25Å; F755-G773 WeakPolarHBondContact CD1-O 3.48Å; F755-G773 PolarHBondContact N-O 2.87Å; F755-G773 PolarHBondContact O-N 2.85Å; F755-L775 HydrophobicContact CD1-CD1 3.88Å; F755-L775 HydrophobicContact CD1-CG 3.84Å; F755-L775 HydrophobicContact CE1-CD1 4.28Å; F755-L775 HydrophobicContact CE1-CG 3.94Å; F755-L775 HydrophobicContact CG-CD1 4.5Å; F755-L781 HydrophobicContact CE1-CD2 3.88Å; F755-L781 HydrophobicContact CZ-CD2 3.51Å; F755-L783 HydrophobicContact CE2-CD1 4.48Å; F755-L783 HydrophobicContact CE2-CD2 4.27Å; F755-L783 HydrophobicContact CZ-CD2 4.32Å; F755-K802 CarbonylContact C-O 3.47Å; F755-K802 WeakPolarHBondContact CA-O 3.45Å
756	G	93.5	Very high	92.1	Very high	6 Å²	6	44 Å²	44	6%	0.062	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	130.2	179.3	0	0	0	0	0	112.3	V758 G771 F772 K802	G756-V758 PolarHBondContact O-N 3.27Å; G756-G771 CarbonylContact C-O 3.49Å; G756-G771 WeakPolarHBondContact CA-O 3.26Å; G756-F772 VanDerWaalsContact CA-CD1 3.42Å; G756-K802 PolarHBondContact N-O 3.22Å; G756-K802 PolarHBondContact O-N 2.92Å
757	F	93.7	Very high	92	Very high	5 Å²	5	45.7 Å²	45.7	2%	0.022	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	118.2	172.3	-78.5	-98.3	0	0	0	110.6	F723 F755 V760 V766 G771 F772 L783 L799 R800 C801	F723-F757 AromaticContact CE1-CZ 3.87Å; F723-F757 HydrophobicContact CE1-CZ 3.87Å; F723-F757 HydrophobicContact CZ-CE1 4.2Å; F723-F757 AromaticContact CZ-CZ 3.81Å; F723-F757 HydrophobicContact CZ-CZ 3.81Å; F755-F757 HydrophobicContact CD2-CD2 4.47Å; F755-F757 HydrophobicContact CD2-CE2 4.37Å; F755-F757 HydrophobicContact CE2-CD2 4.48Å; F755-F757 HydrophobicContact CE2-CE2 4.34Å; F757-V760 HydrophobicContact CB-CG2 3.64Å; F757-V766 HydrophobicContact CD2-CG1 4.21Å; F757-V766 HydrophobicContact CE2-CG1 4.36Å; F757-V766 HydrophobicContact CG-CG2 4.39Å; F757-G771 WeakPolarHBondContact CD2-O 3.42Å; F757-G771 PolarHBondContact N-O 3.17Å; F757-F772 WeakPolarHBondContact O-CZ 3.41Å; F757-L783 HydrophobicContact CE2-CD1 3.65Å; F757-L783 HydrophobicContact CZ-CD1 3.99Å; F757-L799 HydrophobicContact CD1-CB 3.97Å; F757-L799 HydrophobicContact CE1-CB 3.92Å; F757-L799 HydrophobicContact CE1-CD1 4.37Å; F757-R800 WeakPolarHBondContact CA-O 3.48Å; F757-C801 HydrophobicContact CD1-CB 4.19Å; F757-C801 HydrophobicContact CD2-CB 4.33Å; F757-C801 HydrophobicContact CE1-CB 3.91Å; F757-C801 HydrophobicContact CE2-CB 4.04Å; F757-C801 HydrophobicContact CG-CB 4.41Å; F757-C801 HydrophobicContact CZ-CB 3.84Å
758	V	89.6	Confident	91.7	Very high	66 Å²	66	47.8 Å²	47.8	40%	0.4	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	135.5	-173.4	-179.1	0	0	0	0	110.7	G756 R800 K802	G756-V758 PolarHBondContact O-N 3.27Å; V758-R800 PolarHBondContact N-O 3.19Å; V758-K802 HydrophobicContact CG2-CB 4.31Å; V758-K802 HydrophobicContact CG2-CD 4.12Å; V758-K802 HydrophobicContact CG2-CG 4.34Å
759	A	87.9	Confident	91.6	Very high	80 Å²	80	53.4 Å²	53.4	66%	0.661	28%	0.283	S	S	*	.	S	Bend	trans	57.5	44.3	-175.2	0	0	0	0	0	113.7
760	V	92.2	Very high	91.5	Very high	45 Å²	45	58.4 Å²	58.4	27%	0.273	31%	0.309	S	S	.	.			trans	-59.7	129.1	169.9	-177.1	0	0	0	0	109.6	F757 I764 V766 L799	F757-V760 HydrophobicContact CB-CG2 3.64Å; V760-I764 HydrophobicContact CG1-CB 3.88Å; V760-I764 HydrophobicContact CG1-CG2 3.71Å; V760-V766 HydrophobicContact CG1-CG2 4.43Å; V760-V766 HydrophobicContact CG2-CG2 4.4Å; V760-L799 HydrophobicContact CG1-CD2 4.25Å
761	P	92.9	Very high	91.4	Very high	28 Å²	28	55 Å²	55	18%	0.182	29%	0.292	C	S	.	.			trans	-68.8	147.6	177.3	-19.4	32.2	0	0	0	112.6	Y763 I764 F797	P761-Y763 HydrophobicContact CB-CD1 3.96Å; P761-Y763 HydrophobicContact CB-CD2 4.14Å; P761-Y763 HydrophobicContact CB-CE1 3.48Å; P761-Y763 VanDerWaalsContact CB-CE1 3.48Å; P761-Y763 HydrophobicContact CB-CE2 3.66Å; P761-Y763 HydrophobicContact CB-CG 4.27Å; P761-Y763 HydrophobicContact CG-CE1 4.46Å; P761-Y763 HydrophobicContact CG-CE2 4.08Å; P761-Y763 PolarHBondContact O-N 3.33Å; P761-I764 PolarHBondContact O-N 3.04Å; P761-F797 HydrophobicContact CG-CD2 3.98Å; P761-F797 HydrophobicContact CG-CE2 4.49Å
762	E	90.8	Very high	91.5	Very high	157 Å²	157	57.3 Å²	57.3	73%	0.734	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-4.2	-177.2	-47.5	-179.1	165.4	0	0	116.6	K790	E762-K790 VanDerWaalsContact CB-NZ 3.34Å; E762-K790 WeakPolarHBondContact O-CE 3.39Å; E762-K790 IonicContact OE2-NZ 2.65Å; E762-K790 PolarHBondContact OE2-NZ 3.22Å
763	Y	91.6	Very high	91.4	Very high	53 Å²	53	54.8 Å²	54.8	21%	0.208	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	9.6	176.9	51.9	-101.5	0	0	0	112.4	P761 F787 R788 Y795 F797	P761-Y763 HydrophobicContact CB-CD1 3.96Å; P761-Y763 HydrophobicContact CB-CD2 4.14Å; P761-Y763 HydrophobicContact CB-CE1 3.48Å; P761-Y763 VanDerWaalsContact CB-CE1 3.48Å; P761-Y763 HydrophobicContact CB-CE2 3.66Å; P761-Y763 HydrophobicContact CB-CG 4.27Å; P761-Y763 HydrophobicContact CG-CE1 4.46Å; P761-Y763 HydrophobicContact CG-CE2 4.08Å; P761-Y763 PolarHBondContact O-N 3.33Å; Y763-F787 HydrophobicContact CD2-CD2 4.19Å; Y763-F787 AromaticContact CD2-CE2 3.93Å; Y763-F787 HydrophobicContact CD2-CE2 3.93Å; Y763-F787 WeakPolarHBondContact O-CA 3.42Å; Y763-F787 WeakPolarHBondContact O-CD2 3.5Å; Y763-R788 VanDerWaalsContact CB-O 3.24Å; Y763-R788 WeakPolarHBondContact CB-O 3.36Å; Y763-R788 PolarHBondContact O-N 3.33Å; Y763-Y795 HydrophobicContact CD1-CD1 4.11Å; Y763-Y795 AromaticContact CD1-CE1 3.77Å; Y763-Y795 HydrophobicContact CD1-CE1 3.77Å; Y763-Y795 AromaticContact CD2-CD1 3.85Å; Y763-Y795 HydrophobicContact CD2-CD1 3.85Å; Y763-Y795 HydrophobicContact CD2-CE1 4.1Å; Y763-Y795 AromaticContact CE1-CD1 3.93Å; Y763-Y795 HydrophobicContact CE1-CD1 3.93Å; Y763-Y795 AromaticContact CE1-CE1 3.94Å; Y763-Y795 HydrophobicContact CE1-CE1 3.94Å; Y763-Y795 AromaticContact CE2-CD1 3.68Å; Y763-Y795 HydrophobicContact CE2-CD1 3.68Å; Y763-Y795 HydrophobicContact CE2-CE1 4.28Å; Y763-Y795 HydrophobicContact CG-CD1 4.07Å; Y763-Y795 AromaticContact CG-CE1 3.84Å; Y763-Y795 HydrophobicContact CG-CE1 3.84Å; Y763-Y795 AromaticContact CZ-CD1 3.71Å; Y763-F797 HydrophobicContact CD2-CE1 4.46Å; Y763-F797 AromaticContact CE2-CD1 3.72Å; Y763-F797 HydrophobicContact CE2-CD1 3.72Å; Y763-F797 HydrophobicContact CE2-CD2 4.37Å; Y763-F797 AromaticContact CE2-CE1 3.72Å; Y763-F797 HydrophobicContact CE2-CE1 3.72Å; Y763-F797 HydrophobicContact CE2-CE2 4.36Å; Y763-F797 HydrophobicContact CE2-CG 4.06Å; Y763-F797 HydrophobicContact CE2-CZ 4.04Å
764	I	94.3	Very high	91.5	Very high	13 Å²	13	58.1 Å²	58.1	7%	0.067	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	141.3	169	-69.8	-75.5	0	0	0	108.8	F730 V760 P761 V766 I786 F787 F797 L799	F730-I764 HydrophobicContact CE2-CD1 3.74Å; F730-I764 HydrophobicContact CZ-CD1 3.72Å; V760-I764 HydrophobicContact CG1-CB 3.88Å; V760-I764 HydrophobicContact CG1-CG2 3.71Å; P761-I764 PolarHBondContact O-N 3.04Å; I764-V766 HydrophobicContact CG2-CG2 4.12Å; I764-I786 WeakPolarHBondContact CA-O 3.17Å; I764-F787 HydrophobicContact CD1-CB 3.85Å; I764-F787 HydrophobicContact CD1-CD2 3.96Å; I764-F787 HydrophobicContact CD1-CG 4.37Å; I764-F797 HydrophobicContact CD1-CE2 4.22Å; I764-F797 HydrophobicContact CD1-CZ 3.69Å; I764-F797 HydrophobicContact CG1-CE2 3.68Å; I764-F797 HydrophobicContact CG1-CZ 3.51Å; I764-L799 HydrophobicContact CG2-CD1 4.41Å; I764-L799 HydrophobicContact CG2-CD2 4.22Å
765	E	93.5	Very high	91.5	Very high	56 Å²	56	54 Å²	54	26%	0.262	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.6	161	-179.9	-174.4	177.1	0	0	108.1	Q767 I786 R788	E765-Q767 HydrophobicContact CG-CG 4.22Å; E765-Q767 PolarHBondContact OE1-NE2 3.05Å; E765-I786 HydrophobicContact CB-CB 4.34Å; E765-I786 PolarHBondContact N-O 3.07Å; E765-I786 PolarHBondContact O-N 3.32Å; E765-R788 IonicContact OE2-CZ 3.67Å; E765-R788 IonicContact OE2-NH1 3.7Å; E765-R788 PolarHBondContact OE2-NH1 2.95Å; E765-R788 IonicContact OE2-NH2 3.65Å; E765-R788 PolarHBondContact OE2-NH2 3.35Å
766	V	94.9	Very high	91.5	Very high	1 Å²	1	58 Å²	58	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.6	176.6	-175	0	0	0	0	108.5	F757 V760 I764 D770 G771 L783 L785	F757-V766 HydrophobicContact CD2-CG1 4.21Å; F757-V766 HydrophobicContact CE2-CG1 4.36Å; F757-V766 HydrophobicContact CG-CG2 4.39Å; V760-V766 HydrophobicContact CG1-CG2 4.43Å; V760-V766 HydrophobicContact CG2-CG2 4.4Å; I764-V766 HydrophobicContact CG2-CG2 4.12Å; V766-D770 CarbonylContact O-C 3.57Å; V766-D770 WeakPolarHBondContact O-CA 3.49Å; V766-D770 PolarHBondContact O-N 3.18Å; V766-G771 PolarHBondContact O-N 3.4Å; V766-L783 HydrophobicContact CG1-CD2 4.31Å; V766-L785 HydrophobicContact CB-CD2 4.44Å; V766-L785 HydrophobicContact CG1-CD2 4.07Å; V766-L785 HydrophobicContact CG2-CD2 3.86Å
767	Q	91.9	Very high	91.4	Very high	66 Å²	66	60.5 Å²	60.5	31%	0.308	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	152.3	175.8	-65	-172.9	-8.3	0	0	110.8	E765 L783 D784 I786	E765-Q767 HydrophobicContact CG-CG 4.22Å; E765-Q767 PolarHBondContact OE1-NE2 3.05Å; Q767-L783 CarbonylContact O-C 3.42Å; Q767-L783 WeakPolarHBondContact O-CA 3.43Å; Q767-D784 HydrophobicContact CB-CB 4.26Å; Q767-D784 PolarHBondContact N-O 3.2Å; Q767-D784 PolarHBondContact O-N 3.26Å; Q767-I786 HydrophobicContact CG-CD1 4.08Å
768	P	88.2	Confident	91.2	Very high	43 Å²	43	65.4 Å²	65.4	28%	0.279	35%	0.347	S	S	.	.	S	Bend	cis	-73	173.3	-7.2	33	-37.3	0	0	0	113.2	D770 G771	P768-D770 VanDerWaalsContact C-N 3.33Å; P768-D770 PolarHBondContact O-N 2.98Å; P768-G771 PolarHBondContact O-N 3.02Å
769	Y	86.8	Confident	91.4	Very high	189 Å²	189	66 Å²	66	74%	0.741	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	56.8	31.9	167.5	-45.1	-60.5	0	0	0	116.8	G771 F772	Y769-G771 PolarHBondContact O-N 2.89Å; Y769-G771 VanDerWaalsContact O-N 3.12Å; Y769-F772 WeakPolarHBondContact CB-O 3.13Å; Y769-F772 PolarHBondContact O-N 2.87Å
770	D	87.5	Confident	91.7	Very high	107 Å²	107	65.4 Å²	65.4	57%	0.572	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	56.8	24.5	-178.8	-155.7	29.8	0	0	0	113.6	V766 P768 F772	V766-D770 CarbonylContact O-C 3.57Å; V766-D770 WeakPolarHBondContact O-CA 3.49Å; V766-D770 PolarHBondContact O-N 3.18Å; P768-D770 VanDerWaalsContact C-N 3.33Å; P768-D770 PolarHBondContact O-N 2.98Å; D770-F772 HydrophobicContact CB-CD2 4.38Å; D770-F772 VanDerWaalsContact O-CD2 3.29Å; D770-F772 WeakPolarHBondContact O-CD2 3.35Å; D770-F772 WeakPolarHBondContact O-CE2 3.41Å
771	G	87.3	Confident	91.8	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	76.8	20.4	-176	0	0	0	0	0	115.2	F755 G756 F757 V766 P768 Y769	F755-G771 WeakPolarHBondContact CE2-O 3.34Å; G756-G771 CarbonylContact C-O 3.49Å; G756-G771 WeakPolarHBondContact CA-O 3.26Å; F757-G771 WeakPolarHBondContact CD2-O 3.42Å; F757-G771 PolarHBondContact N-O 3.17Å; V766-G771 PolarHBondContact O-N 3.4Å; P768-G771 PolarHBondContact O-N 3.02Å; Y769-G771 PolarHBondContact O-N 2.89Å; Y769-G771 VanDerWaalsContact O-N 3.12Å
772	F	92.1	Very high	91.9	Very high	103 Å²	103	70.3 Å²	70.3	45%	0.452	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137.6	173.4	-65.2	-89.6	0	0	0	112	F755 G756 F757 Y769 D770	F755-F772 WeakPolarHBondContact O-CA 3.25Å; G756-F772 VanDerWaalsContact CA-CD1 3.42Å; F757-F772 WeakPolarHBondContact O-CZ 3.41Å; Y769-F772 WeakPolarHBondContact CB-O 3.13Å; Y769-F772 PolarHBondContact O-N 2.87Å; D770-F772 HydrophobicContact CB-CD2 4.38Å; D770-F772 VanDerWaalsContact O-CD2 3.29Å; D770-F772 WeakPolarHBondContact O-CD2 3.35Å; D770-F772 WeakPolarHBondContact O-CE2 3.41Å
773	G	91.9	Very high	92	Very high	26 Å²	26	62.9 Å²	62.9	27%	0.268	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	-173.9	176.4	0	0	0	0	0	114.2	D754 F755	D754-G773 CarbonylContact C-O 3.57Å; D754-G773 WeakPolarHBondContact CA-O 3.44Å; F755-G773 WeakPolarHBondContact CD1-O 3.48Å; F755-G773 PolarHBondContact N-O 2.87Å; F755-G773 PolarHBondContact O-N 2.85Å
774	T	93.6	Very high	92.2	Very high	77 Å²	77	61.3 Å²	61.3	47%	0.472	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125	172.6	-47.2	0	0	0	0	108.2	P752 Q753 D754	P752-T774 HydrophobicContact CB-CG2 4.09Å; Q753-T774 WeakPolarHBondContact O-CA 3.2Å; D754-T774 WeakPolarHBondContact OD1-CB 3.34Å; D754-T774 VanDerWaalsContact OD1-CG2 3.31Å; D754-T774 WeakPolarHBondContact OD1-CG2 3.4Å; D754-T774 PolarHBondContact OD1-OG1 2.89Å
775	L	93.1	Very high	92.2	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	129.5	170	-75.9	161.7	0	0	0	109.7	L721 L745 N747 P752 Q753 F755 E779 L781	L721-L775 HydrophobicContact CD2-CD1 4.13Å; L745-L775 HydrophobicContact CD2-CD1 4.01Å; L745-L775 HydrophobicContact CG-CD1 3.89Å; N747-L775 HydrophobicContact CB-CB 3.68Å; N747-L775 HydrophobicContact CB-CD1 4.15Å; N747-L775 HydrophobicContact CB-CG 4.44Å; N747-L775 PolarHBondContact ND2-O 2.62Å; P752-L775 CarbonylContact C-O 3.5Å; P752-L775 VanDerWaalsContact CA-O 3.25Å; P752-L775 WeakPolarHBondContact CA-O 3.38Å; Q753-L775 PolarHBondContact N-O 2.76Å; Q753-L775 PolarHBondContact O-N 2.8Å; F755-L775 HydrophobicContact CD1-CD1 3.88Å; F755-L775 HydrophobicContact CD1-CG 3.84Å; F755-L775 HydrophobicContact CE1-CD1 4.28Å; F755-L775 HydrophobicContact CE1-CG 3.94Å; F755-L775 HydrophobicContact CG-CD1 4.5Å; L775-E779 HydrophobicContact CD2-CB 4.34Å; L775-E779 HydrophobicContact CD2-CG 4.25Å; L775-L781 HydrophobicContact CD2-CB 3.58Å
776	L	93.7	Very high	92.3	Very high	95 Å²	95	58.4 Å²	58.4	50%	0.497	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-71.5	166	171.3	-62	177.6	0	0	0	111.4	N747 Q778 E779	N747-L776 PolarHBondContact ND2-O 3.15Å; L776-Q778 PolarHBondContact O-N 3.28Å; L776-E779 HydrophobicContact CB-CB 3.98Å; L776-E779 WeakPolarHBondContact CB-OE2 3.42Å; L776-E779 WeakPolarHBondContact CG-OE2 3.42Å; L776-E779 PolarHBondContact N-OE2 3.4Å; L776-E779 VanDerWaalsContact O-CB 3.26Å; L776-E779 WeakPolarHBondContact O-CB 3.47Å; L776-E779 PolarHBondContact O-N 3.27Å; L776-E779 VanDerWaalsContact O-N 3.07Å
777	P	91.6	Very high	92.3	Very high	60 Å²	60	58.3 Å²	58.3	39%	0.39	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	127.1	176.4	-29	37.2	0	0	0	112.9	S749 I750 E779	S749-P777 WeakPolarHBondContact O-CA 3.48Å; I750-P777 WeakPolarHBondContact O-CG 3.48Å; P777-E779 PolarHBondContact O-N 3.38Å; P777-E779 VanDerWaalsContact O-N 3.1Å
778	Q	89.4	Confident	92.3	Very high	108 Å²	108	59.8 Å²	59.8	51%	0.505	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	17.2	-176.3	-53.4	-60.7	-44.8	0	0	115	N747 M748 S749 L776	N747-Q778 VanDerWaalsContact O-CA 3.25Å; N747-Q778 WeakPolarHBondContact O-CA 3.27Å; N747-Q778 PolarHBondContact O-N 2.97Å; M748-Q778 VanDerWaalsContact C-NE2 3.26Å; M748-Q778 PolarHBondContact O-NE2 3.01Å; S749-Q778 PolarHBondContact O-N 3.11Å; S749-Q778 PolarHBondContact O-NE2 3.2Å; L776-Q778 PolarHBondContact O-N 3.28Å
779	E	93.8	Very high	92.5	Very high	78 Å²	78	57.8 Å²	57.8	36%	0.364	29%	0.288	S	S	.	.			trans	-76.8	143.3	175.9	-171.9	168.8	-133.3	0	0	111.1	T746 N747 L775 L776 P777	T746-E779 WeakPolarHBondContact CA-O 3.41Å; N747-E779 PolarHBondContact N-O 2.97Å; L775-E779 HydrophobicContact CD2-CB 4.34Å; L775-E779 HydrophobicContact CD2-CG 4.25Å; L776-E779 HydrophobicContact CB-CB 3.98Å; L776-E779 WeakPolarHBondContact CB-OE2 3.42Å; L776-E779 WeakPolarHBondContact CG-OE2 3.42Å; L776-E779 PolarHBondContact N-OE2 3.4Å; L776-E779 VanDerWaalsContact O-CB 3.26Å; L776-E779 WeakPolarHBondContact O-CB 3.47Å; L776-E779 PolarHBondContact O-N 3.27Å; L776-E779 VanDerWaalsContact O-N 3.07Å; P777-E779 PolarHBondContact O-N 3.38Å; P777-E779 VanDerWaalsContact O-N 3.1Å
780	T	94.9	Very high	92.6	Very high	68 Å²	68	54.8 Å²	54.8	42%	0.417	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.8	169.5	-59.5	0	0	0	0	108.7	R744 L745 T746	R744-T780 HydrophobicContact CB-CG2 3.66Å; R744-T780 HydrophobicContact CG-CG2 3.98Å; L745-T780 WeakPolarHBondContact O-CA 3.38Å; T746-T780 WeakPolarHBondContact CG2-OG1 3.42Å; T746-T780 WeakPolarHBondContact OG1-CG2 3.47Å; T746-T780 PolarHBondContact OG1-OG1 3.42Å
781	L	93.7	Very high	92.5	Very high	48 Å²	48	56 Å²	56	25%	0.251	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	136	171.7	-179.8	64.5	0	0	0	110.3	R744 L745 F755 L775 L783	R744-L781 WeakPolarHBondContact CA-O 3.44Å; L745-L781 PolarHBondContact N-O 3.11Å; L745-L781 PolarHBondContact O-N 3.31Å; F755-L781 HydrophobicContact CE1-CD2 3.88Å; F755-L781 HydrophobicContact CZ-CD2 3.51Å; L775-L781 HydrophobicContact CD2-CB 3.58Å; L781-L783 HydrophobicContact CD2-CD2 3.78Å; L781-L783 HydrophobicContact CD2-CG 4.39Å; L781-L783 HydrophobicContact CG-CD2 4.21Å; L781-L783 HydrophobicContact CG-CG 4.41Å
782	E	95	Very high	92.3	Very high	128 Å²	128	59 Å²	59	60%	0.598	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83	124	167	-74.9	174.8	179.2	0	0	109.7	T742 R744	T742-E782 HydrophobicContact CG2-CB 3.93Å; T742-E782 HydrophobicContact CG2-CG 4.28Å; R744-E782 HydrophobicContact CG-CG 3.74Å
783	L	94.1	Very high	92.1	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.2	179.8	-67.7	171.2	0	0	0	109.3	T742 V743 L745 F755 F757 V766 Q767 L781	T742-L783 CarbonylContact C-O 3.47Å; T742-L783 WeakPolarHBondContact CA-O 3.38Å; V743-L783 PolarHBondContact N-O 3.18Å; V743-L783 PolarHBondContact O-N 3.28Å; L745-L783 HydrophobicContact CB-CD1 3.75Å; L745-L783 HydrophobicContact CD2-CD1 3.89Å; L745-L783 HydrophobicContact CG-CD1 4.47Å; F755-L783 HydrophobicContact CE2-CD1 4.48Å; F755-L783 HydrophobicContact CE2-CD2 4.27Å; F755-L783 HydrophobicContact CZ-CD2 4.32Å; F757-L783 HydrophobicContact CE2-CD1 3.65Å; F757-L783 HydrophobicContact CZ-CD1 3.99Å; V766-L783 HydrophobicContact CG1-CD2 4.31Å; Q767-L783 CarbonylContact O-C 3.42Å; Q767-L783 WeakPolarHBondContact O-CA 3.43Å; L781-L783 HydrophobicContact CD2-CD2 3.78Å; L781-L783 HydrophobicContact CD2-CG 4.39Å; L781-L783 HydrophobicContact CG-CD2 4.21Å; L781-L783 HydrophobicContact CG-CG 4.41Å
784	D	94.8	Very high	91.9	Very high	19 Å²	19	62.1 Å²	62.1	10%	0.102	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	112.2	175.8	-65.6	-60.5	0	0	0	110.4	R740 T742 Q767	R740-D784 HydrophobicContact CG-CB 4.24Å; R740-D784 IonicContact CZ-OD1 3.38Å; R740-D784 IonicContact CZ-OD2 2.84Å; R740-D784 IonicContact NE-OD1 2.71Å; R740-D784 PolarHBondContact NE-OD1 3.32Å; R740-D784 IonicContact NE-OD2 3.09Å; R740-D784 IonicContact NH1-OD1 2.64Å; R740-D784 IonicContact NH1-OD2 2.63Å; R740-D784 PolarHBondContact NH1-OD2 3.41Å; R740-D784 IonicContact NH2-OD1 3.3Å; R740-D784 PolarHBondContact NH2-OD1 3.38Å; R740-D784 IonicContact NH2-OD2 3.36Å; R740-D784 PolarHBondContact NH2-OD2 2.94Å; T742-D784 PolarHBondContact OG1-OD1 3.06Å; Q767-D784 HydrophobicContact CB-CB 4.26Å; Q767-D784 PolarHBondContact N-O 3.2Å; Q767-D784 PolarHBondContact O-N 3.26Å
785	L	94.9	Very high	91.7	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	116.3	172.4	-54.7	-179.1	0	0	0	108.8	V728 F730 R740 T741 V743 V766 L799 L811	V728-L785 HydrophobicContact CG1-CD1 4.47Å; V728-L785 HydrophobicContact CG2-CD1 4.02Å; F730-L785 HydrophobicContact CE1-CB 3.84Å; F730-L785 HydrophobicContact CZ-CB 3.76Å; F730-L785 HydrophobicContact CZ-CD1 4.24Å; R740-L785 WeakPolarHBondContact CA-O 3.44Å; T741-L785 PolarHBondContact N-O 2.98Å; T741-L785 PolarHBondContact O-N 2.85Å; V743-L785 HydrophobicContact CG2-CD1 3.69Å; V743-L785 HydrophobicContact CG2-CG 4.21Å; V766-L785 HydrophobicContact CB-CD2 4.44Å; V766-L785 HydrophobicContact CG1-CD2 4.07Å; V766-L785 HydrophobicContact CG2-CD2 3.86Å; L785-L799 HydrophobicContact CD1-CD1 3.9Å; L785-L799 HydrophobicContact CD2-CD1 3.81Å; L785-L799 HydrophobicContact CG-CD1 4.46Å; L785-L811 HydrophobicContact CD1-CD2 4.03Å
786	I	94.8	Very high	91.7	Very high	6 Å²	6	65.1 Å²	65.1	3%	0.031	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	103.3	-176.4	-53.5	173.1	0	0	0	109.7	F738 V739 R740 I764 E765 Q767 R788	F738-I786 HydrophobicContact CB-CG2 3.91Å; F738-I786 HydrophobicContact CD2-CG2 3.72Å; F738-I786 HydrophobicContact CG-CG2 4.03Å; V739-I786 CarbonylContact O-C 3.57Å; V739-I786 WeakPolarHBondContact O-CA 3.48Å; R740-I786 HydrophobicContact CB-CG1 4.35Å; R740-I786 HydrophobicContact CG-CG1 4.32Å; I764-I786 WeakPolarHBondContact CA-O 3.17Å; E765-I786 HydrophobicContact CB-CB 4.34Å; E765-I786 PolarHBondContact N-O 3.07Å; E765-I786 PolarHBondContact O-N 3.32Å; Q767-I786 HydrophobicContact CG-CD1 4.08Å; I786-R788 HydrophobicContact CG2-CG 4.28Å
787	F	95.3	Very high	91.7	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	127.3	179.6	177.3	-125.1	0	0	0	111.9	F730 C733 F738 V739 Y763 I764 P789 Y795	F730-F787 HydrophobicContact CB-CB 4.1Å; F730-F787 HydrophobicContact CB-CD1 3.6Å; F730-F787 HydrophobicContact CB-CE1 4.29Å; F730-F787 HydrophobicContact CB-CG 4.07Å; F730-F787 HydrophobicContact CD1-CB 3.67Å; F730-F787 HydrophobicContact CD1-CG 4.47Å; F730-F787 HydrophobicContact CD2-CB 3.87Å; F730-F787 HydrophobicContact CD2-CD1 4.27Å; F730-F787 HydrophobicContact CD2-CD2 4.39Å; F730-F787 AromaticContact CD2-CG 3.95Å; F730-F787 HydrophobicContact CD2-CG 3.95Å; F730-F787 HydrophobicContact CE1-CB 4.02Å; F730-F787 HydrophobicContact CE2-CB 4.23Å; F730-F787 HydrophobicContact CG-CB 3.6Å; F730-F787 AromaticContact CG-CD1 3.99Å; F730-F787 HydrophobicContact CG-CD1 3.99Å; F730-F787 AromaticContact CG-CG 3.91Å; F730-F787 HydrophobicContact CG-CG 3.91Å; F730-F787 HydrophobicContact CZ-CB 4.3Å; C733-F787 HydrophobicContact CB-CD1 3.88Å; C733-F787 HydrophobicContact CB-CE1 3.89Å; F738-F787 CarbonylContact C-O 3.55Å; F738-F787 WeakPolarHBondContact CA-O 3.47Å; F738-F787 WeakPolarHBondContact CB-O 3.22Å; V739-F787 PolarHBondContact N-O 2.94Å; V739-F787 PolarHBondContact O-N 3.39Å; Y763-F787 HydrophobicContact CD2-CD2 4.19Å; Y763-F787 AromaticContact CD2-CE2 3.93Å; Y763-F787 HydrophobicContact CD2-CE2 3.93Å; Y763-F787 WeakPolarHBondContact O-CA 3.42Å; Y763-F787 WeakPolarHBondContact O-CD2 3.5Å; I764-F787 HydrophobicContact CD1-CB 3.85Å; I764-F787 HydrophobicContact CD1-CD2 3.96Å; I764-F787 HydrophobicContact CD1-CG 4.37Å; F787-P789 HydrophobicContact CD1-CG 4.49Å; F787-P789 HydrophobicContact CE1-CB 4.09Å; F787-P789 HydrophobicContact CE1-CG 3.94Å; F787-P789 HydrophobicContact CE2-CB 4.25Å; F787-P789 HydrophobicContact CZ-CB 3.72Å; F787-P789 HydrophobicContact CZ-CG 4.1Å; F787-Y795 HydrophobicContact CE2-CD1 4.27Å; F787-Y795 HydrophobicContact CE2-CD2 4.07Å; F787-Y795 HydrophobicContact CE2-CE2 4.5Å; F787-Y795 AromaticContact CE2-CG 3.94Å; F787-Y795 HydrophobicContact CE2-CG 3.94Å; F787-Y795 AromaticContact CZ-CD2 3.59Å; F787-Y795 HydrophobicContact CZ-CD2 3.59Å; F787-Y795 HydrophobicContact CZ-CE2 4.07Å; F787-Y795 AromaticContact CZ-CG 3.89Å; F787-Y795 HydrophobicContact CZ-CG 3.89Å
788	R	93	Very high	91.9	Very high	96 Å²	96	63.7 Å²	63.7	36%	0.362	31%	0.307	S	S	.	.			trans	-132.5	83.2	-178.3	-55.1	-154.1	-176.8	87.9	-7.9	110.9	F738 Y763 E765 I786 K790	F738-R788 HydrophobicContact CB-CG 3.77Å; Y763-R788 VanDerWaalsContact CB-O 3.24Å; Y763-R788 WeakPolarHBondContact CB-O 3.36Å; Y763-R788 PolarHBondContact O-N 3.33Å; E765-R788 IonicContact OE2-CZ 3.67Å; E765-R788 IonicContact OE2-NH1 3.7Å; E765-R788 PolarHBondContact OE2-NH1 2.95Å; E765-R788 IonicContact OE2-NH2 3.65Å; E765-R788 PolarHBondContact OE2-NH2 3.35Å; I786-R788 HydrophobicContact CG2-CG 4.28Å; R788-K790 PolarHBondContact O-N 3.21Å
789	P	92.1	Very high	92.1	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.013	28%	0.283	C	S	.	.			trans	-66.9	116	-174.8	25.3	-32.5	0	0	0	112	C733 I735 F787 K791 Y795	C733-P789 HydrophobicContact CB-CG 3.9Å; C733-P789 VanDerWaalsContact SG-CD 3.55Å; I735-P789 VanDerWaalsContact CA-O 3.31Å; I735-P789 WeakPolarHBondContact CA-O 3.39Å; I735-P789 WeakPolarHBondContact CB-O 3.32Å; I735-P789 WeakPolarHBondContact CG2-O 3.42Å; F787-P789 HydrophobicContact CD1-CG 4.49Å; F787-P789 HydrophobicContact CE1-CB 4.09Å; F787-P789 HydrophobicContact CE1-CG 3.94Å; F787-P789 HydrophobicContact CE2-CB 4.25Å; F787-P789 HydrophobicContact CZ-CB 3.72Å; F787-P789 HydrophobicContact CZ-CG 4.1Å; P789-K791 VanDerWaalsContact C-N 3.31Å; P789-K791 PolarHBondContact O-N 3.13Å; P789-Y795 HydrophobicContact CB-CD2 4.39Å; P789-Y795 HydrophobicContact CB-CE2 3.57Å
790	K	87.7	Confident	92.1	Very high	125 Å²	125	60.2 Å²	60.2	54%	0.543	29%	0.286	S	S	.	.	S	Bend	trans	-75.9	-13.8	177.6	-59.4	-172.3	-177.5	-175.1	0	114.2	E762 R788 Y795	E762-K790 VanDerWaalsContact CB-NZ 3.34Å; E762-K790 WeakPolarHBondContact O-CE 3.39Å; E762-K790 IonicContact OE2-NZ 2.65Å; E762-K790 PolarHBondContact OE2-NZ 3.22Å; R788-K790 PolarHBondContact O-N 3.21Å; K790-Y795 PolarHBondContact N-OH 3.44Å
791	K	85.7	Confident	92	Very high	134 Å²	134	57 Å²	57	58%	0.583	27%	0.266	S	S	*	.	S	Bend	trans	-141.7	150.6	-176.7	-64.3	-174.7	-178.9	-178.8	0	110.3	P789 I793 Y795	P789-K791 VanDerWaalsContact C-N 3.31Å; P789-K791 PolarHBondContact O-N 3.13Å; K791-I793 VanDerWaalsContact C-N 3.29Å; K791-I793 HydrophobicContact CB-CD1 4.42Å; K791-I793 HydrophobicContact CB-CG1 4.26Å; K791-I793 HydrophobicContact CB-CG2 4.42Å; K791-I793 PolarHBondContact O-N 3.43Å; K791-Y795 PolarHBondContact N-OH 2.69Å; K791-Y795 WeakPolarHBondContact O-CE2 3.46Å; K791-Y795 PolarHBondContact O-OH 2.69Å; K791-Y795 VanDerWaalsContact O-OH 3.09Å
792	P	83.4	Confident	91.9	Very high	62 Å²	62	57.5 Å²	57.5	40%	0.403	27%	0.266	S	S	.	.	S	Bend	trans	-80.3	74.3	176.8	33.8	-35.2	0	0	0	111.2	I735 G817 H819	I735-P792 HydrophobicContact CG2-CB 4.49Å; P792-G817 CarbonylContact C-O 3.52Å; P792-G817 VanDerWaalsContact C-O 3.27Å; P792-G817 VanDerWaalsContact CA-O 3.23Å; P792-G817 WeakPolarHBondContact CA-O 3.36Å; P792-H819 HydrophobicContact CB-CB 4.41Å
793	I	87.1	Confident	91.7	Very high	87 Å²	87	51.6 Å²	51.6	45%	0.446	24%	0.239	S	C	.	.	S	Bend	trans	-136	165.4	-179.9	63.3	176	0	0	0	111	K791 Y795 G817	K791-I793 VanDerWaalsContact C-N 3.29Å; K791-I793 HydrophobicContact CB-CD1 4.42Å; K791-I793 HydrophobicContact CB-CG1 4.26Å; K791-I793 HydrophobicContact CB-CG2 4.42Å; K791-I793 PolarHBondContact O-N 3.43Å; I793-Y795 HydrophobicContact CD1-CE1 4.22Å; I793-Y795 HydrophobicContact CD1-CE2 4.31Å; I793-Y795 HydrophobicContact CG1-CD2 3.92Å; I793-Y795 HydrophobicContact CG1-CE1 4.24Å; I793-Y795 HydrophobicContact CG1-CE2 3.45Å; I793-Y795 VanDerWaalsContact CG1-CE2 3.45Å; I793-Y795 HydrophobicContact CG1-CG 4.5Å; I793-Y795 WeakPolarHBondContact O-CD2 3.48Å; I793-Y795 VanDerWaalsContact O-CE2 3.32Å; I793-Y795 WeakPolarHBondContact O-CE2 3.5Å; I793-G817 PolarHBondContact N-O 3.06Å; I793-G817 PolarHBondContact O-N 2.95Å
794	E	88.9	Confident	91.2	Very high	108 Å²	108	54.5 Å²	54.5	51%	0.505	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	134.4	162.7	-176.3	166.4	-163	0	0	110.2	R814 V816	E794-R814 IonicContact OE1-CZ 3.81Å; E794-R814 IonicContact OE1-NE 3.52Å; E794-R814 PolarHBondContact OE1-NE 3.16Å; E794-R814 IonicContact OE1-NH2 3.95Å; E794-R814 PolarHBondContact OE1-NH2 2.73Å; E794-V816 HydrophobicContact CB-CG2 4.5Å; E794-V816 HydrophobicContact CG-CG2 4.27Å
795	Y	89.3	Confident	90.6	Very high	16 Å²	16	56.3 Å²	56.3	6%	0.063	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.9	177.5	-65.9	-102.8	0	0	0	108.5	Y763 F787 P789 K790 K791 I793 R814 G815	Y763-Y795 HydrophobicContact CD1-CD1 4.11Å; Y763-Y795 AromaticContact CD1-CE1 3.77Å; Y763-Y795 HydrophobicContact CD1-CE1 3.77Å; Y763-Y795 AromaticContact CD2-CD1 3.85Å; Y763-Y795 HydrophobicContact CD2-CD1 3.85Å; Y763-Y795 HydrophobicContact CD2-CE1 4.1Å; Y763-Y795 AromaticContact CE1-CD1 3.93Å; Y763-Y795 HydrophobicContact CE1-CD1 3.93Å; Y763-Y795 AromaticContact CE1-CE1 3.94Å; Y763-Y795 HydrophobicContact CE1-CE1 3.94Å; Y763-Y795 AromaticContact CE2-CD1 3.68Å; Y763-Y795 HydrophobicContact CE2-CD1 3.68Å; Y763-Y795 HydrophobicContact CE2-CE1 4.28Å; Y763-Y795 HydrophobicContact CG-CD1 4.07Å; Y763-Y795 AromaticContact CG-CE1 3.84Å; Y763-Y795 HydrophobicContact CG-CE1 3.84Å; Y763-Y795 AromaticContact CZ-CD1 3.71Å; F787-Y795 HydrophobicContact CE2-CD1 4.27Å; F787-Y795 HydrophobicContact CE2-CD2 4.07Å; F787-Y795 HydrophobicContact CE2-CE2 4.5Å; F787-Y795 AromaticContact CE2-CG 3.94Å; F787-Y795 HydrophobicContact CE2-CG 3.94Å; F787-Y795 AromaticContact CZ-CD2 3.59Å; F787-Y795 HydrophobicContact CZ-CD2 3.59Å; F787-Y795 HydrophobicContact CZ-CE2 4.07Å; F787-Y795 AromaticContact CZ-CG 3.89Å; F787-Y795 HydrophobicContact CZ-CG 3.89Å; P789-Y795 HydrophobicContact CB-CD2 4.39Å; P789-Y795 HydrophobicContact CB-CE2 3.57Å; K790-Y795 PolarHBondContact N-OH 3.44Å; K791-Y795 PolarHBondContact N-OH 2.69Å; K791-Y795 WeakPolarHBondContact O-CE2 3.46Å; K791-Y795 PolarHBondContact O-OH 2.69Å; K791-Y795 VanDerWaalsContact O-OH 3.09Å; I793-Y795 HydrophobicContact CD1-CE1 4.22Å; I793-Y795 HydrophobicContact CD1-CE2 4.31Å; I793-Y795 HydrophobicContact CG1-CD2 3.92Å; I793-Y795 HydrophobicContact CG1-CE1 4.24Å; I793-Y795 HydrophobicContact CG1-CE2 3.45Å; I793-Y795 VanDerWaalsContact CG1-CE2 3.45Å; I793-Y795 HydrophobicContact CG1-CG 4.5Å; I793-Y795 WeakPolarHBondContact O-CD2 3.48Å; I793-Y795 VanDerWaalsContact O-CE2 3.32Å; I793-Y795 WeakPolarHBondContact O-CE2 3.5Å; Y795-R814 CarbonylContact O-C 3.39Å; Y795-R814 WeakPolarHBondContact O-CA 3.39Å; Y795-G815 WeakPolarHBondContact CB-O 3.24Å; Y795-G815 PolarHBondContact N-O 3.45Å; Y795-G815 PolarHBondContact O-N 3.35Å
796	N	93.4	Very high	90.1	Very high	124 Å²	124	61.7 Å²	61.7	66%	0.663	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	119.3	171.2	-177.3	-5.2	0	0	0	107.4
797	F	93.1	Very high	89.8	Confident	20 Å²	20	65.6 Å²	65.6	9%	0.088	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	176.4	-171.9	63.9	-80.5	0	0	0	110.7	F730 P761 Y763 I764 L799 C813	F730-F797 HydrophobicContact CE2-CZ 4.02Å; P761-F797 HydrophobicContact CG-CD2 3.98Å; P761-F797 HydrophobicContact CG-CE2 4.49Å; Y763-F797 HydrophobicContact CD2-CE1 4.46Å; Y763-F797 AromaticContact CE2-CD1 3.72Å; Y763-F797 HydrophobicContact CE2-CD1 3.72Å; Y763-F797 HydrophobicContact CE2-CD2 4.37Å; Y763-F797 AromaticContact CE2-CE1 3.72Å; Y763-F797 HydrophobicContact CE2-CE1 3.72Å; Y763-F797 HydrophobicContact CE2-CE2 4.36Å; Y763-F797 HydrophobicContact CE2-CG 4.06Å; Y763-F797 HydrophobicContact CE2-CZ 4.04Å; I764-F797 HydrophobicContact CD1-CE2 4.22Å; I764-F797 HydrophobicContact CD1-CZ 3.69Å; I764-F797 HydrophobicContact CG1-CE2 3.68Å; I764-F797 HydrophobicContact CG1-CZ 3.51Å; F797-L799 HydrophobicContact CD2-CD2 4.31Å; F797-L799 HydrophobicContact CD2-CG 4.44Å; F797-L799 HydrophobicContact CE2-CD2 3.92Å; F797-L799 HydrophobicContact CE2-CG 3.97Å; F797-C813 HydrophobicContact CD1-CB 4.15Å; F797-C813 HydrophobicContact CD2-CB 3.88Å; F797-C813 HydrophobicContact CE1-CB 3.69Å; F797-C813 HydrophobicContact CE2-CB 3.38Å; F797-C813 HydrophobicContact CG-CB 4.23Å; F797-C813 HydrophobicContact CZ-CB 3.28Å; F797-C813 PolarHBondContact N-O 3.29Å; F797-C813 PolarHBondContact O-N 2.62Å
798	Q	94.6	Very high	89.6	Confident	106 Å²	106	69.2 Å²	69.2	50%	0.495	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	127.6	-179	-70.3	175.3	-5.1	0	0	109.5	V810	Q798-V810 HydrophobicContact CB-CG1 3.77Å; Q798-V810 HydrophobicContact CG-CG1 3.97Å
799	L	93.8	Very high	89.5	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	130.4	168.7	-65.5	178	0	0	0	108.9	F757 V760 I764 L785 F797 V810 L811	F757-L799 HydrophobicContact CD1-CB 3.97Å; F757-L799 HydrophobicContact CE1-CB 3.92Å; F757-L799 HydrophobicContact CE1-CD1 4.37Å; V760-L799 HydrophobicContact CG1-CD2 4.25Å; I764-L799 HydrophobicContact CG2-CD1 4.41Å; I764-L799 HydrophobicContact CG2-CD2 4.22Å; L785-L799 HydrophobicContact CD1-CD1 3.9Å; L785-L799 HydrophobicContact CD2-CD1 3.81Å; L785-L799 HydrophobicContact CG-CD1 4.46Å; F797-L799 HydrophobicContact CD2-CD2 4.31Å; F797-L799 HydrophobicContact CD2-CG 4.44Å; F797-L799 HydrophobicContact CE2-CD2 3.92Å; F797-L799 HydrophobicContact CE2-CG 3.97Å; L799-V810 WeakPolarHBondContact O-CA 3.3Å; L799-L811 HydrophobicContact CB-CB 4.42Å; L799-L811 PolarHBondContact N-O 2.87Å; L799-L811 PolarHBondContact O-N 2.93Å
800	R	93.6	Very high	89.6	Confident	110 Å²	110	68.7 Å²	68.7	42%	0.415	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	107	175.6	-89.5	178.9	-75.4	-112.1	-3	109.9	F757 V758 V810	F757-R800 WeakPolarHBondContact CA-O 3.48Å; V758-R800 PolarHBondContact N-O 3.19Å; R800-V810 HydrophobicContact CG-CG2 4.19Å
801	C	93.1	Very high	89.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116.9	165.7	-179.1	0	0	0	0	108.3	F723 F757 F809	F723-C801 HydrophobicContact CE2-CB 4.46Å; F723-C801 HydrophobicContact CZ-CB 3.87Å; F757-C801 HydrophobicContact CD1-CB 4.19Å; F757-C801 HydrophobicContact CD2-CB 4.33Å; F757-C801 HydrophobicContact CE1-CB 3.91Å; F757-C801 HydrophobicContact CE2-CB 4.04Å; F757-C801 HydrophobicContact CG-CB 4.41Å; F757-C801 HydrophobicContact CZ-CB 3.84Å; C801-F809 HydrophobicContact CB-CB 4.38Å; C801-F809 PolarHBondContact N-O 2.78Å; C801-F809 PolarHBondContact O-N 2.94Å
802	K	93.1	Very high	90.4	Very high	59 Å²	59	58.3 Å²	58.3	26%	0.257	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	136.4	169.7	-80.8	-173.3	171.8	-76.6	0	109.5	F755 G756 V758 D806 R807 D808	F755-K802 CarbonylContact C-O 3.47Å; F755-K802 WeakPolarHBondContact CA-O 3.45Å; G756-K802 PolarHBondContact N-O 3.22Å; G756-K802 PolarHBondContact O-N 2.92Å; V758-K802 HydrophobicContact CG2-CB 4.31Å; V758-K802 HydrophobicContact CG2-CD 4.12Å; V758-K802 HydrophobicContact CG2-CG 4.34Å; K802-D806 IonicContact NZ-OD1 2.9Å; K802-D806 PolarHBondContact NZ-OD1 2.66Å; K802-R807 WeakPolarHBondContact CA-O 3.38Å; K802-D808 WeakPolarHBondContact CE-OD1 3.39Å; K802-D808 WeakPolarHBondContact CG-OD1 3.36Å; K802-D808 IonicContact NZ-OD1 2.81Å; K802-D808 PolarHBondContact NZ-OD1 2.92Å; K802-D808 IonicContact NZ-OD2 2.73Å
803	S	91	Very high	90.9	Very high	5 Å²	5	55.4 Å²	55.4	4%	0.035	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	158.2	162.4	70.9	0	0	0	0	111.4	D754 I805 D806 R807	D754-S803 CarbonylContact O-C 3.54Å; D754-S803 VanDerWaalsContact O-CA 3.26Å; D754-S803 WeakPolarHBondContact O-CA 3.42Å; S803-I805 PolarHBondContact O-N 3.01Å; S803-D806 PolarHBondContact O-N 2.85Å; S803-R807 PolarHBondContact N-O 2.89Å
804	G	82.9	Confident	91.3	Very high	61 Å²	61	55.9 Å²	55.9	63%	0.629	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	0.3	176.3	0	0	0	0	0	115.3	D754	D754-G804 PolarHBondContact O-N 2.88Å
805	I	82.1	Confident	91.4	Very high	58 Å²	58	50.7 Å²	50.7	30%	0.297	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	12.4	172.8	1.3	176.5	0	0	0	112.6	R621 S803	R621-I805 VanDerWaalsContact CZ-CG2 3.42Å; R621-I805 PolarHBondContact NH2-O 2.86Å; S803-I805 PolarHBondContact O-N 3.01Å
806	D	84.3	Confident	91.4	Very high	115 Å²	115	51.6 Å²	51.6	62%	0.615	27%	0.265	S	S	*	.	S	Bend	trans	59.6	54.7	-179.8	-157.1	35.6	0	0	0	113.9	K802 S803	K802-D806 IonicContact NZ-OD1 2.9Å; K802-D806 PolarHBondContact NZ-OD1 2.66Å; S803-D806 PolarHBondContact O-N 2.85Å
807	R	87.7	Confident	91	Very high	87 Å²	87	45.9 Å²	45.9	33%	0.328	24%	0.236	S	C	.	.			trans	-114.5	135.6	164.4	-66.3	-174.9	68.6	-159.7	2.9	110.1	S719 D720 K802 S803 F809	S719-R807 PolarHBondContact O-NH1 2.9Å; D720-R807 IonicContact OD1-CZ 3.83Å; D720-R807 IonicContact OD1-NH1 3.6Å; D720-R807 PolarHBondContact OD1-NH1 2.81Å; D720-R807 IonicContact OD1-NH2 3.63Å; D720-R807 PolarHBondContact OD1-NH2 3.19Å; K802-R807 WeakPolarHBondContact CA-O 3.38Å; S803-R807 PolarHBondContact N-O 2.89Å; R807-F809 HydrophobicContact CB-CE2 3.77Å; R807-F809 HydrophobicContact CB-CZ 3.96Å
808	D	91	Very high	90.5	Very high	76 Å²	76	48.6 Å²	48.6	41%	0.406	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122	179.6	-73.7	35.5	0	0	0	110.9	K802	K802-D808 WeakPolarHBondContact CE-OD1 3.39Å; K802-D808 WeakPolarHBondContact CG-OD1 3.36Å; K802-D808 IonicContact NZ-OD1 2.81Å; K802-D808 PolarHBondContact NZ-OD1 2.92Å; K802-D808 IonicContact NZ-OD2 2.73Å
809	F	92.3	Very high	89.7	Confident	22 Å²	22	45.8 Å²	45.8	10%	0.096	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	117.9	171.2	-56.9	-84.4	0	0	0	108.1	S719 D720 L721 F723 C801 R807	S719-F809 WeakPolarHBondContact O-CZ 3.47Å; D720-F809 HydrophobicContact CB-CE1 4.44Å; L721-F809 HydrophobicContact CB-CD1 4.28Å; L721-F809 HydrophobicContact CB-CD2 4.03Å; L721-F809 HydrophobicContact CB-CE1 4.28Å; L721-F809 HydrophobicContact CB-CE2 4.02Å; L721-F809 HydrophobicContact CB-CG 4.16Å; L721-F809 HydrophobicContact CB-CZ 4.16Å; L721-F809 HydrophobicContact CD1-CD2 4.11Å; L721-F809 HydrophobicContact CD1-CE2 4.06Å; L721-F809 HydrophobicContact CG-CD2 4.23Å; L721-F809 HydrophobicContact CG-CE2 3.9Å; L721-F809 HydrophobicContact CG-CZ 4.24Å; L721-F809 VanDerWaalsContact N-CE1 3.27Å; L721-F809 WeakPolarHBondContact O-CD1 3.24Å; F723-F809 HydrophobicContact CE2-CB 4.07Å; C801-F809 HydrophobicContact CB-CB 4.38Å; C801-F809 PolarHBondContact N-O 2.78Å; C801-F809 PolarHBondContact O-N 2.94Å; R807-F809 HydrophobicContact CB-CE2 3.77Å; R807-F809 HydrophobicContact CB-CZ 3.96Å
810	V	93.4	Very high	88.9	Confident	65 Å²	65	47 Å²	47	39%	0.394	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.7	-169.6	-172	0	0	0	0	110.3	Q798 L799 R800	Q798-V810 HydrophobicContact CB-CG1 3.77Å; Q798-V810 HydrophobicContact CG-CG1 3.97Å; L799-V810 WeakPolarHBondContact O-CA 3.3Å; R800-V810 HydrophobicContact CG-CG2 4.19Å
811	L	94.5	Very high	88.1	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	101.3	174.9	-176.2	61.5	0	0	0	110.2	F723 Q725 V728 V743 L785 L799 C813	F723-L811 HydrophobicContact CB-CD1 4.41Å; F723-L811 HydrophobicContact CD1-CD2 4.05Å; F723-L811 HydrophobicContact CD2-CB 4.18Å; F723-L811 HydrophobicContact CD2-CD1 4.39Å; F723-L811 HydrophobicContact CE1-CD2 4.04Å; F723-L811 HydrophobicContact CE2-CB 3.94Å; F723-L811 HydrophobicContact CG-CD1 4.26Å; F723-L811 HydrophobicContact CG-CD2 4.4Å; F723-L811 HydrophobicContact CZ-CB 4.17Å; F723-L811 HydrophobicContact CZ-CD2 4.38Å; Q725-L811 VanDerWaalsContact O-CD1 3.3Å; Q725-L811 WeakPolarHBondContact O-CD1 3.2Å; V728-L811 HydrophobicContact CG2-CD1 4.14Å; V728-L811 HydrophobicContact CG2-CD2 3.88Å; V728-L811 HydrophobicContact CG2-CG 4.08Å; V743-L811 HydrophobicContact CG1-CD2 4.13Å; V743-L811 HydrophobicContact CG2-CD2 4.42Å; L785-L811 HydrophobicContact CD1-CD2 4.03Å; L799-L811 HydrophobicContact CB-CB 4.42Å; L799-L811 PolarHBondContact N-O 2.87Å; L799-L811 PolarHBondContact O-N 2.93Å; L811-C813 PolarHBondContact O-SG 2.89Å
812	P	95.9	Very high	87.6	Confident	40 Å²	40	46.2 Å²	46.2	26%	0.26	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	137.6	171.1	-24.9	34.4	0	0	0	112.4	I726 Q727 V728	I726-P812 WeakPolarHBondContact O-CD 3.28Å; Q727-P812 WeakPolarHBondContact CA-O 3.49Å; Q727-P812 HydrophobicContact CB-CB 4.36Å; Q727-P812 HydrophobicContact CG-CB 4.18Å; V728-P812 PolarHBondContact N-O 3.42Å
813	C	94.6	Very high	87	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.2	-174.9	-70.9	0	0	0	0	111.2	V728 F730 F797 L811	V728-C813 CarbonylContact O-C 3.33Å; V728-C813 WeakPolarHBondContact O-CA 3.39Å; F730-C813 HydrophobicContact CE2-CB 4.16Å; F797-C813 HydrophobicContact CD1-CB 4.15Å; F797-C813 HydrophobicContact CD2-CB 3.88Å; F797-C813 HydrophobicContact CE1-CB 3.69Å; F797-C813 HydrophobicContact CE2-CB 3.38Å; F797-C813 HydrophobicContact CG-CB 4.23Å; F797-C813 HydrophobicContact CZ-CB 3.28Å; F797-C813 PolarHBondContact N-O 3.29Å; F797-C813 PolarHBondContact O-N 2.62Å; L811-C813 PolarHBondContact O-SG 2.89Å
814	R	94.4	Very high	86.7	Confident	97 Å²	97	48.2 Å²	48.2	37%	0.366	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	147.3	177.4	-171.8	-180	-177.2	-143.4	7	111.1	V728 D729 F730 E794 Y795	V728-R814 PolarHBondContact O-N 3.25Å; D729-R814 CarbonylContact C-O 3.53Å; D729-R814 WeakPolarHBondContact CA-O 3.46Å; D729-R814 IonicContact OD2-NH1 3.65Å; F730-R814 VanDerWaalsContact CD2-O 3.23Å; F730-R814 WeakPolarHBondContact CD2-O 3.45Å; F730-R814 PolarHBondContact N-O 3.17Å; E794-R814 IonicContact OE1-CZ 3.81Å; E794-R814 IonicContact OE1-NE 3.52Å; E794-R814 PolarHBondContact OE1-NE 3.16Å; E794-R814 IonicContact OE1-NH2 3.95Å; E794-R814 PolarHBondContact OE1-NH2 2.73Å; Y795-R814 CarbonylContact O-C 3.39Å; Y795-R814 WeakPolarHBondContact O-CA 3.39Å
815	G	91.9	Very high	86.9	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	156.5	169.3	0	0	0	0	0	111.9	Y795	Y795-G815 WeakPolarHBondContact CB-O 3.24Å; Y795-G815 PolarHBondContact N-O 3.45Å; Y795-G815 PolarHBondContact O-N 3.35Å
816	V	88.2	Confident	87	Confident	34 Å²	34	50.6 Å²	50.6	21%	0.206	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	111.5	-178.3	-178.7	0	0	0	0	109.7	G731 H732 C733 E794	G731-V816 PolarHBondContact O-N 3.5Å; H732-V816 WeakPolarHBondContact CA-O 3.47Å; C733-V816 PolarHBondContact N-O 2.94Å; E794-V816 HydrophobicContact CB-CG2 4.5Å; E794-V816 HydrophobicContact CG-CG2 4.27Å
817	G	86.6	Confident	86.9	Confident	4 Å²	4	51.1 Å²	51.1	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	135.2	169	0	0	0	0	0	110.9	C733 P792 I793	C733-G817 CarbonylContact O-C 3.58Å; C733-G817 WeakPolarHBondContact O-CA 3.15Å; P792-G817 CarbonylContact C-O 3.52Å; P792-G817 VanDerWaalsContact C-O 3.27Å; P792-G817 VanDerWaalsContact CA-O 3.23Å; P792-G817 WeakPolarHBondContact CA-O 3.36Å; I793-G817 PolarHBondContact N-O 3.06Å; I793-G817 PolarHBondContact O-N 2.95Å
818	F	81.9	Confident	86.8	Confident	78 Å²	78	53.8 Å²	53.8	34%	0.342	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	152.6	171.4	74	-86.7	0	0	0	112.4	H732 C733 S734 I735 P820	H732-F818 HydrophobicContact CB-CD1 4.04Å; H732-F818 HydrophobicContact CB-CE1 3.98Å; C733-F818 VanDerWaalsContact C-CD1 3.45Å; C733-F818 VanDerWaalsContact C-CE1 3.44Å; C733-F818 VanDerWaalsContact O-CD1 3.23Å; C733-F818 WeakPolarHBondContact O-CD1 3.18Å; C733-F818 PolarHBondContact O-N 3.48Å; S734-F818 WeakPolarHBondContact CA-O 3.39Å; I735-F818 PolarHBondContact N-O 3.2Å; F818-P820 HydrophobicContact CE2-CB 4.28Å
819	H	76.9	Confident	86.6	Confident	46 Å²	46	52.6 Å²	52.6	21%	0.213	29%	0.288	C	S	.	.			trans	-86.8	122.2	170.3	-159.1	105.7	0	0	0	108.4	I735 Y736 P792 Y849	I735-H819 WeakPolarHBondContact CD1-ND1 3.34Å; Y736-H819 AromaticContact CE2-CE1 3.93Å; Y736-H819 AromaticContact CE2-NE2 3.89Å; Y736-H819 AromaticContact CZ-CE1 3.9Å; Y736-H819 PolarHBondContact OH-CE1 3.29Å; P792-H819 HydrophobicContact CB-CB 4.41Å; H819-Y849 AromaticContact CD2-CD1 3.51Å; H819-Y849 AromaticContact CD2-CE1 3.99Å; H819-Y849 AromaticContact NE2-CD1 3.61Å; H819-Y849 AromaticContact NE2-CE1 3.97Å
820	P	77.9	Confident	86.4	Confident	27 Å²	27	60.2 Å²	60.2	18%	0.175	32%	0.324	C	S	.	.			trans	-69.2	135.1	179.3	28.6	-33.3	0	0	0	109.7	S734 Y736 F818 L822	S734-P820 WeakPolarHBondContact OG-CD 3.42Å; Y736-P820 HydrophobicContact CD2-CG 3.64Å; Y736-P820 HydrophobicContact CE2-CG 3.98Å; F818-P820 HydrophobicContact CE2-CB 4.28Å; P820-L822 PolarHBondContact O-N 3.35Å
821	P	76.1	Confident	86.2	Confident	43 Å²	43	59.3 Å²	59.3	28%	0.279	32%	0.315	S	S	.	.	S	Bend	trans	-68.8	-20.2	-171.6	27.6	-35.9	0	0	0	113.2	N848 Y849 R869	P821-N848 CarbonylContact O-C 3.59Å; P821-N848 VanDerWaalsContact O-CA 3.23Å; P821-N848 WeakPolarHBondContact O-CA 3.33Å; P821-N848 PolarHBondContact O-OD1 3.27Å; P821-Y849 PolarHBondContact O-N 2.67Å; P821-R869 HydrophobicContact CB-CG 4.29Å; P821-R869 HydrophobicContact CG-CG 4.32Å
822	L	82.6	Confident	85.9	Confident	51 Å²	51	68.8 Å²	68.8	27%	0.267	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.3	177.5	-71.3	178.1	0	0	0	110.2	P820 L846 T847 N848 R869 F871 L890	P820-L822 PolarHBondContact O-N 3.35Å; L822-L846 HydrophobicContact CB-CD1 4.26Å; L822-L846 HydrophobicContact CD2-CG 4.5Å; L822-T847 WeakPolarHBondContact CA-O 3.32Å; L822-N848 HydrophobicContact CD2-CB 4.19Å; L822-R869 HydrophobicContact CD1-CB 4.18Å; L822-R869 HydrophobicContact CD2-CB 3.98Å; L822-R869 HydrophobicContact CG-CB 4.08Å; L822-F871 HydrophobicContact CD1-CB 3.96Å; L822-L890 HydrophobicContact CD2-CD1 3.82Å
823	V	81.2	Confident	85.5	Confident	37 Å²	37	73.5 Å²	73.5	22%	0.224	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.4	-176.6	-177.5	0	0	0	0	110.1	T847	V823-T847 PolarHBondContact N-O 2.9Å; V823-T847 PolarHBondContact O-N 2.83Å
824	L	85.3	Confident	85.2	Confident	70 Å²	70	74.8 Å²	74.8	37%	0.366	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	137.2	172.1	-74	171.8	0	0	0	110.7	H826 I844 L846 F873	L824-H826 VanDerWaalsContact C-N 3.26Å; L824-H826 PolarHBondContact O-N 2.82Å; L824-I844 HydrophobicContact CD2-CD1 3.83Å; L824-I844 HydrophobicContact CD2-CG1 4.24Å; L824-L846 HydrophobicContact CD2-CB 3.97Å; L824-L846 HydrophobicContact CD2-CD1 3.57Å; L824-L846 HydrophobicContact CD2-CG 4.33Å; L824-L846 HydrophobicContact CG-CD1 3.92Å; L824-F873 HydrophobicContact CD2-CZ 4.31Å
825	S	85.8	Confident	84.8	Confident	55 Å²	55	74 Å²	74	39%	0.385	40%	0.396	S	S	.	.	S	Bend	trans	-60.9	-31.6	173.6	55	0	0	0	0	114.2	Y845	S825-Y845 PolarHBondContact N-O 3.43Å; S825-Y845 PolarHBondContact OG-N 2.82Å; S825-Y845 PolarHBondContact OG-O 3.49Å
826	H	84.3	Confident	84.4	Confident	114 Å²	114	78.4 Å²	78.4	53%	0.528	42%	0.423	S	S	.	.			trans	-143.4	133.3	179.5	-59	83.6	0	0	0	108.9	L824 I844	L824-H826 VanDerWaalsContact C-N 3.26Å; L824-H826 PolarHBondContact O-N 2.82Å; H826-I844 HydrophobicContact CB-CG2 4.02Å
827	S	82.1	Confident	84	Confident	126 Å²	126	79.7 Å²	79.7	88%	0.881	44%	0.443	S	S	*	.	S	Bend	trans	-98.9	-19.7	176.4	52.7	0	0	0	0	113.5
828	L	85.6	Confident	84	Confident	142 Å²	142	83.6 Å²	83.6	74%	0.743	46%	0.463	S	S	*	.			trans	-117.4	132.8	176.1	-179.8	63.9	0	0	0	109.2
829	I	87.7	Confident	84.3	Confident	51 Å²	51	85.6 Å²	85.6	26%	0.262	47%	0.472	S	S	.	.			trans	-125.8	117.3	177.1	-57.6	176.4	0	0	0	108.1	F831 A842 I844 V900	I829-F831 HydrophobicContact CB-CE2 4.49Å; I829-F831 HydrophobicContact CG2-CD2 4.26Å; I829-F831 HydrophobicContact CG2-CE1 4.19Å; I829-F831 HydrophobicContact CG2-CE2 3.75Å; I829-F831 HydrophobicContact CG2-CZ 3.7Å; I829-A842 HydrophobicContact CG2-CB 3.48Å; I829-A842 VanDerWaalsContact CG2-CB 3.48Å; I829-I844 HydrophobicContact CD1-CD1 4.23Å; I829-I844 HydrophobicContact CD1-CG2 3.7Å; I829-I844 HydrophobicContact CG1-CG2 4.14Å; I829-V900 HydrophobicContact CD1-CB 3.93Å; I829-V900 HydrophobicContact CD1-CG1 4.14Å; I829-V900 HydrophobicContact CD1-CG2 3.65Å
830	Q	88.3	Confident	85	Confident	183 Å²	183	84.4 Å²	84.4	86%	0.855	47%	0.469	S	S	*	.			trans	-104.6	109.6	175.2	-172.8	173	-1.5	0	0	109.6
831	F	89.1	Confident	85.6	Confident	46 Å²	46	86.3 Å²	86.3	20%	0.202	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-74	152.2	174.3	-66.8	-79.3	0	0	0	111.3	I829 S840 A842 I881 V900 F902	I829-F831 HydrophobicContact CB-CE2 4.49Å; I829-F831 HydrophobicContact CG2-CD2 4.26Å; I829-F831 HydrophobicContact CG2-CE1 4.19Å; I829-F831 HydrophobicContact CG2-CE2 3.75Å; I829-F831 HydrophobicContact CG2-CZ 3.7Å; F831-S840 VanDerWaalsContact CE1-O 3.28Å; F831-S840 WeakPolarHBondContact CE1-O 3.37Å; F831-A842 HydrophobicContact CE1-CB 3.86Å; F831-A842 HydrophobicContact CZ-CB 4.26Å; F831-I881 HydrophobicContact CE2-CD1 4.36Å; F831-V900 WeakPolarHBondContact CE1-O 3.35Å; F831-V900 HydrophobicContact CE2-CG1 4.47Å; F831-V900 HydrophobicContact CZ-CB 4.31Å; F831-V900 HydrophobicContact CZ-CG1 3.84Å; F831-F902 HydrophobicContact CB-CD1 4.2Å; F831-F902 HydrophobicContact CD1-CB 3.77Å; F831-F902 HydrophobicContact CD2-CB 3.85Å; F831-F902 HydrophobicContact CD2-CG 4.33Å; F831-F902 HydrophobicContact CE1-CB 3.86Å; F831-F902 HydrophobicContact CE2-CB 3.94Å; F831-F902 HydrophobicContact CG-CB 3.77Å; F831-F902 HydrophobicContact CG-CD1 4.31Å; F831-F902 HydrophobicContact CG-CG 4.32Å; F831-F902 HydrophobicContact CZ-CB 3.94Å
832	R	87	Confident	86.4	Confident	201 Å²	201	85.5 Å²	85.5	76%	0.758	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-74.3	156.7	169.5	-74	-173.5	-77.1	170.3	-4.8	110	T834	R832-T834 PolarHBondContact O-N 2.8Å; R832-T834 PolarHBondContact O-OG1 2.81Å
833	P	88	Confident	86.8	Confident	138 Å²	138	86.8 Å²	86.8	90%	0.896	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-50.9	116	172.5	-26.5	35.5	0	0	0	110.3
834	T	88.8	Confident	87.3	Confident	27 Å²	27	85.5 Å²	85.5	17%	0.166	48%	0.478	C	S	.	.			trans	-116.1	124.2	-173.1	-54	0	0	0	0	107.9	R832 D838 S840 P904	R832-T834 PolarHBondContact O-N 2.8Å; R832-T834 PolarHBondContact O-OG1 2.81Å; T834-D838 HydrophobicContact CG2-CB 4.22Å; T834-S840 VanDerWaalsContact OG1-CB 3.27Å; T834-S840 WeakPolarHBondContact OG1-CB 3.23Å; T834-P904 HydrophobicContact CG2-CG 3.97Å
835	P	85.9	Confident	87.5	Confident	80 Å²	80	87.9 Å²	87.9	52%	0.519	48%	0.483	S	S	.	.			trans	-70.6	153.4	177.6	28.3	-31.6	0	0	0	111.3	G837 D838	P835-G837 PolarHBondContact O-N 2.95Å; P835-D838 HydrophobicContact CG-CB 3.77Å; P835-D838 WeakPolarHBondContact O-CB 3.38Å; P835-D838 PolarHBondContact O-N 2.89Å; P835-D838 VanDerWaalsContact O-N 3.12Å
836	V	83.4	Confident	87.6	Confident	93 Å²	93	85.7 Å²	85.7	56%	0.564	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	130.6	179.5	176.4	0	0	0	0	110.3	D838 L906	V836-D838 VanDerWaalsContact C-N 3.33Å; V836-L906 HydrophobicContact CG1-CB 3.93Å; V836-L906 HydrophobicContact CG2-CB 4.48Å
837	G	79.4	Confident	87.7	Confident	62 Å²	62	81.4 Å²	81.4	64%	0.639	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	-19	-178.3	0	0	0	0	0	115.3	P835 P904	P835-G837 PolarHBondContact O-N 2.95Å; G837-P904 PolarHBondContact N-O 2.87Å
838	D	85.9	Confident	87.8	Confident	86 Å²	86	75.7 Å²	75.7	46%	0.46	41%	0.408	S	S	.	.			trans	-84.2	175.9	171.2	-166	14.7	0	0	0	111.4	T834 P835 V836 R903	T834-D838 HydrophobicContact CG2-CB 4.22Å; P835-D838 HydrophobicContact CG-CB 3.77Å; P835-D838 WeakPolarHBondContact O-CB 3.38Å; P835-D838 PolarHBondContact O-N 2.89Å; P835-D838 VanDerWaalsContact O-N 3.12Å; V836-D838 VanDerWaalsContact C-N 3.33Å; D838-R903 WeakPolarHBondContact O-CG 3.31Å
839	K	88.3	Confident	87.1	Confident	120 Å²	120	73.9 Å²	73.9	52%	0.522	39%	0.392	S	S	.	.			trans	-133.3	136.4	-180	65.2	-176	-178.7	177.7	0	112.1	F902	K839-F902 CarbonylContact C-O 3.55Å; K839-F902 VanDerWaalsContact CA-O 3.29Å; K839-F902 WeakPolarHBondContact CA-O 3.28Å
840	S	91.8	Very high	86.2	Confident	21 Å²	21	75.8 Å²	75.8	15%	0.147	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.2	167.2	-175.6	0	0	0	0	109.8	F831 T834 M901 F902	F831-S840 VanDerWaalsContact CE1-O 3.28Å; F831-S840 WeakPolarHBondContact CE1-O 3.37Å; T834-S840 VanDerWaalsContact OG1-CB 3.27Å; T834-S840 WeakPolarHBondContact OG1-CB 3.23Å; S840-M901 WeakPolarHBondContact O-CA 3.4Å; S840-F902 PolarHBondContact N-O 3.37Å; S840-F902 PolarHBondContact O-N 3.01Å
841	T	91.5	Very high	84.9	Confident	67 Å²	67	69.5 Å²	69.5	41%	0.411	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.5	178.6	-55.3	0	0	0	0	110.9	Q899 M901	T841-Q899 HydrophobicContact CG2-CB 4.31Å; T841-M901 HydrophobicContact CG2-CG 3.97Å; T841-M901 WeakPolarHBondContact OG1-CG 3.23Å
842	A	91.6	Very high	83.3	Confident	25 Å²	25	75.9 Å²	75.9	21%	0.207	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	155.6	166.2	0	0	0	0	0	109.8	I829 F831 V900	I829-A842 HydrophobicContact CG2-CB 3.48Å; I829-A842 VanDerWaalsContact CG2-CB 3.48Å; F831-A842 HydrophobicContact CE1-CB 3.86Å; F831-A842 HydrophobicContact CZ-CB 4.26Å; A842-V900 PolarHBondContact N-O 2.89Å; A842-V900 PolarHBondContact O-N 3.2Å
843	T	92	Very high	81.6	Confident	78 Å²	78	72.3 Å²	72.3	48%	0.479	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.7	-179	45	0	0	0	0	110.7	L897 Q899	T843-L897 HydrophobicContact CG2-CD1 4.15Å; T843-Q899 HydrophobicContact CG2-CG 4.34Å
844	I	91.6	Very high	79.6	Confident	10 Å²	10	68 Å²	68	5%	0.051	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.7	172.9	68.8	-172.7	0	0	0	109.1	L824 H826 I829 V898 V900	L824-I844 HydrophobicContact CD2-CD1 3.83Å; L824-I844 HydrophobicContact CD2-CG1 4.24Å; H826-I844 HydrophobicContact CB-CG2 4.02Å; I829-I844 HydrophobicContact CD1-CD1 4.23Å; I829-I844 HydrophobicContact CD1-CG2 3.7Å; I829-I844 HydrophobicContact CG1-CG2 4.14Å; I844-V898 HydrophobicContact CD1-CG1 4.4Å; I844-V898 HydrophobicContact CG1-CB 3.83Å; I844-V898 HydrophobicContact CG1-CG1 4.19Å; I844-V898 PolarHBondContact N-O 3.19Å; I844-V898 WeakPolarHBondContact O-CA 3.43Å; I844-V898 PolarHBondContact O-N 2.92Å; I844-V900 HydrophobicContact CD1-CG2 4.04Å; I844-V900 HydrophobicContact CG1-CG2 4.42Å
845	Y	89.6	Confident	77.7	Confident	121 Å²	121	70.9 Å²	70.9	48%	0.475	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	136.6	168.3	-62.6	-84	0	0	0	110.5	S825 C896 L897	S825-Y845 PolarHBondContact N-O 3.43Å; S825-Y845 PolarHBondContact OG-N 2.82Å; S825-Y845 PolarHBondContact OG-O 3.49Å; Y845-C896 WeakPolarHBondContact CA-O 3.35Å; Y845-L897 HydrophobicContact CD1-CD1 4.12Å; Y845-L897 HydrophobicContact CE1-CB 4.33Å; Y845-L897 HydrophobicContact CE1-CD1 3.64Å; Y845-L897 HydrophobicContact CE2-CD1 4.41Å
846	L	87.9	Confident	75.9	Confident	8 Å²	8	72.6 Å²	72.6	4%	0.042	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.2	167	179.9	66.1	0	0	0	108.3	L822 L824 F871 F873 L890 R895 C896 V898	L822-L846 HydrophobicContact CB-CD1 4.26Å; L822-L846 HydrophobicContact CD2-CG 4.5Å; L824-L846 HydrophobicContact CD2-CB 3.97Å; L824-L846 HydrophobicContact CD2-CD1 3.57Å; L824-L846 HydrophobicContact CD2-CG 4.33Å; L824-L846 HydrophobicContact CG-CD1 3.92Å; L846-F871 HydrophobicContact CD2-CB 3.81Å; L846-F871 HydrophobicContact CD2-CD1 3.56Å; L846-F871 HydrophobicContact CD2-CD2 3.66Å; L846-F871 HydrophobicContact CD2-CE1 3.93Å; L846-F871 HydrophobicContact CD2-CE2 4.04Å; L846-F871 HydrophobicContact CD2-CG 3.4Å; L846-F871 HydrophobicContact CD2-CZ 4.15Å; L846-F873 HydrophobicContact CD2-CE2 4.5Å; L846-F873 HydrophobicContact CD2-CZ 4.33Å; L846-L890 HydrophobicContact CB-CD1 4.4Å; L846-L890 HydrophobicContact CD2-CD1 3.83Å; L846-L890 HydrophobicContact CG-CD1 3.75Å; L846-R895 CarbonylContact O-C 3.59Å; L846-R895 WeakPolarHBondContact O-CA 3.45Å; L846-C896 PolarHBondContact N-O 3.37Å; L846-C896 PolarHBondContact O-N 3.43Å; L846-V898 HydrophobicContact CB-CG2 4.09Å
847	T	85.6	Confident	74.2	Confident	25 Å²	25	77.3 Å²	77.3	15%	0.153	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136	-175.8	-55.7	0	0	0	0	110.4	L822 V823 Y849 E894 R895	L822-T847 WeakPolarHBondContact CA-O 3.32Å; V823-T847 PolarHBondContact N-O 2.9Å; V823-T847 PolarHBondContact O-N 2.83Å; T847-Y849 PolarHBondContact O-N 3.09Å; T847-E894 WeakPolarHBondContact CA-O 3.49Å; T847-R895 HydrophobicContact CG2-CG 3.9Å; T847-R895 WeakPolarHBondContact OG1-CG 3.17Å
848	N	84.8	Confident	72.3	Confident	5 Å²	5	80.7 Å²	80.7	3%	0.027	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	89.7	166.9	-171.4	2.7	0	0	0	109.2	P821 L822 Q850 L890 L891 P892 G893 E894	P821-N848 CarbonylContact O-C 3.59Å; P821-N848 VanDerWaalsContact O-CA 3.23Å; P821-N848 WeakPolarHBondContact O-CA 3.33Å; P821-N848 PolarHBondContact O-OD1 3.27Å; L822-N848 HydrophobicContact CD2-CB 4.19Å; N848-Q850 PolarHBondContact O-N 2.95Å; N848-L890 HydrophobicContact CB-CB 3.91Å; N848-L890 PolarHBondContact ND2-O 3Å; N848-L891 VanDerWaalsContact CB-O 3.3Å; N848-L891 WeakPolarHBondContact CB-O 3.48Å; N848-L891 VanDerWaalsContact ND2-C 3.32Å; N848-L891 PolarHBondContact ND2-O 2.91Å; N848-L891 VanDerWaalsContact ND2-O 3.13Å; N848-P892 WeakPolarHBondContact ND2-CA 3.38Å; N848-G893 WeakPolarHBondContact O-CA 3.34Å; N848-G893 PolarHBondContact O-N 3.33Å; N848-E894 PolarHBondContact N-O 3.37Å
849	Y	71.6	Confident	70.1	Confident	104 Å²	104	85.4 Å²	85.4	41%	0.408	43%	0.431	S	S	.	.			trans	-73.8	120.3	-175.5	-177.2	-97	0	0	0	111.4	H819 P821 T847 D851	H819-Y849 AromaticContact CD2-CD1 3.51Å; H819-Y849 AromaticContact CD2-CE1 3.99Å; H819-Y849 AromaticContact NE2-CD1 3.61Å; H819-Y849 AromaticContact NE2-CE1 3.97Å; P821-Y849 PolarHBondContact O-N 2.67Å; T847-Y849 PolarHBondContact O-N 3.09Å; Y849-D851 HydrophobicContact CE1-CB 3.92Å
850	Q	68.8	Low	67.7	Low	92 Å²	92	89.7 Å²	89.7	43%	0.43	45%	0.449	S	S	.	.			trans	-102.4	123.4	164.5	-96.4	-179.8	-21.5	0	0	109.8	N848 K852 P892	N848-Q850 PolarHBondContact O-N 2.95Å; Q850-K852 PolarHBondContact O-N 3.33Å; Q850-P892 HydrophobicContact CG-CB 3.87Å; Q850-P892 VanDerWaalsContact NE2-CB 3.34Å
851	D	60.6	Low	65	Low	50 Å²	50	94.3 Å²	94.3	27%	0.267	48%	0.477	S	S	.	.			trans	-77.6	110.3	164.7	-172.9	-28.6	0	0	0	109	Y849 E853 A854 A855	Y849-D851 HydrophobicContact CE1-CB 3.92Å; D851-E853 VanDerWaalsContact C-N 3.25Å; D851-E853 PolarHBondContact O-N 3.01Å; D851-E853 WeakPolarHBondContact OD1-CA 3.38Å; D851-E853 PolarHBondContact OD1-N 2.77Å; D851-A854 HydrophobicContact CB-CB 3.78Å; D851-A854 PolarHBondContact OD1-N 3.47Å; D851-A855 PolarHBondContact O-N 2.85Å
852	K	56	Low	62.2	Low	181 Å²	181	98.7 Å²	98.7	79%	0.787	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-19.6	-179	-65.8	-171.3	-178.6	-172.1	0	113.2	Q850 T856	Q850-K852 PolarHBondContact O-N 3.33Å; K852-T856 PolarHBondContact O-OG1 3.3Å
853	E	49.8	Very low	59.8	Low	126 Å²	126	102.7 Å²	102.7	59%	0.589	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-32.3	179.4	-61.7	-169.9	-165.5	0	0	112.4	D851 A855 T856 R857	D851-E853 VanDerWaalsContact C-N 3.25Å; D851-E853 PolarHBondContact O-N 3.01Å; D851-E853 WeakPolarHBondContact OD1-CA 3.38Å; D851-E853 PolarHBondContact OD1-N 2.77Å; E853-A855 VanDerWaalsContact C-N 3.3Å; E853-A855 PolarHBondContact O-N 3Å; E853-T856 PolarHBondContact O-N 3.28Å; E853-T856 PolarHBondContact O-OG1 2.92Å; E853-T856 VanDerWaalsContact O-OG1 3.13Å; E853-R857 IonicContact OE2-NH2 2.7Å
854	A	47.5	Very low	57.3	Low	48 Å²	48	103.7 Å²	103.7	40%	0.397	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-62.8	-39.5	173.7	0	0	0	0	0	111.6	D851 T856 R857	D851-A854 HydrophobicContact CB-CB 3.78Å; D851-A854 PolarHBondContact OD1-N 3.47Å; A854-T856 PolarHBondContact O-N 2.67Å; A854-T856 VanDerWaalsContact O-N 3.12Å; A854-R857 PolarHBondContact O-N 2.86Å; A854-R857 VanDerWaalsContact O-N 3.14Å
855	A	47	Very low	55	Low	86 Å²	86	108.8 Å²	108.8	71%	0.711	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-60	-19.7	177.4	0	0	0	0	0	114.1	D851 E853	D851-A855 PolarHBondContact O-N 2.85Å; E853-A855 VanDerWaalsContact C-N 3.3Å; E853-A855 PolarHBondContact O-N 3Å
856	T	48.1	Very low	53.5	Low	117 Å²	117	109.6 Å²	109.6	72%	0.718	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-91.2	-12.7	179.2	-2.7	0	0	0	0	114	K852 E853 A854	K852-T856 PolarHBondContact O-OG1 3.3Å; E853-T856 PolarHBondContact O-N 3.28Å; E853-T856 PolarHBondContact O-OG1 2.92Å; E853-T856 VanDerWaalsContact O-OG1 3.13Å; A854-T856 PolarHBondContact O-N 2.67Å; A854-T856 VanDerWaalsContact O-N 3.12Å
857	R	48.6	Very low	52.2	Low	191 Å²	191	111.5 Å²	111.5	72%	0.721	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-13.5	-168.8	-60.5	-172.7	-163.3	-159.2	8.3	115.3	E853 A854	E853-R857 IonicContact OE2-NH2 2.7Å; A854-R857 PolarHBondContact O-N 2.86Å; A854-R857 VanDerWaalsContact O-N 3.14Å
858	L	40.6	Very low	51.7	Low	133 Å²	133	112 Å²	112	70%	0.696	60%	0.599	S	S	*	*	S	Bend	trans	-117.3	100.8	178.1	-75.3	170	0	0	0	111.6
859	F	38.3	Very low	51.5	Low	185 Å²	185	117.6 Å²	117.6	81%	0.811	62%	0.619	S	S	*	*			trans	57.2	106.9	162.1	-67.3	-88.4	0	0	0	119	V861	F859-V861 PolarHBondContact O-N 2.72Å; F859-V861 VanDerWaalsContact O-N 3.11Å
860	K	38.8	Very low	52.2	Low	210 Å²	210	119 Å²	119	91%	0.913	63%	0.633	S	S	*	*	S	Bend	trans	-59.7	103.7	137.4	-87.9	-177.2	171.8	179	0	108.5
861	V	34.7	Very low	53.1	Low	119 Å²	119	115.4 Å²	115.4	72%	0.721	62%	0.616	S	S	*	*	S	Bend	trans	171.1	137.2	145.3	145.9	0	0	0	0	108.1	F859	F859-V861 PolarHBondContact O-N 2.72Å; F859-V861 VanDerWaalsContact O-N 3.11Å
862	I	32.8	Very low	54.5	Low	158 Å²	158	117.4 Å²	117.4	81%	0.81	63%	0.633	S	S	*	*	S	Bend	trans	67.9	126.6	-169.9	-55.8	163.5	0	0	0	113	A864	I862-A864 PolarHBondContact O-N 3.03Å
863	S	40.3	Very low	56	Low	109 Å²	109	111.1 Å²	111.1	76%	0.762	61%	0.606	S	S	*	*			trans	-68.5	97.4	174.1	-56.3	0	0	0	0	110.6	V865	S863-V865 PolarHBondContact O-N 3.07Å
864	A	39.9	Very low	57.7	Low	100 Å²	100	110.5 Å²	110.5	83%	0.826	62%	0.616	S	S	*	*			trans	-67.4	85.8	164	0	0	0	0	0	109	I862	I862-A864 PolarHBondContact O-N 3.03Å
865	V	43.9	Very low	59.5	Low	117 Å²	117	111.6 Å²	111.6	71%	0.709	61%	0.614	S	S	*	*			trans	-45.2	143.5	174.8	175.1	0	0	0	0	110	S863 A867	S863-V865 PolarHBondContact O-N 3.07Å; V865-A867 PolarHBondContact O-N 3.45Å
866	E	57.6	Low	61.3	Low	137 Å²	137	112 Å²	112	64%	0.64	61%	0.61	S	S	*	*			trans	-63.7	67	172.8	-71.3	-172.1	135.7	0	0	111.6	P868 P892	E866-P868 WeakPolarHBondContact O-CD 3.49Å; E866-P892 HydrophobicContact CB-CG 3.97Å
867	A	61.9	Low	62.5	Low	49 Å²	49	116.5 Å²	116.5	41%	0.405	62%	0.619	S	S	.	*			trans	-71.4	112	-165.3	0	0	0	0	0	110.1	V865 R869	V865-A867 PolarHBondContact O-N 3.45Å; A867-R869 PolarHBondContact O-N 2.83Å
868	P	73.8	Confident	63.6	Low	34 Å²	34	113.3 Å²	113.3	22%	0.221	62%	0.617	C	S	.	*	P	Polyproline II helix	trans	-63.6	132.7	179.1	22.3	-30.1	0	0	0	110.3	E866 R889 L890 L891	E866-P868 WeakPolarHBondContact O-CD 3.49Å; P868-R889 HydrophobicContact CB-CG 3.78Å; P868-R889 HydrophobicContact CG-CG 4.31Å; P868-R889 VanDerWaalsContact CG-NE 3.26Å; P868-L890 CarbonylContact C-O 3.59Å; P868-L890 WeakPolarHBondContact CA-O 3.46Å; P868-L890 WeakPolarHBondContact CB-O 3.23Å; P868-L891 HydrophobicContact CB-CD2 4.08Å; P868-L891 HydrophobicContact CG-CD2 4.4Å
869	R	81.6	Confident	65.6	Low	123 Å²	123	109 Å²	109	46%	0.464	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.4	129.7	-178.1	-62.8	-60.1	-178	172.8	-2.4	109.8	P821 L822 A867 R889 L890	P821-R869 HydrophobicContact CB-CG 4.29Å; P821-R869 HydrophobicContact CG-CG 4.32Å; L822-R869 HydrophobicContact CD1-CB 4.18Å; L822-R869 HydrophobicContact CD2-CB 3.98Å; L822-R869 HydrophobicContact CG-CB 4.08Å; A867-R869 PolarHBondContact O-N 2.83Å; R869-R889 WeakPolarHBondContact O-CA 2.77Å; R869-L890 PolarHBondContact N-O 3.21Å; R869-L890 PolarHBondContact O-N 3.25Å
870	L	86.3	Confident	67.8	Low	134 Å²	134	102.3 Å²	102.3	70%	0.702	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.6	143	169.1	-60.6	177.6	0	0	0	109.3	G888 R889	L870-G888 WeakPolarHBondContact CA-O 3.36Å; L870-R889 HydrophobicContact CD2-CB 3.81Å; L870-R889 HydrophobicContact CD2-CG 3.94Å
871	F	87.3	Confident	70.3	Confident	16 Å²	16	95 Å²	95	7%	0.07	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151	172.1	68.7	-94	0	0	0	110.7	L822 L846 F873 P885 V887 G888 L890 C896	L822-F871 HydrophobicContact CD1-CB 3.96Å; L846-F871 HydrophobicContact CD2-CB 3.81Å; L846-F871 HydrophobicContact CD2-CD1 3.56Å; L846-F871 HydrophobicContact CD2-CD2 3.66Å; L846-F871 HydrophobicContact CD2-CE1 3.93Å; L846-F871 HydrophobicContact CD2-CE2 4.04Å; L846-F871 HydrophobicContact CD2-CG 3.4Å; L846-F871 HydrophobicContact CD2-CZ 4.15Å; F871-F873 HydrophobicContact CD2-CD2 4.01Å; F871-F873 AromaticContact CD2-CE2 3.63Å; F871-F873 HydrophobicContact CD2-CE2 3.63Å; F871-F873 HydrophobicContact CE2-CD2 4.17Å; F871-F873 AromaticContact CE2-CE2 3.72Å; F871-F873 HydrophobicContact CE2-CE2 3.72Å; F871-P885 HydrophobicContact CE2-CG 4.29Å; F871-P885 HydrophobicContact CZ-CG 4.02Å; F871-V887 WeakPolarHBondContact O-CA 3.41Å; F871-G888 WeakPolarHBondContact CD1-O 3.44Å; F871-G888 VanDerWaalsContact CE1-C 3.45Å; F871-G888 VanDerWaalsContact CE1-CA 3.43Å; F871-G888 PolarHBondContact N-O 2.96Å; F871-G888 PolarHBondContact O-N 2.97Å; F871-L890 HydrophobicContact CD1-CD1 4.02Å; F871-L890 HydrophobicContact CD1-CG 4.24Å; F871-L890 HydrophobicContact CE1-CD1 4.06Å; F871-L890 HydrophobicContact CE1-CG 4.03Å; F871-C896 HydrophobicContact CE1-CB 4.46Å; F871-C896 HydrophobicContact CZ-CB 4.41Å
872	C	89.8	Confident	72.8	Confident	92 Å²	92	91.4 Å²	91.4	62%	0.622	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.1	131.1	177.1	179.3	0	0	0	0	109	S886 V887	C872-S886 CarbonylContact C-O 3.6Å; C872-S886 WeakPolarHBondContact CA-O 3.29Å; C872-V887 HydrophobicContact CB-CG2 4.28Å
873	F	87.9	Confident	75.7	Confident	49 Å²	49	85.4 Å²	85.4	22%	0.215	49%	0.49	C	S	.	.			trans	-101	104.7	174.6	-67.6	-79	0	0	0	109.8	L824 L846 F871 I883 S886 V898	L824-F873 HydrophobicContact CD2-CZ 4.31Å; L846-F873 HydrophobicContact CD2-CE2 4.5Å; L846-F873 HydrophobicContact CD2-CZ 4.33Å; F871-F873 HydrophobicContact CD2-CD2 4.01Å; F871-F873 AromaticContact CD2-CE2 3.63Å; F871-F873 HydrophobicContact CD2-CE2 3.63Å; F871-F873 HydrophobicContact CE2-CD2 4.17Å; F871-F873 AromaticContact CE2-CE2 3.72Å; F871-F873 HydrophobicContact CE2-CE2 3.72Å; F873-I883 HydrophobicContact CB-CB 4.42Å; F873-I883 HydrophobicContact CB-CD1 4.03Å; F873-I883 HydrophobicContact CB-CG2 4.11Å; F873-I883 HydrophobicContact CD1-CD1 4.18Å; F873-I883 HydrophobicContact CD1-CG2 4.47Å; F873-I883 HydrophobicContact CD2-CG2 3.71Å; F873-I883 HydrophobicContact CE2-CG2 4.21Å; F873-I883 HydrophobicContact CG-CD1 4.21Å; F873-I883 HydrophobicContact CG-CG2 3.86Å; F873-S886 PolarHBondContact N-O 2.77Å; F873-V898 HydrophobicContact CD2-CG1 4.48Å; F873-V898 HydrophobicContact CE2-CB 4.5Å; F873-V898 HydrophobicContact CE2-CG1 3.8Å; F873-V898 HydrophobicContact CE2-CG2 3.89Å; F873-V898 HydrophobicContact CZ-CG1 4Å; F873-V898 HydrophobicContact CZ-CG2 4.12Å
874	S	84.9	Confident	78	Confident	114 Å²	114	83.5 Å²	83.5	80%	0.797	48%	0.477	S	S	*	.			trans	-82	115	172.4	42.1	0	0	0	0	110.9
875	L	84.7	Confident	80.4	Confident	70 Å²	70	80.8 Å²	80.8	37%	0.366	45%	0.451	S	S	.	.			trans	-94.7	145.8	174.3	-73.4	161.4	0	0	0	110.7	I881 I883	L875-I881 WeakPolarHBondContact CD1-O 3.26Å; L875-I883 HydrophobicContact CD1-CB 4.35Å; L875-I883 HydrophobicContact CD1-CD1 4.49Å; L875-I883 HydrophobicContact CD1-CG1 4.22Å; L875-I883 HydrophobicContact CD2-CD1 3.82Å; L875-I883 HydrophobicContact CD2-CG1 4.17Å; L875-I883 HydrophobicContact CG-CD1 4.25Å
876	P	85	Confident	82.4	Confident	94 Å²	94	78.1 Å²	78.1	61%	0.61	44%	0.437	S	S	*	.			trans	-56.2	143.8	167.4	-23.8	34.2	0	0	0	111.3	D878 S879	P876-D878 PolarHBondContact O-N 2.85Å; P876-D878 VanDerWaalsContact O-N 3.1Å; P876-S879 WeakPolarHBondContact O-CB 3.47Å; P876-S879 PolarHBondContact O-N 2.77Å
877	K	73.8	Confident	83.9	Confident	212 Å²	212	76 Å²	76	92%	0.922	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.6	-176.3	-63.8	-175.6	179.8	-178.3	0	113.5
878	D	71.8	Confident	85.1	Confident	125 Å²	125	74.6 Å²	74.6	67%	0.668	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	42.5	-177.4	-72.4	-59.5	0	0	0	111.4	P876 R907	P876-D878 PolarHBondContact O-N 2.85Å; P876-D878 VanDerWaalsContact O-N 3.1Å; D878-R907 PolarHBondContact O-NH2 2.87Å; D878-R907 IonicContact OD1-NH1 3.27Å
879	S	81.8	Confident	85.7	Confident	42 Å²	42	81.4 Å²	81.4	29%	0.294	45%	0.445	S	S	.	.			trans	-96.3	121.4	-176.9	175.9	0	0	0	0	113	P876 I881	P876-S879 WeakPolarHBondContact O-CB 3.47Å; P876-S879 PolarHBondContact O-N 2.77Å; S879-I881 PolarHBondContact O-N 2.86Å; S879-I881 PolarHBondContact OG-N 2.73Å; S879-I881 VanDerWaalsContact OG-N 3.07Å; S879-I881 PolarHBondContact OG-O 2.98Å
880	D	86.3	Confident	85.9	Confident	44 Å²	44	75.6 Å²	75.6	24%	0.235	42%	0.424	C	S	.	.	S	Bend	trans	-74.4	3.6	168.5	-72.2	31.2	0	0	0	112.5	F902 R903 P904 V905 R907	D880-F902 HydrophobicContact CB-CD2 4.17Å; D880-F902 HydrophobicContact CB-CE2 3.84Å; D880-R903 PolarHBondContact O-N 2.9Å; D880-P904 WeakPolarHBondContact OD2-CA 3.47Å; D880-V905 PolarHBondContact OD2-N 3.19Å; D880-R907 IonicContact OD1-CZ 3.91Å; D880-R907 IonicContact OD1-NE 3.77Å; D880-R907 IonicContact OD1-NH2 2.68Å; D880-R907 PolarHBondContact OD1-NH2 2.84Å
881	I	90	Very high	85.7	Confident	57 Å²	57	73.9 Å²	73.9	29%	0.292	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.8	175.3	-57.7	171.1	0	0	0	109.7	F831 L875 S879 V900 M901 F902	F831-I881 HydrophobicContact CE2-CD1 4.36Å; L875-I881 WeakPolarHBondContact CD1-O 3.26Å; S879-I881 PolarHBondContact O-N 2.86Å; S879-I881 PolarHBondContact OG-N 2.73Å; S879-I881 VanDerWaalsContact OG-N 3.07Å; S879-I881 PolarHBondContact OG-O 2.98Å; I881-V900 HydrophobicContact CG2-CG1 3.48Å; I881-V900 VanDerWaalsContact CG2-CG1 3.48Å; I881-M901 CarbonylContact C-O 3.45Å; I881-M901 WeakPolarHBondContact CA-O 3.4Å; I881-F902 HydrophobicContact CG1-CB 4.39Å; I881-F902 HydrophobicContact CG1-CD2 3.87Å
882	S	88.4	Confident	85.2	Confident	43 Å²	43	74.6 Å²	74.6	30%	0.301	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143	173	59.6	0	0	0	0	111.1	M901	S882-M901 PolarHBondContact N-O 3.09Å; S882-M901 PolarHBondContact O-N 3.28Å; S882-M901 PolarHBondContact OG-O 2.71Å
883	I	91.9	Very high	84.6	Confident	32 Å²	32	72.7 Å²	72.7	16%	0.164	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	133.4	-176.4	-62.9	174.7	0	0	0	109.6	F873 L875 V898 Q899 V900	F873-I883 HydrophobicContact CB-CB 4.42Å; F873-I883 HydrophobicContact CB-CD1 4.03Å; F873-I883 HydrophobicContact CB-CG2 4.11Å; F873-I883 HydrophobicContact CD1-CD1 4.18Å; F873-I883 HydrophobicContact CD1-CG2 4.47Å; F873-I883 HydrophobicContact CD2-CG2 3.71Å; F873-I883 HydrophobicContact CE2-CG2 4.21Å; F873-I883 HydrophobicContact CG-CD1 4.21Å; F873-I883 HydrophobicContact CG-CG2 3.86Å; L875-I883 HydrophobicContact CD1-CB 4.35Å; L875-I883 HydrophobicContact CD1-CD1 4.49Å; L875-I883 HydrophobicContact CD1-CG1 4.22Å; L875-I883 HydrophobicContact CD2-CD1 3.82Å; L875-I883 HydrophobicContact CD2-CG1 4.17Å; L875-I883 HydrophobicContact CG-CD1 4.25Å; I883-V898 HydrophobicContact CG2-CG1 3.43Å; I883-V898 VanDerWaalsContact CG2-CG1 3.43Å; I883-Q899 WeakPolarHBondContact CA-O 3.19Å; I883-V900 HydrophobicContact CG1-CG1 4.06Å; I883-V900 HydrophobicContact CG1-CG2 4.23Å
884	S	90	Very high	84.4	Confident	69 Å²	69	74.4 Å²	74.4	48%	0.483	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	128.2	178.9	-170.9	0	0	0	0	112	Q899	S884-Q899 PolarHBondContact N-O 2.98Å; S884-Q899 PolarHBondContact O-N 3.04Å
885	P	89.9	Confident	84.5	Confident	44 Å²	44	77.5 Å²	77.5	29%	0.286	42%	0.419	S	S	.	.	S	Bend	cis	-68.6	138.1	-8.1	29.8	-34.7	0	0	0	111.3	F871 L897	F871-P885 HydrophobicContact CE2-CG 4.29Å; F871-P885 HydrophobicContact CZ-CG 4.02Å; P885-L897 WeakPolarHBondContact CD-O 3.33Å
886	S	85.7	Confident	84.6	Confident	60 Å²	60	75.4 Å²	75.4	42%	0.42	41%	0.411	S	S	.	.	S	Bend	trans	-77	-26.5	176.3	54.3	0	0	0	0	112.9	C872 F873	C872-S886 CarbonylContact C-O 3.6Å; C872-S886 WeakPolarHBondContact CA-O 3.29Å; F873-S886 PolarHBondContact N-O 2.77Å
887	V	88.5	Confident	84.9	Confident	92 Å²	92	74.4 Å²	74.4	56%	0.558	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	143.1	177.4	-178	0	0	0	0	108.5	F871 C872	F871-V887 WeakPolarHBondContact O-CA 3.41Å; C872-V887 HydrophobicContact CB-CG2 4.28Å
888	G	87.1	Confident	85.7	Confident	21 Å²	21	64.3 Å²	64.3	22%	0.216	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	-178.4	175.1	0	0	0	0	0	114.4	L870 F871	L870-G888 WeakPolarHBondContact CA-O 3.36Å; F871-G888 WeakPolarHBondContact CD1-O 3.44Å; F871-G888 VanDerWaalsContact CE1-C 3.45Å; F871-G888 VanDerWaalsContact CE1-CA 3.43Å; F871-G888 PolarHBondContact N-O 2.96Å; F871-G888 PolarHBondContact O-N 2.97Å
889	R	86.4	Confident	86.6	Confident	177 Å²	177	62.3 Å²	62.3	67%	0.668	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	128.6	-178.5	-177.7	-178	-169.7	-159	3.7	107.6	P868 R869 L870	P868-R889 HydrophobicContact CB-CG 3.78Å; P868-R889 HydrophobicContact CG-CG 4.31Å; P868-R889 VanDerWaalsContact CG-NE 3.26Å; R869-R889 WeakPolarHBondContact O-CA 2.77Å; L870-R889 HydrophobicContact CD2-CB 3.81Å; L870-R889 HydrophobicContact CD2-CG 3.94Å
890	L	86.7	Confident	87.1	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.8	177.6	-82.2	166	0	0	0	110.5	L822 L846 N848 P868 R869 F871 E894 C896	L822-L890 HydrophobicContact CD2-CD1 3.82Å; L846-L890 HydrophobicContact CB-CD1 4.4Å; L846-L890 HydrophobicContact CD2-CD1 3.83Å; L846-L890 HydrophobicContact CG-CD1 3.75Å; N848-L890 HydrophobicContact CB-CB 3.91Å; N848-L890 PolarHBondContact ND2-O 3Å; P868-L890 CarbonylContact C-O 3.59Å; P868-L890 WeakPolarHBondContact CA-O 3.46Å; P868-L890 WeakPolarHBondContact CB-O 3.23Å; R869-L890 PolarHBondContact N-O 3.21Å; R869-L890 PolarHBondContact O-N 3.25Å; F871-L890 HydrophobicContact CD1-CD1 4.02Å; F871-L890 HydrophobicContact CD1-CG 4.24Å; F871-L890 HydrophobicContact CE1-CD1 4.06Å; F871-L890 HydrophobicContact CE1-CG 4.03Å; L890-E894 WeakPolarHBondContact CA-OE2 3.48Å; L890-E894 HydrophobicContact CD2-CB 3.75Å; L890-E894 HydrophobicContact CD2-CG 3.68Å; L890-C896 HydrophobicContact CD1-CB 4.34Å; L890-C896 HydrophobicContact CD2-CB 3.84Å; L890-C896 HydrophobicContact CG-CB 4.34Å
891	L	82.3	Confident	87.3	Confident	98 Å²	98	60.8 Å²	60.8	51%	0.513	33%	0.33	S	S	.	.			trans	-64.9	158.9	164.3	-69.8	164.1	0	0	0	110.4	N848 P868 E894	N848-L891 VanDerWaalsContact CB-O 3.3Å; N848-L891 WeakPolarHBondContact CB-O 3.48Å; N848-L891 VanDerWaalsContact ND2-C 3.32Å; N848-L891 PolarHBondContact ND2-O 2.91Å; N848-L891 VanDerWaalsContact ND2-O 3.13Å; P868-L891 HydrophobicContact CB-CD2 4.08Å; P868-L891 HydrophobicContact CG-CD2 4.4Å; L891-E894 HydrophobicContact CB-CB 4.28Å; L891-E894 WeakPolarHBondContact CB-OE2 3.39Å; L891-E894 PolarHBondContact N-OE2 2.85Å; L891-E894 WeakPolarHBondContact O-CB 3.45Å; L891-E894 PolarHBondContact O-N 3.15Å
892	P	76.4	Confident	87.4	Confident	30 Å²	30	60.7 Å²	60.7	20%	0.195	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	139.9	177.4	-22.9	36.1	0	0	0	112.5	N848 Q850 E866 E894	N848-P892 WeakPolarHBondContact ND2-CA 3.38Å; Q850-P892 HydrophobicContact CG-CB 3.87Å; Q850-P892 VanDerWaalsContact NE2-CB 3.34Å; E866-P892 HydrophobicContact CB-CG 3.97Å; P892-E894 PolarHBondContact O-N 3.01Å
893	G	77.4	Confident	87.5	Confident	52 Å²	52	64.2 Å²	64.2	54%	0.536	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	-14.8	-173.4	0	0	0	0	0	115.3	N848	N848-G893 WeakPolarHBondContact O-CA 3.34Å; N848-G893 PolarHBondContact O-N 3.33Å
894	E	83.2	Confident	87.3	Confident	85 Å²	85	63.5 Å²	63.5	40%	0.397	33%	0.332	S	S	.	.			trans	-69.5	152.7	-177.8	-165.4	-179.3	-173	0	0	112.5	T847 N848 L890 L891 P892	T847-E894 WeakPolarHBondContact CA-O 3.49Å; N848-E894 PolarHBondContact N-O 3.37Å; L890-E894 WeakPolarHBondContact CA-OE2 3.48Å; L890-E894 HydrophobicContact CD2-CB 3.75Å; L890-E894 HydrophobicContact CD2-CG 3.68Å; L891-E894 HydrophobicContact CB-CB 4.28Å; L891-E894 WeakPolarHBondContact CB-OE2 3.39Å; L891-E894 PolarHBondContact N-OE2 2.85Å; L891-E894 WeakPolarHBondContact O-CB 3.45Å; L891-E894 PolarHBondContact O-N 3.15Å; P892-E894 PolarHBondContact O-N 3.01Å
895	R	86.4	Confident	87	Confident	179 Å²	179	64.1 Å²	64.1	68%	0.675	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.5	118.3	177.1	-59.9	-170.3	177.4	169.2	0.4	111.2	L846 T847	L846-R895 CarbonylContact O-C 3.59Å; L846-R895 WeakPolarHBondContact O-CA 3.45Å; T847-R895 HydrophobicContact CG2-CG 3.9Å; T847-R895 WeakPolarHBondContact OG1-CG 3.17Å
896	C	88.1	Confident	86.5	Confident	27 Å²	27	67.5 Å²	67.5	18%	0.182	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136.7	172.1	-179.4	0	0	0	0	110	Y845 L846 F871 L890	Y845-C896 WeakPolarHBondContact CA-O 3.35Å; L846-C896 PolarHBondContact N-O 3.37Å; L846-C896 PolarHBondContact O-N 3.43Å; F871-C896 HydrophobicContact CE1-CB 4.46Å; F871-C896 HydrophobicContact CZ-CB 4.41Å; L890-C896 HydrophobicContact CD1-CB 4.34Å; L890-C896 HydrophobicContact CD2-CB 3.84Å; L890-C896 HydrophobicContact CG-CB 4.34Å
897	L	90.1	Very high	86.2	Confident	72 Å²	72	69.2 Å²	69.2	38%	0.377	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117.6	167.1	-178.8	73	0	0	0	109.1	T843 Y845 P885	T843-L897 HydrophobicContact CG2-CD1 4.15Å; Y845-L897 HydrophobicContact CD1-CD1 4.12Å; Y845-L897 HydrophobicContact CE1-CB 4.33Å; Y845-L897 HydrophobicContact CE1-CD1 3.64Å; Y845-L897 HydrophobicContact CE2-CD1 4.41Å; P885-L897 WeakPolarHBondContact CD-O 3.33Å
898	V	91.8	Very high	85.6	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118.6	176.2	179.9	0	0	0	0	108.8	I844 L846 F873 I883 V900	I844-V898 HydrophobicContact CD1-CG1 4.4Å; I844-V898 HydrophobicContact CG1-CB 3.83Å; I844-V898 HydrophobicContact CG1-CG1 4.19Å; I844-V898 PolarHBondContact N-O 3.19Å; I844-V898 WeakPolarHBondContact O-CA 3.43Å; I844-V898 PolarHBondContact O-N 2.92Å; L846-V898 HydrophobicContact CB-CG2 4.09Å; F873-V898 HydrophobicContact CD2-CG1 4.48Å; F873-V898 HydrophobicContact CE2-CB 4.5Å; F873-V898 HydrophobicContact CE2-CG1 3.8Å; F873-V898 HydrophobicContact CE2-CG2 3.89Å; F873-V898 HydrophobicContact CZ-CG1 4Å; F873-V898 HydrophobicContact CZ-CG2 4.12Å; I883-V898 HydrophobicContact CG2-CG1 3.43Å; I883-V898 VanDerWaalsContact CG2-CG1 3.43Å; V898-V900 HydrophobicContact CG1-CG2 4.45Å
899	Q	90.9	Very high	85.2	Confident	84 Å²	84	79.4 Å²	79.4	39%	0.393	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.7	174.7	-59.1	-171.9	-4.9	0	0	109.4	T841 T843 I883 S884	T841-Q899 HydrophobicContact CG2-CB 4.31Å; T843-Q899 HydrophobicContact CG2-CG 4.34Å; I883-Q899 WeakPolarHBondContact CA-O 3.19Å; S884-Q899 PolarHBondContact N-O 2.98Å; S884-Q899 PolarHBondContact O-N 3.04Å
900	V	92.1	Very high	84.8	Confident	8 Å²	8	74.3 Å²	74.3	5%	0.048	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	110.2	175.3	-171.1	0	0	0	0	107.3	I829 F831 A842 I844 I881 I883 V898	I829-V900 HydrophobicContact CD1-CB 3.93Å; I829-V900 HydrophobicContact CD1-CG1 4.14Å; I829-V900 HydrophobicContact CD1-CG2 3.65Å; F831-V900 WeakPolarHBondContact CE1-O 3.35Å; F831-V900 HydrophobicContact CE2-CG1 4.47Å; F831-V900 HydrophobicContact CZ-CB 4.31Å; F831-V900 HydrophobicContact CZ-CG1 3.84Å; A842-V900 PolarHBondContact N-O 2.89Å; A842-V900 PolarHBondContact O-N 3.2Å; I844-V900 HydrophobicContact CD1-CG2 4.04Å; I844-V900 HydrophobicContact CG1-CG2 4.42Å; I881-V900 HydrophobicContact CG2-CG1 3.48Å; I881-V900 VanDerWaalsContact CG2-CG1 3.48Å; I883-V900 HydrophobicContact CG1-CG1 4.06Å; I883-V900 HydrophobicContact CG1-CG2 4.23Å; V898-V900 HydrophobicContact CG1-CG2 4.45Å
901	M	90.8	Very high	84.5	Confident	46 Å²	46	77.5 Å²	77.5	23%	0.227	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.6	-180	-53.9	-167.9	-62.5	0	0	110.5	S840 T841 I881 S882	S840-M901 WeakPolarHBondContact O-CA 3.4Å; T841-M901 HydrophobicContact CG2-CG 3.97Å; T841-M901 WeakPolarHBondContact OG1-CG 3.23Å; I881-M901 CarbonylContact C-O 3.45Å; I881-M901 WeakPolarHBondContact CA-O 3.4Å; S882-M901 PolarHBondContact N-O 3.09Å; S882-M901 PolarHBondContact O-N 3.28Å; S882-M901 PolarHBondContact OG-O 2.71Å
902	F	92.1	Very high	84.5	Confident	54 Å²	54	76.6 Å²	76.6	24%	0.237	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.8	166.7	175.2	-124.2	0	0	0	109.7	F831 K839 S840 D880 I881 P904	F831-F902 HydrophobicContact CB-CD1 4.2Å; F831-F902 HydrophobicContact CD1-CB 3.77Å; F831-F902 HydrophobicContact CD2-CB 3.85Å; F831-F902 HydrophobicContact CD2-CG 4.33Å; F831-F902 HydrophobicContact CE1-CB 3.86Å; F831-F902 HydrophobicContact CE2-CB 3.94Å; F831-F902 HydrophobicContact CG-CB 3.77Å; F831-F902 HydrophobicContact CG-CD1 4.31Å; F831-F902 HydrophobicContact CG-CG 4.32Å; F831-F902 HydrophobicContact CZ-CB 3.94Å; K839-F902 CarbonylContact C-O 3.55Å; K839-F902 VanDerWaalsContact CA-O 3.29Å; K839-F902 WeakPolarHBondContact CA-O 3.28Å; S840-F902 PolarHBondContact N-O 3.37Å; S840-F902 PolarHBondContact O-N 3.01Å; D880-F902 HydrophobicContact CB-CD2 4.17Å; D880-F902 HydrophobicContact CB-CE2 3.84Å; I881-F902 HydrophobicContact CG1-CB 4.39Å; I881-F902 HydrophobicContact CG1-CD2 3.87Å; F902-P904 HydrophobicContact CE1-CB 4.12Å; F902-P904 HydrophobicContact CE1-CG 3.91Å; F902-P904 HydrophobicContact CE2-CB 4.28Å; F902-P904 HydrophobicContact CZ-CB 3.7Å; F902-P904 HydrophobicContact CZ-CG 4.03Å
903	R	89.1	Confident	84.8	Confident	117 Å²	117	81 Å²	81	44%	0.442	40%	0.403	S	S	.	.			trans	-134.2	95.4	174.1	179.5	-169.8	-68.1	133.1	-1.3	108.4	D838 D880 V905	D838-R903 WeakPolarHBondContact O-CG 3.31Å; D880-R903 PolarHBondContact O-N 2.9Å; R903-V905 PolarHBondContact O-N 3.32Å
904	P	88.3	Confident	85.1	Confident	17 Å²	17	82.2 Å²	82.2	11%	0.11	40%	0.395	C	S	.	.			trans	-65.6	128.9	-179.5	22.9	-29.9	0	0	0	111.9	T834 G837 D880 F902	T834-P904 HydrophobicContact CG2-CG 3.97Å; G837-P904 PolarHBondContact N-O 2.87Å; D880-P904 WeakPolarHBondContact OD2-CA 3.47Å; F902-P904 HydrophobicContact CE1-CB 4.12Å; F902-P904 HydrophobicContact CE1-CG 3.91Å; F902-P904 HydrophobicContact CE2-CB 4.28Å; F902-P904 HydrophobicContact CZ-CB 3.7Å; F902-P904 HydrophobicContact CZ-CG 4.03Å
905	V	83.3	Confident	85.2	Confident	83 Å²	83	80.7 Å²	80.7	50%	0.503	40%	0.397	S	S	.	.			trans	-120.4	120.6	179.1	-179.2	0	0	0	0	110.2	D880 R903 R907	D880-V905 PolarHBondContact OD2-N 3.19Å; R903-V905 PolarHBondContact O-N 3.32Å; V905-R907 PolarHBondContact O-N 3.01Å
906	L	79.2	Confident	85.2	Confident	115 Å²	115	76.5 Å²	76.5	60%	0.602	39%	0.387	S	S	*	.			trans	-75.6	107.8	175	-156.2	75.8	0	0	0	109.4	V836 V911	V836-L906 HydrophobicContact CG1-CB 3.93Å; V836-L906 HydrophobicContact CG2-CB 4.48Å; L906-V911 HydrophobicContact CD2-CG2 3.57Å; L906-V911 HydrophobicContact CG-CG2 3.68Å
907	R	79.5	Confident	85.2	Confident	95 Å²	95	81.6 Å²	81.6	36%	0.358	40%	0.403	S	S	.	.			trans	-81.7	137	-173.9	-56.8	178.6	-167.9	176.9	2.5	110.8	D878 D880 V905 K909 T910 V911	D878-R907 PolarHBondContact O-NH2 2.87Å; D878-R907 IonicContact OD1-NH1 3.27Å; D880-R907 IonicContact OD1-CZ 3.91Å; D880-R907 IonicContact OD1-NE 3.77Å; D880-R907 IonicContact OD1-NH2 2.68Å; D880-R907 PolarHBondContact OD1-NH2 2.84Å; V905-R907 PolarHBondContact O-N 3.01Å; R907-K909 PolarHBondContact O-N 3.02Å; R907-K909 VanDerWaalsContact O-N 3.1Å; R907-T910 WeakPolarHBondContact O-CA 3.48Å; R907-T910 WeakPolarHBondContact O-CB 3.43Å; R907-T910 PolarHBondContact O-N 2.91Å; R907-V911 PolarHBondContact O-N 3.27Å
908	E	77.6	Confident	85	Confident	168 Å²	168	83.3 Å²	83.3	79%	0.785	41%	0.412	S	S	*	.	H	α-helix	trans	-54.3	-33.7	-179.8	-63.2	-178.7	152.7	0	0	113.2	V911 T912	E908-V911 PolarHBondContact O-N 2.82Å; E908-T912 WeakPolarHBondContact O-CB 3.27Å; E908-T912 WeakPolarHBondContact O-CG2 3.45Å; E908-T912 PolarHBondContact O-N 2.97Å; E908-T912 PolarHBondContact O-OG1 3.26Å
909	K	76.8	Confident	84.7	Confident	159 Å²	159	89.3 Å²	89.3	69%	0.691	44%	0.44	S	S	*	.	H	α-helix	trans	-59.7	-48.7	172.7	-66.2	-175.7	179.3	178.7	0	112	R907 V911 T912 E913	R907-K909 PolarHBondContact O-N 3.02Å; R907-K909 VanDerWaalsContact O-N 3.1Å; K909-V911 VanDerWaalsContact C-N 3.35Å; K909-V911 PolarHBondContact O-N 2.86Å; K909-T912 WeakPolarHBondContact CA-OG1 3.28Å; K909-T912 PolarHBondContact O-N 3.13Å; K909-T912 PolarHBondContact O-OG1 3.47Å; K909-T912 VanDerWaalsContact O-OG1 3.04Å; K909-E913 WeakPolarHBondContact O-CB 3.5Å; K909-E913 VanDerWaalsContact O-CG 3.24Å; K909-E913 WeakPolarHBondContact O-CG 3.19Å; K909-E913 PolarHBondContact O-N 2.92Å
910	T	78.6	Confident	84.4	Confident	70 Å²	70	93.7 Å²	93.7	43%	0.429	45%	0.452	S	S	.	.	H	α-helix	trans	-67.6	-36.8	178.5	-44.8	0	0	0	0	111.5	R907 E914	R907-T910 WeakPolarHBondContact O-CA 3.48Å; R907-T910 WeakPolarHBondContact O-CB 3.43Å; R907-T910 PolarHBondContact O-N 2.91Å; T910-E914 PolarHBondContact O-N 2.87Å
911	V	80.4	Confident	83.9	Confident	68 Å²	68	97.5 Å²	97.5	41%	0.412	47%	0.472	S	S	.	.	H	α-helix	trans	-64.5	-44.3	174	178.2	0	0	0	0	111.4	L906 R907 E908 K909 A915	L906-V911 HydrophobicContact CD2-CG2 3.57Å; L906-V911 HydrophobicContact CG-CG2 3.68Å; R907-V911 PolarHBondContact O-N 3.27Å; E908-V911 PolarHBondContact O-N 2.82Å; K909-V911 VanDerWaalsContact C-N 3.35Å; K909-V911 PolarHBondContact O-N 2.86Å; V911-A915 VanDerWaalsContact O-CB 3.23Å; V911-A915 WeakPolarHBondContact O-CB 3.23Å; V911-A915 PolarHBondContact O-N 3.48Å
912	T	81.7	Confident	83.5	Confident	79 Å²	79	97.9 Å²	97.9	49%	0.485	48%	0.482	S	S	.	.	H	α-helix	trans	-72.6	-34.5	179.1	48	0	0	0	0	112.4	E908 K909 A915 L916	E908-T912 WeakPolarHBondContact O-CB 3.27Å; E908-T912 WeakPolarHBondContact O-CG2 3.45Å; E908-T912 PolarHBondContact O-N 2.97Å; E908-T912 PolarHBondContact O-OG1 3.26Å; K909-T912 WeakPolarHBondContact CA-OG1 3.28Å; K909-T912 PolarHBondContact O-N 3.13Å; K909-T912 PolarHBondContact O-OG1 3.47Å; K909-T912 VanDerWaalsContact O-OG1 3.04Å; T912-A915 PolarHBondContact O-N 2.8Å; T912-L916 VanDerWaalsContact O-CB 3.28Å; T912-L916 WeakPolarHBondContact O-CB 3.48Å; T912-L916 WeakPolarHBondContact O-CG 3.24Å; T912-L916 PolarHBondContact O-N 3.26Å
913	E	84.1	Confident	82.9	Confident	124 Å²	124	100.7 Å²	100.7	58%	0.579	49%	0.494	S	S	*	.	H	α-helix	trans	-63.4	-46	171.8	-76.8	167.2	-177	0	0	112.1	K909 L916 R917	K909-E913 WeakPolarHBondContact O-CB 3.5Å; K909-E913 VanDerWaalsContact O-CG 3.24Å; K909-E913 WeakPolarHBondContact O-CG 3.19Å; K909-E913 PolarHBondContact O-N 2.92Å; E913-L916 PolarHBondContact O-N 2.92Å; E913-R917 WeakPolarHBondContact O-CB 3.33Å; E913-R917 PolarHBondContact O-N 2.88Å
914	E	83.5	Confident	82.2	Confident	77 Å²	77	97 Å²	97	36%	0.36	49%	0.489	S	S	.	.	H	α-helix	trans	-70.7	-36.1	174.6	-79.9	-62.4	141.2	0	0	112.6	T910 L916 R917 L918	T910-E914 PolarHBondContact O-N 2.87Å; E914-L916 VanDerWaalsContact C-N 3.34Å; E914-L916 PolarHBondContact O-N 3.19Å; E914-R917 VanDerWaalsContact CD-NH1 3.28Å; E914-R917 WeakPolarHBondContact O-CB 3.28Å; E914-R917 PolarHBondContact O-N 3.5Å; E914-R917 WeakPolarHBondContact OE1-CD 3.5Å; E914-R917 IonicContact OE1-CZ 3.63Å; E914-R917 IonicContact OE1-NE 3.86Å; E914-R917 IonicContact OE1-NH1 2.88Å; E914-R917 PolarHBondContact OE1-NH1 3.02Å; E914-R917 WeakPolarHBondContact OE2-CD 3.37Å; E914-R917 IonicContact OE2-CZ 3.8Å; E914-R917 IonicContact OE2-NE 2.69Å; E914-R917 IonicContact OE2-NH1 3.9Å; E914-R917 PolarHBondContact OE2-NH1 3.02Å; E914-R917 VanDerWaalsContact OE2-NH1 3.09Å; E914-L918 WeakPolarHBondContact O-CB 3.29Å; E914-L918 WeakPolarHBondContact O-CG 3.47Å; E914-L918 PolarHBondContact O-N 2.82Å
915	A	85.2	Confident	81.4	Confident	53 Å²	53	100.1 Å²	100.1	44%	0.438	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-41	171.9	0	0	0	0	0	111.8	V911 T912 L918 H919	V911-A915 VanDerWaalsContact O-CB 3.23Å; V911-A915 WeakPolarHBondContact O-CB 3.23Å; V911-A915 PolarHBondContact O-N 3.48Å; T912-A915 PolarHBondContact O-N 2.8Å; A915-L918 PolarHBondContact O-N 3.19Å; A915-H919 VanDerWaalsContact O-CB 3.28Å; A915-H919 WeakPolarHBondContact O-CB 3.12Å; A915-H919 PolarHBondContact O-N 2.88Å
916	L	86.2	Confident	80.7	Confident	91 Å²	91	99.6 Å²	99.6	48%	0.476	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-36.3	172.9	-75.7	168.6	0	0	0	112.1	T912 E913 E914 R920	T912-L916 VanDerWaalsContact O-CB 3.28Å; T912-L916 WeakPolarHBondContact O-CB 3.48Å; T912-L916 WeakPolarHBondContact O-CG 3.24Å; T912-L916 PolarHBondContact O-N 3.26Å; E913-L916 PolarHBondContact O-N 2.92Å; E914-L916 VanDerWaalsContact C-N 3.34Å; E914-L916 PolarHBondContact O-N 3.19Å; L916-R920 WeakPolarHBondContact O-CB 3.46Å; L916-R920 WeakPolarHBondContact O-CD 3.5Å; L916-R920 WeakPolarHBondContact O-CG 3.49Å; L916-R920 PolarHBondContact O-N 2.85Å
917	R	88.3	Confident	80	Confident	133 Å²	133	99.6 Å²	99.6	50%	0.502	51%	0.505	S	S	.	.	H	α-helix	trans	-65.3	-47.8	173.5	176.4	179.2	160.2	-152.4	-4.7	111.4	E913 E914 H919 R920 I921	E913-R917 WeakPolarHBondContact O-CB 3.33Å; E913-R917 PolarHBondContact O-N 2.88Å; E914-R917 VanDerWaalsContact CD-NH1 3.28Å; E914-R917 WeakPolarHBondContact O-CB 3.28Å; E914-R917 PolarHBondContact O-N 3.5Å; E914-R917 WeakPolarHBondContact OE1-CD 3.5Å; E914-R917 IonicContact OE1-CZ 3.63Å; E914-R917 IonicContact OE1-NE 3.86Å; E914-R917 IonicContact OE1-NH1 2.88Å; E914-R917 PolarHBondContact OE1-NH1 3.02Å; E914-R917 WeakPolarHBondContact OE2-CD 3.37Å; E914-R917 IonicContact OE2-CZ 3.8Å; E914-R917 IonicContact OE2-NE 2.69Å; E914-R917 IonicContact OE2-NH1 3.9Å; E914-R917 PolarHBondContact OE2-NH1 3.02Å; E914-R917 VanDerWaalsContact OE2-NH1 3.09Å; R917-H919 VanDerWaalsContact C-N 3.35Å; R917-H919 PolarHBondContact O-N 2.86Å; R917-R920 PolarHBondContact O-N 2.9Å; R917-I921 HydrophobicContact CG-CD1 3.95Å; R917-I921 VanDerWaalsContact O-CG1 3.29Å; R917-I921 WeakPolarHBondContact O-CG1 3.47Å; R917-I921 PolarHBondContact O-N 3.18Å
918	L	86.6	Confident	79.1	Confident	109 Å²	109	101.2 Å²	101.2	57%	0.571	52%	0.515	S	S	*	.	H	α-helix	trans	-62.3	-41.1	176.1	-71	170.7	0	0	0	111.5	E914 A915 I921 A922	E914-L918 WeakPolarHBondContact O-CB 3.29Å; E914-L918 WeakPolarHBondContact O-CG 3.47Å; E914-L918 PolarHBondContact O-N 2.82Å; A915-L918 PolarHBondContact O-N 3.19Å; L918-I921 PolarHBondContact O-N 3.44Å; L918-A922 WeakPolarHBondContact O-CB 3.37Å; L918-A922 PolarHBondContact O-N 3.33Å
919	H	84	Confident	78.2	Confident	126 Å²	126	99.8 Å²	99.8	58%	0.583	51%	0.508	S	S	*	.	H	α-helix	trans	-63	-42.7	173.8	-178.6	78.7	0	0	0	112.3	A915 R917 A922 K923	A915-H919 VanDerWaalsContact O-CB 3.28Å; A915-H919 WeakPolarHBondContact O-CB 3.12Å; A915-H919 PolarHBondContact O-N 2.88Å; R917-H919 VanDerWaalsContact C-N 3.35Å; R917-H919 PolarHBondContact O-N 2.86Å; H919-A922 PolarHBondContact O-N 3.14Å; H919-K923 WeakPolarHBondContact O-CB 3.36Å; H919-K923 PolarHBondContact O-N 2.86Å
920	R	84.4	Confident	77.3	Confident	175 Å²	175	95.2 Å²	95.2	66%	0.66	49%	0.494	S	S	*	.	H	α-helix	trans	-62.3	-40.4	173.3	-74.2	165.9	-175.7	167.5	3.2	112.1	L916 R917 A924	L916-R920 WeakPolarHBondContact O-CB 3.46Å; L916-R920 WeakPolarHBondContact O-CD 3.5Å; L916-R920 WeakPolarHBondContact O-CG 3.49Å; L916-R920 PolarHBondContact O-N 2.85Å; R917-R920 PolarHBondContact O-N 2.9Å; R920-A924 VanDerWaalsContact O-CB 3.26Å; R920-A924 WeakPolarHBondContact O-CB 3.45Å; R920-A924 PolarHBondContact O-N 3.47Å
921	I	82.9	Confident	76.3	Confident	88 Å²	88	98 Å²	98	45%	0.451	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-52	175.6	-70	164.3	0	0	0	109.9	R917 L918 K923 A924 T925	R917-I921 HydrophobicContact CG-CD1 3.95Å; R917-I921 VanDerWaalsContact O-CG1 3.29Å; R917-I921 WeakPolarHBondContact O-CG1 3.47Å; R917-I921 PolarHBondContact O-N 3.18Å; L918-I921 PolarHBondContact O-N 3.44Å; I921-K923 VanDerWaalsContact C-N 3.32Å; I921-K923 PolarHBondContact O-N 3.4Å; I921-A924 CarbonylContact O-C 3.59Å; I921-A924 WeakPolarHBondContact O-CA 3.36Å; I921-A924 PolarHBondContact O-N 3.4Å; I921-T925 PolarHBondContact O-N 3.49Å; I921-T925 PolarHBondContact O-OG1 2.82Å
922	A	81.6	Confident	75.1	Confident	55 Å²	55	99.3 Å²	99.3	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-59	-40.9	179.9	0	0	0	0	0	112.6	L918 H919 T925 S926	L918-A922 WeakPolarHBondContact O-CB 3.37Å; L918-A922 PolarHBondContact O-N 3.33Å; H919-A922 PolarHBondContact O-N 3.14Å; A922-T925 WeakPolarHBondContact CA-OG1 3.23Å; A922-T925 PolarHBondContact O-N 3.12Å; A922-T925 PolarHBondContact O-OG1 3.33Å; A922-S926 WeakPolarHBondContact O-CB 3.48Å; A922-S926 PolarHBondContact O-N 2.85Å
923	K	79.1	Confident	74.1	Confident	112 Å²	112	98.8 Å²	98.8	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-62.2	-45.8	172.3	-179.4	169.4	174.1	171.9	0	111.5	H919 I921 T925 S926 E927	H919-K923 WeakPolarHBondContact O-CB 3.36Å; H919-K923 PolarHBondContact O-N 2.86Å; I921-K923 VanDerWaalsContact C-N 3.32Å; I921-K923 PolarHBondContact O-N 3.4Å; K923-T925 VanDerWaalsContact C-N 3.27Å; K923-T925 PolarHBondContact O-N 3.42Å; K923-S926 PolarHBondContact O-N 2.99Å; K923-E927 WeakPolarHBondContact CE-OE1 3.4Å; K923-E927 HydrophobicContact CG-CG 4.38Å; K923-E927 IonicContact NZ-OE1 3.77Å; K923-E927 WeakPolarHBondContact O-CB 3.35Å; K923-E927 WeakPolarHBondContact O-CG 3.47Å; K923-E927 PolarHBondContact O-N 3.49Å
924	A	75.1	Confident	72.9	Confident	41 Å²	41	101.7 Å²	101.7	34%	0.339	52%	0.516	S	S	.	.	H	α-helix	trans	-72	-11.5	178.7	0	0	0	0	0	115	R920 I921 K928	R920-A924 VanDerWaalsContact O-CB 3.26Å; R920-A924 WeakPolarHBondContact O-CB 3.45Å; R920-A924 PolarHBondContact O-N 3.47Å; I921-A924 CarbonylContact O-C 3.59Å; I921-A924 WeakPolarHBondContact O-CA 3.36Å; I921-A924 PolarHBondContact O-N 3.4Å; A924-K928 VanDerWaalsContact O-CD 3.28Å; A924-K928 WeakPolarHBondContact O-CD 3.47Å; A924-K928 WeakPolarHBondContact O-CE 3.41Å; A924-K928 WeakPolarHBondContact O-CG 3.39Å
925	T	71.6	Confident	71.7	Confident	81 Å²	81	102 Å²	102	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-84.7	-47.3	162.6	12.2	0	0	0	0	111.4	I921 A922 K923 E927 K928 E929	I921-T925 PolarHBondContact O-N 3.49Å; I921-T925 PolarHBondContact O-OG1 2.82Å; A922-T925 WeakPolarHBondContact CA-OG1 3.23Å; A922-T925 PolarHBondContact O-N 3.12Å; A922-T925 PolarHBondContact O-OG1 3.33Å; K923-T925 VanDerWaalsContact C-N 3.27Å; K923-T925 PolarHBondContact O-N 3.42Å; T925-E927 VanDerWaalsContact C-N 3.26Å; T925-E927 PolarHBondContact O-N 2.85Å; T925-K928 WeakPolarHBondContact O-CB 3.3Å; T925-K928 PolarHBondContact O-N 3.48Å; T925-E929 PolarHBondContact O-N 3.1Å
926	S	67.8	Low	70.5	Confident	73 Å²	73	102.3 Å²	102.3	51%	0.51	52%	0.52	S	S	.	.	H	α-helix	trans	-57.7	-37.1	178.3	179.2	0	0	0	0	112.6	A922 K923 K928 P930	A922-S926 WeakPolarHBondContact O-CB 3.48Å; A922-S926 PolarHBondContact O-N 2.85Å; K923-S926 PolarHBondContact O-N 2.99Å; S926-K928 PolarHBondContact O-N 3.39Å; S926-P930 WeakPolarHBondContact O-CD 3.44Å
927	E	64.9	Low	69.2	Low	115 Å²	115	103.2 Å²	103.2	54%	0.537	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-12	175.4	-71.8	173.1	160.6	0	0	113.9	K923 T925	K923-E927 WeakPolarHBondContact CE-OE1 3.4Å; K923-E927 HydrophobicContact CG-CG 4.38Å; K923-E927 IonicContact NZ-OE1 3.77Å; K923-E927 WeakPolarHBondContact O-CB 3.35Å; K923-E927 WeakPolarHBondContact O-CG 3.47Å; K923-E927 PolarHBondContact O-N 3.49Å; T925-E927 VanDerWaalsContact C-N 3.26Å; T925-E927 PolarHBondContact O-N 2.85Å
928	K	60.2	Low	67.9	Low	129 Å²	129	103.2 Å²	103.2	56%	0.561	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-25.1	-179.2	-68.3	177.7	-177.6	177.2	0	114.9	A924 T925 S926 P930 E931 V932	A924-K928 VanDerWaalsContact O-CD 3.28Å; A924-K928 WeakPolarHBondContact O-CD 3.47Å; A924-K928 WeakPolarHBondContact O-CE 3.41Å; A924-K928 WeakPolarHBondContact O-CG 3.39Å; T925-K928 WeakPolarHBondContact O-CB 3.3Å; T925-K928 PolarHBondContact O-N 3.48Å; S926-K928 PolarHBondContact O-N 3.39Å; K928-P930 VanDerWaalsContact C-CD 3.45Å; K928-P930 VanDerWaalsContact C-N 3.35Å; K928-E931 PolarHBondContact O-N 3.21Å; K928-V932 PolarHBondContact O-N 3.12Å
929	E	58.7	Low	66.5	Low	137 Å²	137	103.7 Å²	103.7	64%	0.64	53%	0.526	S	S	*	.	H	α-helix	trans	-53.9	-39.3	173.1	-66	-176.7	140.8	0	0	114.4	T925 E931 S933	T925-E929 PolarHBondContact O-N 3.1Å; E929-E931 VanDerWaalsContact C-N 3.25Å; E929-E931 PolarHBondContact O-N 2.9Å; E929-S933 PolarHBondContact O-N 3.43Å; E929-S933 PolarHBondContact O-OG 2.7Å
930	P	58.8	Low	65.4	Low	63 Å²	63	107 Å²	107	41%	0.409	53%	0.533	S	S	.	.	H	α-helix	trans	-71.1	-12.7	174.2	27.9	-35.8	0	0	0	114.5	S926 K928 S933 R934	S926-P930 WeakPolarHBondContact O-CD 3.44Å; K928-P930 VanDerWaalsContact C-CD 3.45Å; K928-P930 VanDerWaalsContact C-N 3.35Å; P930-S933 WeakPolarHBondContact CA-OG 3.38Å; P930-S933 PolarHBondContact O-OG 2.76Å; P930-R934 VanDerWaalsContact O-CD 3.24Å; P930-R934 WeakPolarHBondContact O-CD 3.48Å; P930-R934 WeakPolarHBondContact O-CG 3.45Å
931	E	56.5	Low	64.2	Low	128 Å²	128	104.3 Å²	104.3	60%	0.598	53%	0.527	S	S	*	.	H	α-helix	trans	-86.7	-45.6	173.1	-63.5	-166.2	130.4	0	0	111.3	K928 E929 S933 R934 V935	K928-E931 PolarHBondContact O-N 3.21Å; E929-E931 VanDerWaalsContact C-N 3.25Å; E929-E931 PolarHBondContact O-N 2.9Å; E931-S933 VanDerWaalsContact C-N 3.3Å; E931-S933 PolarHBondContact O-N 2.84Å; E931-R934 PolarHBondContact O-N 2.89Å; E931-V935 WeakPolarHBondContact O-CG2 3.45Å; E931-V935 PolarHBondContact O-N 2.87Å
932	V	57.2	Low	63.1	Low	96 Å²	96	106 Å²	106	58%	0.582	53%	0.532	S	S	*	.	H	α-helix	trans	-62.3	-38.2	179.5	179.7	0	0	0	0	111.8	K928 R934 V935 T936	K928-V932 PolarHBondContact O-N 3.12Å; V932-R934 VanDerWaalsContact C-N 3.34Å; V932-R934 PolarHBondContact O-N 3.36Å; V932-V935 PolarHBondContact O-N 3.17Å; V932-T936 PolarHBondContact O-N 3.22Å; V932-T936 VanDerWaalsContact O-N 3.11Å; V932-T936 PolarHBondContact O-OG1 3.07Å
933	S	58.8	Low	61.9	Low	69 Å²	69	106.7 Å²	106.7	48%	0.483	53%	0.534	S	S	.	.	H	α-helix	trans	-68.1	-29	174.7	48.7	0	0	0	0	113.4	E929 P930 E931 T936 E937	E929-S933 PolarHBondContact O-N 3.43Å; E929-S933 PolarHBondContact O-OG 2.7Å; P930-S933 WeakPolarHBondContact CA-OG 3.38Å; P930-S933 PolarHBondContact O-OG 2.76Å; E931-S933 VanDerWaalsContact C-N 3.3Å; E931-S933 PolarHBondContact O-N 2.84Å; S933-T936 PolarHBondContact O-OG1 2.85Å; S933-E937 PolarHBondContact O-N 2.86Å
934	R	59.8	Low	61	Low	185 Å²	185	103.6 Å²	103.6	70%	0.698	53%	0.529	S	S	*	.	H	α-helix	trans	-76.3	-39.6	172.7	-74.5	173.6	178.9	-179.5	-0.8	112.8	P930 E931 V932 E937 H938	P930-R934 VanDerWaalsContact O-CD 3.24Å; P930-R934 WeakPolarHBondContact O-CD 3.48Å; P930-R934 WeakPolarHBondContact O-CG 3.45Å; E931-R934 PolarHBondContact O-N 2.89Å; V932-R934 VanDerWaalsContact C-N 3.34Å; V932-R934 PolarHBondContact O-N 3.36Å; R934-E937 PolarHBondContact O-N 3.45Å; R934-H938 PolarHBondContact O-N 2.84Å; R934-H938 VanDerWaalsContact O-N 3.11Å
935	V	59.3	Low	60.2	Low	82 Å²	82	103.8 Å²	103.8	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-62.1	-49.2	177.1	172	0	0	0	0	110.6	E931 V932 E937 H938 E939	E931-V935 WeakPolarHBondContact O-CG2 3.45Å; E931-V935 PolarHBondContact O-N 2.87Å; V932-V935 PolarHBondContact O-N 3.17Å; V935-E937 VanDerWaalsContact C-N 3.29Å; V935-E937 PolarHBondContact O-N 2.84Å; V935-H938 WeakPolarHBondContact O-CA 3.36Å; V935-H938 WeakPolarHBondContact O-CB 3.11Å; V935-H938 PolarHBondContact O-N 2.86Å; V935-E939 HydrophobicContact CG1-CG 4.48Å; V935-E939 PolarHBondContact O-N 2.86Å
936	T	58.7	Low	59.6	Low	61 Å²	61	103.6 Å²	103.6	37%	0.374	53%	0.527	S	S	.	.	H	α-helix	trans	-65.1	-27.9	-179.8	47.8	0	0	0	0	113.7	V932 S933 R940	V932-T936 PolarHBondContact O-N 3.22Å; V932-T936 VanDerWaalsContact O-N 3.11Å; V932-T936 PolarHBondContact O-OG1 3.07Å; S933-T936 PolarHBondContact O-OG1 2.85Å; T936-R940 WeakPolarHBondContact O-CG 3.5Å; T936-R940 PolarHBondContact O-N 2.8Å
937	E	59.9	Low	59.1	Low	110 Å²	110	106.1 Å²	106.1	51%	0.514	53%	0.53	S	S	.	.	H	α-helix	trans	-73.4	-33.9	170.8	-155.4	-161.2	-132.9	0	0	112.3	S933 R934 V935 K941	S933-E937 PolarHBondContact O-N 2.86Å; R934-E937 PolarHBondContact O-N 3.45Å; V935-E937 VanDerWaalsContact C-N 3.29Å; V935-E937 PolarHBondContact O-N 2.84Å; E937-K941 VanDerWaalsContact CD-NZ 3.28Å; E937-K941 WeakPolarHBondContact O-CG 3.18Å; E937-K941 PolarHBondContact O-N 2.89Å; E937-K941 IonicContact OE1-NZ 3.2Å; E937-K941 IonicContact OE2-NZ 2.7Å; E937-K941 PolarHBondContact OE2-NZ 3Å
938	H	59.3	Low	58.9	Low	132 Å²	132	105.4 Å²	105.4	61%	0.611	53%	0.529	S	S	*	.	H	α-helix	trans	-69.7	-39.7	176	-121.5	-62.9	0	0	0	112.6	R934 V935 K941 H942	R934-H938 PolarHBondContact O-N 2.84Å; R934-H938 VanDerWaalsContact O-N 3.11Å; V935-H938 WeakPolarHBondContact O-CA 3.36Å; V935-H938 WeakPolarHBondContact O-CB 3.11Å; V935-H938 PolarHBondContact O-N 2.86Å; H938-K941 PolarHBondContact O-N 2.85Å; H938-H942 PolarHBondContact O-N 3.35Å
939	E	58.2	Low	58.8	Low	119 Å²	119	105.1 Å²	105.1	56%	0.556	53%	0.531	S	S	*	.	H	α-helix	trans	-63.2	-41.5	176	-70.8	177.7	144	0	0	112	V935 K941 H942 S943	V935-E939 HydrophobicContact CG1-CG 4.48Å; V935-E939 PolarHBondContact O-N 2.86Å; E939-K941 VanDerWaalsContact C-N 3.32Å; E939-K941 PolarHBondContact O-N 2.9Å; E939-H942 PolarHBondContact O-N 2.78Å; E939-H942 VanDerWaalsContact O-N 3.17Å; E939-S943 PolarHBondContact O-N 3.29Å
940	R	60.3	Low	58.7	Low	196 Å²	196	102.9 Å²	102.9	74%	0.74	53%	0.527	S	S	*	.	H	α-helix	trans	-60.1	-40.8	174	-73.8	174.8	-179.6	-178.6	1.2	112.3	T936 H942 A944	T936-R940 WeakPolarHBondContact O-CG 3.5Å; T936-R940 PolarHBondContact O-N 2.8Å; R940-H942 VanDerWaalsContact C-N 3.33Å; R940-A944 PolarHBondContact O-N 2.75Å
941	K	60.5	Low	58.5	Low	119 Å²	119	106.7 Å²	106.7	52%	0.517	54%	0.539	S	S	.	.	H	α-helix	trans	-66.6	-33.9	176.5	-71.8	164.9	-179.6	169.8	0	112.1	E937 H938 E939 A945	E937-K941 VanDerWaalsContact CD-NZ 3.28Å; E937-K941 WeakPolarHBondContact O-CG 3.18Å; E937-K941 PolarHBondContact O-N 2.89Å; E937-K941 IonicContact OE1-NZ 3.2Å; E937-K941 IonicContact OE2-NZ 2.7Å; E937-K941 PolarHBondContact OE2-NZ 3Å; H938-K941 PolarHBondContact O-N 2.85Å; E939-K941 VanDerWaalsContact C-N 3.32Å; E939-K941 PolarHBondContact O-N 2.9Å; K941-A945 PolarHBondContact O-N 3.21Å
942	H	59.4	Low	58.6	Low	123 Å²	123	108.6 Å²	108.6	57%	0.569	55%	0.546	S	S	*	.	H	α-helix	trans	-70.7	-47.8	174.7	-132.8	-67.7	0	0	0	112.1	H938 E939 R940 A944 A945 D946	H938-H942 PolarHBondContact O-N 3.35Å; E939-H942 PolarHBondContact O-N 2.78Å; E939-H942 VanDerWaalsContact O-N 3.17Å; R940-H942 VanDerWaalsContact C-N 3.33Å; H942-A944 VanDerWaalsContact C-N 3.28Å; H942-A944 PolarHBondContact O-N 3.2Å; H942-A945 WeakPolarHBondContact O-CB 3.49Å; H942-A945 PolarHBondContact O-N 2.84Å; H942-D946 IonicContact ND1-OD2 2.8Å; H942-D946 PolarHBondContact ND1-OD2 3.04Å; H942-D946 PolarHBondContact O-N 3.11Å; H942-D946 VanDerWaalsContact O-N 3.12Å
943	S	56.9	Low	58.4	Low	70 Å²	70	112.5 Å²	112.5	49%	0.49	56%	0.555	S	S	.	*	H	α-helix	trans	-58.4	-37.4	179.6	-179.8	0	0	0	0	113.1	E939 Q947	E939-S943 PolarHBondContact O-N 3.29Å; S943-Q947 PolarHBondContact O-N 2.74Å
944	A	59.1	Low	58.1	Low	46 Å²	46	117.6 Å²	117.6	38%	0.38	57%	0.573	S	S	.	*	H	α-helix	trans	-67.5	-34.9	175.1	0	0	0	0	0	112.8	R940 H942 I948	R940-A944 PolarHBondContact O-N 2.75Å; H942-A944 VanDerWaalsContact C-N 3.28Å; H942-A944 PolarHBondContact O-N 3.2Å; A944-I948 WeakPolarHBondContact O-CG1 3.34Å; A944-I948 PolarHBondContact O-N 2.89Å
945	A	58.7	Low	57.5	Low	46 Å²	46	119.1 Å²	119.1	38%	0.38	59%	0.594	S	S	.	*	H	α-helix	trans	-68.8	-38.8	177.2	0	0	0	0	0	112.2	K941 H942 I948 M949	K941-A945 PolarHBondContact O-N 3.21Å; H942-A945 WeakPolarHBondContact O-CB 3.49Å; H942-A945 PolarHBondContact O-N 2.84Å; A945-I948 PolarHBondContact O-N 2.8Å; A945-M949 PolarHBondContact O-N 3.04Å
946	D	58.2	Low	57.4	Low	77 Å²	77	121 Å²	121	41%	0.412	60%	0.599	S	S	.	*	H	α-helix	trans	-71.6	-29.7	179.4	-68.1	-46.1	0	0	0	112.7	H942 M949 T950	H942-D946 IonicContact ND1-OD2 2.8Å; H942-D946 PolarHBondContact ND1-OD2 3.04Å; H942-D946 PolarHBondContact O-N 3.11Å; H942-D946 VanDerWaalsContact O-N 3.12Å; D946-M949 PolarHBondContact O-N 2.93Å; D946-T950 PolarHBondContact O-N 2.95Å; D946-T950 VanDerWaalsContact O-N 3.13Å; D946-T950 PolarHBondContact O-OG1 2.86Å
947	Q	57.1	Low	57.3	Low	126 Å²	126	124.1 Å²	124.1	59%	0.589	61%	0.61	S	S	*	*	H	α-helix	trans	-65	-47.4	168.8	-75.6	-176.9	-35.7	0	0	111.8	S943 M949 T950 E951	S943-Q947 PolarHBondContact O-N 2.74Å; Q947-M949 PolarHBondContact O-N 2.76Å; Q947-T950 WeakPolarHBondContact CA-OG1 3.35Å; Q947-T950 PolarHBondContact O-N 3.17Å; Q947-T950 PolarHBondContact O-OG1 3.1Å; Q947-E951 PolarHBondContact O-N 3.36Å
948	I	61.2	Low	57.2	Low	100 Å²	100	124.9 Å²	124.9	51%	0.513	62%	0.616	S	S	.	*	H	α-helix	trans	-62.8	-31.2	177.5	-65.1	165.6	0	0	0	111.6	A944 A945 K952	A944-I948 WeakPolarHBondContact O-CG1 3.34Å; A944-I948 PolarHBondContact O-N 2.89Å; A945-I948 PolarHBondContact O-N 2.8Å; I948-K952 PolarHBondContact O-N 3.13Å
949	M	57.5	Low	57.1	Low	122 Å²	122	124.5 Å²	124.5	60%	0.601	62%	0.616	S	S	*	*	H	α-helix	trans	-76.4	-19.4	173.9	-103.5	-169.7	-64.6	0	0	114.8	A945 D946 Q947	A945-M949 PolarHBondContact O-N 3.04Å; D946-M949 PolarHBondContact O-N 2.93Å; Q947-M949 PolarHBondContact O-N 2.76Å
950	T	56.4	Low	57	Low	90 Å²	90	124.8 Å²	124.8	55%	0.552	62%	0.62	S	S	*	*	H	α-helix	trans	-88.7	-36.9	175.5	31.9	0	0	0	0	112.3	D946 Q947 K952 K953	D946-T950 PolarHBondContact O-N 2.95Å; D946-T950 VanDerWaalsContact O-N 3.13Å; D946-T950 PolarHBondContact O-OG1 2.86Å; Q947-T950 WeakPolarHBondContact CA-OG1 3.35Å; Q947-T950 PolarHBondContact O-N 3.17Å; Q947-T950 PolarHBondContact O-OG1 3.1Å; T950-K952 PolarHBondContact O-N 2.84Å; T950-K953 WeakPolarHBondContact O-CB 3.18Å; T950-K953 PolarHBondContact O-N 2.67Å; T950-K953 VanDerWaalsContact O-N 3.14Å
951	E	56.3	Low	56.8	Low	144 Å²	144	120.1 Å²	120.1	67%	0.673	61%	0.612	S	S	*	*	H	α-helix	trans	-63.5	-40.6	172.9	-67.7	-174.6	149.6	0	0	112.1	Q947 K953 M954	Q947-E951 PolarHBondContact O-N 3.36Å; E951-K953 PolarHBondContact O-N 2.86Å; E951-M954 PolarHBondContact O-N 2.99Å
952	K	57.3	Low	56.5	Low	168 Å²	168	120.1 Å²	120.1	73%	0.73	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	12.4	172.9	-79.3	-171.8	172.4	-178.1	0	115.4	I948 T950	I948-K952 PolarHBondContact O-N 3.13Å; T950-K952 PolarHBondContact O-N 2.84Å
953	K	54.4	Low	56.3	Low	178 Å²	178	119.9 Å²	119.9	77%	0.774	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	1.8	174.2	-111.3	178.4	178.6	176.9	0	113.7	T950 E951	T950-K953 WeakPolarHBondContact O-CB 3.18Å; T950-K953 PolarHBondContact O-N 2.67Å; T950-K953 VanDerWaalsContact O-N 3.14Å; E951-K953 PolarHBondContact O-N 2.86Å
954	M	52.1	Low	56.2	Low	175 Å²	175	124.1 Å²	124.1	86%	0.862	63%	0.634	S	S	*	*			trans	-122.1	25	174.5	-60.4	-142.9	-72.7	0	0	112.5	E951	E951-M954 PolarHBondContact O-N 2.99Å
955	L	46.3	Very low	55.9	Low	217 Å²	217	131.2 Å²	131.2	100%	1.136	66%	0.657	S	S	*	*			trans	-136.4	0	169.8	-83.1	163.3	0	0	0	108.1

Retrieved 955 of 955 residues in 350.1 ms (Link to these results)

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