A0A087X4E0_POEFO Loading...

SWI/SNF-related matrix-associated actin-dependent regulator of chromatin subfamily A-like protein 1

AlphaFold DB , UniProt , Accession A0A087X4E0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 889 aa.

						>A0A087X4E0_POEFO|A0A087X4E0
MSNQLTAEQQRKIEENRRKALERRAQRLGQQTSAGFNGASVQTDFPKQSENHRNPPLSVPPRFVPPFKQDSQITSNQIHRPNQQLLPGTSNQVNKNTQNNSFRQVTAPPPRTNQHLQNLGSSGGGNVGVKPVQAISVTSGSAVGSFYKPPSIPAAQPPPRCSTSAAAKKAAISVRGKCVPHAEDRFKVEVGYHAELIAVFKSIPSKNYDPATKTWNFSLDDYTQLMDQVAAIPSVSLRPLEGIAALDSAPSRPCDGAALAALLKLCNGWQKPGASVQGQCILVSRTKFEVDIPYHADVIAVFKQMPTKNYDMKTRKWSFSLEDYKRLMDLLSGMAGVEVEPLPRAVIQAFAASFNGTVAKSSDVPEADLSSIDPTLTSSLMPFQKEGVNFAVSKQGRLLLADDMGLGKTVQAICIAAYYRNEWPLLVVTPSSVRFTWAEAFRRWLPSLSPDSINVAVKAKENIRSGLVNIVSYDLLSRMDKQHAGPPFNVLIMDESHFLKNMKTARCKAALPLLKAAKRVILLSGTPAMSRPCELYTQILSVKPSLFPRFHEFGVRYCDARQHQQKTWGWDYSGSSNLGELKLLLEECLMLRRLKSDVLSQLPSKQRKVVTVTIEGVSGRMKAALSAAAKQLTKSHRSKMEEKEALLVFYNHTAEAKLQAIMEYITDMLECGREKFLVFAHHKLVLDHITTELLKKNVSFIRIDGATPSAERQQLCEKFQFSSKSCVAVLSVTAANMGLTLHSADLVIFAELFWNPGVLIQAEDRVHRIGQTSNVDIHYLVAKGTADDHLWPMIQAKMNVLKEVGLSESNLLDKAENESFHSKDPNQRSIMEMFQRSFSEEDDFDEAILMEAANDWKDEPPEAAPAPSCTGTSFSKDTHKKTMKDFFTR
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.4	Very low	55.6	Low	235 Å²	235	131.1 Å²	131.1	100%	1.158	68%	0.675	S	S	*	*				0	165.2	0	-61	-176.4	-171.1	0	0	108.8	N3	M1-N3 PolarHBondContact O-N 2.64Å
2	S	34.9	Very low	57	Low	108 Å²	108	129.7 Å²	129.7	76%	0.755	66%	0.66	S	S	*	*			trans	-85.6	101.5	178.8	-169.8	0	0	0	0	110.8	Q4	S2-Q4 PolarHBondContact O-N 2.62Å
3	N	39.5	Very low	58.1	Low	154 Å²	154	127 Å²	127	82%	0.824	65%	0.647	S	S	*	*			trans	-76.4	102	170.7	-74	8	0	0	0	108.8	M1	M1-N3 PolarHBondContact O-N 2.64Å
4	Q	43.5	Very low	58.8	Low	170 Å²	170	125.1 Å²	125.1	79%	0.794	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-68.6	139.8	168.1	-66.3	-177.5	-9.4	0	0	109.6	S2	S2-Q4 PolarHBondContact O-N 2.62Å
5	L	59.3	Low	59.7	Low	95 Å²	95	122.4 Å²	122.4	50%	0.497	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-59.2	137.9	174.7	-71.9	164.9	0	0	0	110	Q9 Q10 I13	L5-Q9 HydrophobicContact CB-CB 4.44Å; L5-Q9 HydrophobicContact CD2-CB 4.36Å; L5-Q10 HydrophobicContact CB-CG 3.78Å; L5-Q10 PolarHBondContact O-NE2 3.12Å; L5-I13 HydrophobicContact CD1-CD1 4.03Å
6	T	78.7	Confident	60.3	Low	79 Å²	79	121.1 Å²	121.1	49%	0.485	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-65.6	152.6	177.4	67.2	0	0	0	0	110.6	E8 Q9 Q10	T6-E8 PolarHBondContact O-N 3Å; T6-E8 VanDerWaalsContact O-N 3.12Å; T6-Q9 WeakPolarHBondContact O-CB 3.1Å; T6-Q9 PolarHBondContact O-N 3.39Å; T6-Q9 WeakPolarHBondContact OG1-CG 3.26Å; T6-Q9 PolarHBondContact OG1-N 2.98Å; T6-Q9 PolarHBondContact OG1-OE1 3.24Å; T6-Q10 WeakPolarHBondContact O-CG 3.41Å; T6-Q10 PolarHBondContact O-N 2.9Å
7	A	62.7	Low	61.3	Low	78 Å²	78	123.2 Å²	123.2	65%	0.645	61%	0.612	S	S	*	*	H	α-helix	trans	-56.6	-32.2	-177.7	0	0	0	0	0	112.8	R11	A7-R11 VanDerWaalsContact O-CB 3.3Å; A7-R11 WeakPolarHBondContact O-CB 3.4Å; A7-R11 PolarHBondContact O-N 3.15Å
8	E	60.6	Low	61.9	Low	120 Å²	120	124.2 Å²	124.2	56%	0.561	61%	0.608	S	S	*	*	H	α-helix	trans	-70.1	-40	174.8	-159.8	-160.5	136.2	0	0	112.7	T6 R11 K12	T6-E8 PolarHBondContact O-N 3Å; T6-E8 VanDerWaalsContact O-N 3.12Å; E8-R11 PolarHBondContact O-N 2.96Å; E8-K12 PolarHBondContact O-N 2.74Å; E8-K12 WeakPolarHBondContact OE1-CE 3.21Å; E8-K12 IonicContact OE1-NZ 2.64Å; E8-K12 PolarHBondContact OE1-NZ 3.34Å
9	Q	63.6	Low	62.5	Low	97 Å²	97	121.9 Å²	121.9	45%	0.453	59%	0.594	S	S	.	*	H	α-helix	trans	-62.7	-45.7	173.8	-72.5	170.7	-27	0	0	110.9	L5 T6 R11 K12 I13	L5-Q9 HydrophobicContact CB-CB 4.44Å; L5-Q9 HydrophobicContact CD2-CB 4.36Å; T6-Q9 WeakPolarHBondContact O-CB 3.1Å; T6-Q9 PolarHBondContact O-N 3.39Å; T6-Q9 WeakPolarHBondContact OG1-CG 3.26Å; T6-Q9 PolarHBondContact OG1-N 2.98Å; T6-Q9 PolarHBondContact OG1-OE1 3.24Å; Q9-R11 VanDerWaalsContact C-N 3.32Å; Q9-R11 PolarHBondContact O-N 2.81Å; Q9-K12 PolarHBondContact O-N 3.37Å; Q9-I13 WeakPolarHBondContact O-CD1 3.34Å; Q9-I13 VanDerWaalsContact O-CG1 3.24Å; Q9-I13 WeakPolarHBondContact O-CG1 3.11Å; Q9-I13 PolarHBondContact O-N 3.16Å
10	Q	65.5	Low	62.4	Low	107 Å²	107	118.9 Å²	118.9	50%	0.5	59%	0.589	S	S	.	*	H	α-helix	trans	-58.6	-44.5	175.1	-62.6	-178.4	28.7	0	0	111.2	L5 T6 I13 E14	L5-Q10 HydrophobicContact CB-CG 3.78Å; L5-Q10 PolarHBondContact O-NE2 3.12Å; T6-Q10 WeakPolarHBondContact O-CG 3.41Å; T6-Q10 PolarHBondContact O-N 2.9Å; Q10-I13 PolarHBondContact O-N 3.45Å; Q10-E14 PolarHBondContact O-N 3.04Å
11	R	73.6	Confident	62.8	Low	199 Å²	199	118 Å²	118	75%	0.751	59%	0.586	S	S	*	*	H	α-helix	trans	-64.3	-41.6	179	-161.6	175.4	-166.5	173.8	4.3	112.8	A7 E8 Q9 E14 E15	A7-R11 VanDerWaalsContact O-CB 3.3Å; A7-R11 WeakPolarHBondContact O-CB 3.4Å; A7-R11 PolarHBondContact O-N 3.15Å; E8-R11 PolarHBondContact O-N 2.96Å; Q9-R11 VanDerWaalsContact C-N 3.32Å; Q9-R11 PolarHBondContact O-N 2.81Å; R11-E14 PolarHBondContact O-N 3.47Å; R11-E15 WeakPolarHBondContact O-CB 3.47Å; R11-E15 PolarHBondContact O-N 3.49Å
12	K	72.6	Confident	64.8	Low	114 Å²	114	111 Å²	111	50%	0.496	55%	0.551	S	S	.	*	H	α-helix	trans	-66.8	-37.4	174.5	-83	172	169.4	161.6	0	112.7	E8 Q9 N16	E8-K12 PolarHBondContact O-N 2.74Å; E8-K12 WeakPolarHBondContact OE1-CE 3.21Å; E8-K12 IonicContact OE1-NZ 2.64Å; E8-K12 PolarHBondContact OE1-NZ 3.34Å; Q9-K12 PolarHBondContact O-N 3.37Å; K12-N16 WeakPolarHBondContact O-CB 3.35Å; K12-N16 PolarHBondContact O-N 3.5Å; K12-N16 PolarHBondContact O-ND2 2.96Å
13	I	71.2	Confident	66.6	Low	95 Å²	95	113.4 Å²	113.4	49%	0.487	54%	0.544	S	S	.	.	H	α-helix	trans	-62.3	-47.3	174.5	-71.2	164.1	0	0	0	110.2	L5 Q9 Q10 N16 R17	L5-I13 HydrophobicContact CD1-CD1 4.03Å; Q9-I13 WeakPolarHBondContact O-CD1 3.34Å; Q9-I13 VanDerWaalsContact O-CG1 3.24Å; Q9-I13 WeakPolarHBondContact O-CG1 3.11Å; Q9-I13 PolarHBondContact O-N 3.16Å; Q10-I13 PolarHBondContact O-N 3.45Å; I13-N16 PolarHBondContact O-N 2.97Å; I13-R17 WeakPolarHBondContact O-CB 3.43Å; I13-R17 PolarHBondContact O-N 3.4Å
14	E	68.6	Low	67.8	Low	101 Å²	101	113.9 Å²	113.9	47%	0.472	53%	0.534	S	S	.	.	H	α-helix	trans	-71.4	-35.4	-178.8	-164.4	54.4	-142.2	0	0	112.6	Q10 R11 R17 R18	Q10-E14 PolarHBondContact O-N 3.04Å; R11-E14 PolarHBondContact O-N 3.47Å; E14-R17 WeakPolarHBondContact O-CB 3.3Å; E14-R17 PolarHBondContact O-N 2.96Å; E14-R17 WeakPolarHBondContact OE2-CD 3.49Å; E14-R18 PolarHBondContact O-N 2.92Å
15	E	71.8	Confident	69	Low	84 Å²	84	108.7 Å²	108.7	39%	0.393	52%	0.52	S	S	.	.	H	α-helix	trans	-62.7	-42.9	173	-168.7	-173.2	160.4	0	0	111.9	R11 R18 K19	R11-E15 WeakPolarHBondContact O-CB 3.47Å; R11-E15 PolarHBondContact O-N 3.49Å; E15-R18 PolarHBondContact O-N 3.12Å; E15-K19 WeakPolarHBondContact O-CG 3.24Å; E15-K19 PolarHBondContact O-N 2.98Å; E15-K19 VanDerWaalsContact OE1-CE 3.26Å; E15-K19 WeakPolarHBondContact OE1-CE 3.26Å; E15-K19 IonicContact OE1-NZ 2.62Å; E15-K19 PolarHBondContact OE1-NZ 3.41Å
16	N	70.1	Confident	69.6	Low	102 Å²	102	110.2 Å²	110.2	55%	0.545	53%	0.525	S	S	.	.	H	α-helix	trans	-67.7	-38.4	175.2	-74.8	-15.2	0	0	0	111.9	K12 I13 R18 K19 A20	K12-N16 WeakPolarHBondContact O-CB 3.35Å; K12-N16 PolarHBondContact O-N 3.5Å; K12-N16 PolarHBondContact O-ND2 2.96Å; I13-N16 PolarHBondContact O-N 2.97Å; N16-R18 PolarHBondContact O-N 3.01Å; N16-K19 PolarHBondContact O-N 3.32Å; N16-A20 WeakPolarHBondContact O-CB 3.4Å; N16-A20 PolarHBondContact O-N 3.43Å
17	R	76.4	Confident	69	Low	156 Å²	156	112.8 Å²	112.8	59%	0.589	53%	0.525	S	S	*	.	H	α-helix	trans	-58.7	-45.5	172.7	-175.4	-179	-176.8	153.8	1.5	111.4	I13 E14 A20 L21	I13-R17 WeakPolarHBondContact O-CB 3.43Å; I13-R17 PolarHBondContact O-N 3.4Å; E14-R17 WeakPolarHBondContact O-CB 3.3Å; E14-R17 PolarHBondContact O-N 2.96Å; E14-R17 WeakPolarHBondContact OE2-CD 3.49Å; R17-A20 PolarHBondContact O-N 3.36Å; R17-L21 HydrophobicContact CG-CD1 4.25Å; R17-L21 WeakPolarHBondContact O-CG 3.37Å; R17-L21 PolarHBondContact O-N 3.32Å
18	R	72.5	Confident	68.9	Low	142 Å²	142	113.8 Å²	113.8	54%	0.536	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-46.6	178.3	-155.6	-174	77.1	-142.3	-1.3	112	E14 E15 N16 A20 L21 E22	E14-R18 PolarHBondContact O-N 2.92Å; E15-R18 PolarHBondContact O-N 3.12Å; N16-R18 PolarHBondContact O-N 3.01Å; R18-A20 VanDerWaalsContact C-N 3.29Å; R18-A20 PolarHBondContact O-N 2.97Å; R18-L21 PolarHBondContact O-N 3.4Å; R18-L21 VanDerWaalsContact O-N 3.13Å; R18-E22 IonicContact CZ-OE1 3.65Å; R18-E22 IonicContact NE-OE1 2.79Å; R18-E22 PolarHBondContact NE-OE1 3.5Å; R18-E22 IonicContact NH2-OE1 3.63Å; R18-E22 WeakPolarHBondContact O-CG 3.38Å; R18-E22 PolarHBondContact O-N 3.06Å
19	K	73.3	Confident	68.5	Low	81 Å²	81	109.9 Å²	109.9	35%	0.352	51%	0.511	S	S	.	.	H	α-helix	trans	-60.2	-35.8	176	-71.3	170.9	-174.7	169	0	112.8	E15 N16 R23	E15-K19 WeakPolarHBondContact O-CG 3.24Å; E15-K19 PolarHBondContact O-N 2.98Å; E15-K19 VanDerWaalsContact OE1-CE 3.26Å; E15-K19 WeakPolarHBondContact OE1-CE 3.26Å; E15-K19 IonicContact OE1-NZ 2.62Å; E15-K19 PolarHBondContact OE1-NZ 3.41Å; N16-K19 PolarHBondContact O-N 3.32Å; K19-R23 WeakPolarHBondContact O-CB 3.5Å; K19-R23 VanDerWaalsContact O-CG 3.29Å; K19-R23 WeakPolarHBondContact O-CG 3.29Å; K19-R23 PolarHBondContact O-N 3.05Å; K19-R23 VanDerWaalsContact O-N 3.12Å
20	A	60.3	Low	68	Low	60 Å²	60	111.9 Å²	111.9	50%	0.496	52%	0.52	S	S	.	.	H	α-helix	trans	-67.9	-41.2	174.6	0	0	0	0	0	112.2	N16 R17 R18 R23 R24	N16-A20 WeakPolarHBondContact O-CB 3.4Å; N16-A20 PolarHBondContact O-N 3.43Å; R17-A20 PolarHBondContact O-N 3.36Å; R18-A20 VanDerWaalsContact C-N 3.29Å; R18-A20 PolarHBondContact O-N 2.97Å; A20-R23 PolarHBondContact O-N 2.93Å; A20-R24 WeakPolarHBondContact O-CB 3.21Å; A20-R24 PolarHBondContact O-N 3.45Å
21	L	71.4	Confident	66.9	Low	100 Å²	100	113.7 Å²	113.7	52%	0.524	53%	0.529	S	S	.	.	H	α-helix	trans	-66.7	-43.6	175.9	-70.3	168.6	0	0	0	112.3	R17 R18 R23 R24 A25	R17-L21 HydrophobicContact CG-CD1 4.25Å; R17-L21 WeakPolarHBondContact O-CG 3.37Å; R17-L21 PolarHBondContact O-N 3.32Å; R18-L21 PolarHBondContact O-N 3.4Å; R18-L21 VanDerWaalsContact O-N 3.13Å; L21-R23 PolarHBondContact O-N 2.79Å; L21-R24 PolarHBondContact O-N 2.99Å; L21-R24 VanDerWaalsContact O-N 3.17Å; L21-A25 PolarHBondContact O-N 3.35Å
22	E	70.1	Confident	65.5	Low	89 Å²	89	109.6 Å²	109.6	42%	0.416	53%	0.526	S	S	.	.	H	α-helix	trans	-56.5	-46.8	174.1	-72.3	163.6	-171.3	0	0	111.1	R18 R24 A25 Q26	R18-E22 IonicContact CZ-OE1 3.65Å; R18-E22 IonicContact NE-OE1 2.79Å; R18-E22 PolarHBondContact NE-OE1 3.5Å; R18-E22 IonicContact NH2-OE1 3.63Å; R18-E22 WeakPolarHBondContact O-CG 3.38Å; R18-E22 PolarHBondContact O-N 3.06Å; E22-R24 PolarHBondContact O-N 3.19Å; E22-A25 PolarHBondContact O-N 2.87Å; E22-Q26 WeakPolarHBondContact O-CG 3.41Å; E22-Q26 PolarHBondContact O-N 3.12Å
23	R	73.9	Confident	63.9	Low	159 Å²	159	108.8 Å²	108.8	60%	0.6	54%	0.535	S	S	*	.	H	α-helix	trans	-64.8	-37	175.3	-72.6	173.5	179.4	-169.2	-0.1	113.1	K19 A20 L21 Q26 R27	K19-R23 WeakPolarHBondContact O-CB 3.5Å; K19-R23 VanDerWaalsContact O-CG 3.29Å; K19-R23 WeakPolarHBondContact O-CG 3.29Å; K19-R23 PolarHBondContact O-N 3.05Å; K19-R23 VanDerWaalsContact O-N 3.12Å; A20-R23 PolarHBondContact O-N 2.93Å; L21-R23 PolarHBondContact O-N 2.79Å; R23-Q26 PolarHBondContact O-N 2.64Å; R23-R27 PolarHBondContact O-N 2.9Å
24	R	63.5	Low	62.3	Low	163 Å²	163	108.6 Å²	108.6	62%	0.615	55%	0.548	S	S	*	.	H	α-helix	trans	-67.2	-39.2	176.8	-166.5	173.2	-175.1	169.3	2.5	111.6	A20 L21 E22 R27 L28	A20-R24 WeakPolarHBondContact O-CB 3.21Å; A20-R24 PolarHBondContact O-N 3.45Å; L21-R24 PolarHBondContact O-N 2.99Å; L21-R24 VanDerWaalsContact O-N 3.17Å; E22-R24 PolarHBondContact O-N 3.19Å; R24-R27 PolarHBondContact O-N 3.22Å; R24-L28 WeakPolarHBondContact O-CG 3.28Å; R24-L28 PolarHBondContact O-N 3.46Å; R24-L28 VanDerWaalsContact O-N 3.09Å
25	A	70.1	Confident	60.7	Low	62 Å²	62	106.5 Å²	106.5	51%	0.512	55%	0.553	S	S	.	*	H	α-helix	trans	-63.3	-40.6	172.7	0	0	0	0	0	112.1	L21 E22 L28 G29	L21-A25 PolarHBondContact O-N 3.35Å; E22-A25 PolarHBondContact O-N 2.87Å; A25-L28 PolarHBondContact O-N 3.46Å; A25-G29 PolarHBondContact O-N 3.44Å
26	Q	70.9	Confident	58.8	Low	127 Å²	127	112.2 Å²	112.2	59%	0.593	58%	0.577	S	S	*	*	H	α-helix	trans	-62.8	-44.4	174.8	-72.1	171.1	-9	0	0	112.6	E22 R23 L28 G29 Q30	E22-Q26 WeakPolarHBondContact O-CG 3.41Å; E22-Q26 PolarHBondContact O-N 3.12Å; R23-Q26 PolarHBondContact O-N 2.64Å; Q26-L28 VanDerWaalsContact C-N 3.35Å; Q26-L28 PolarHBondContact O-N 2.95Å; Q26-G29 PolarHBondContact O-N 3.3Å; Q26-Q30 WeakPolarHBondContact O-CG 3.34Å; Q26-Q30 PolarHBondContact O-N 3.42Å; Q26-Q30 VanDerWaalsContact O-N 3.09Å
27	R	65.7	Low	56.9	Low	132 Å²	132	115.8 Å²	115.8	50%	0.498	60%	0.596	S	S	.	*	H	α-helix	trans	-59.8	-42.5	175.1	-71.4	-179.3	-177.3	171.3	2.3	111.6	R23 R24 Q30 Q31 E670	R23-R27 PolarHBondContact O-N 2.9Å; R24-R27 PolarHBondContact O-N 3.22Å; R27-Q30 PolarHBondContact O-N 3.03Å; R27-Q31 PolarHBondContact O-N 3.05Å; R27-E670 IonicContact NH2-OE2 3.92Å; R27-E670 PolarHBondContact NH2-OE2 3.42Å
28	L	62.3	Low	54.6	Low	100 Å²	100	111.9 Å²	111.9	52%	0.524	60%	0.604	S	S	.	*	H	α-helix	trans	-64.5	-44.5	176.7	-75.9	163.6	0	0	0	112.6	R24 A25 Q26 Q30 Q31 T32	R24-L28 WeakPolarHBondContact O-CG 3.28Å; R24-L28 PolarHBondContact O-N 3.46Å; R24-L28 VanDerWaalsContact O-N 3.09Å; A25-L28 PolarHBondContact O-N 3.46Å; Q26-L28 VanDerWaalsContact C-N 3.35Å; Q26-L28 PolarHBondContact O-N 2.95Å; L28-Q30 VanDerWaalsContact C-N 3.33Å; L28-Q30 PolarHBondContact O-N 3.24Å; L28-Q31 PolarHBondContact O-N 3.01Å; L28-T32 PolarHBondContact O-N 3.32Å; L28-T32 PolarHBondContact O-OG1 2.81Å
29	G	52.1	Low	52.6	Low	37 Å²	37	109.5 Å²	109.5	38%	0.381	62%	0.615	S	S	.	*	H	α-helix	trans	-60.3	-40.3	176.8	0	0	0	0	0	113.2	A25 Q26 Q31 T32 S33	A25-G29 PolarHBondContact O-N 3.44Å; Q26-G29 PolarHBondContact O-N 3.3Å; G29-Q31 PolarHBondContact O-N 3.11Å; G29-T32 WeakPolarHBondContact CA-OG1 3.2Å; G29-T32 PolarHBondContact O-N 3.34Å; G29-T32 PolarHBondContact O-OG1 3.42Å; G29-S33 PolarHBondContact O-N 2.8Å; G29-S33 PolarHBondContact O-OG 3.46Å
30	Q	52.1	Low	50.4	Low	139 Å²	139	110.8 Å²	110.8	65%	0.65	63%	0.634	S	S	*	*	H	α-helix	trans	-66.5	-34	177.2	-73.6	178	-14.4	0	0	113.1	Q26 R27 L28 S33	Q26-Q30 WeakPolarHBondContact O-CG 3.34Å; Q26-Q30 PolarHBondContact O-N 3.42Å; Q26-Q30 VanDerWaalsContact O-N 3.09Å; R27-Q30 PolarHBondContact O-N 3.03Å; L28-Q30 VanDerWaalsContact C-N 3.33Å; L28-Q30 PolarHBondContact O-N 3.24Å; Q30-S33 WeakPolarHBondContact CA-OG 3.47Å; Q30-S33 PolarHBondContact O-N 3Å; Q30-S33 PolarHBondContact O-OG 3.46Å
31	Q	42.5	Very low	48.9	Very low	146 Å²	146	114.6 Å²	114.6	68%	0.682	65%	0.651	S	S	*	*	H	α-helix	trans	-68.2	-37.9	174.3	-73.4	-179.9	-26.3	0	0	112.2	R27 L28 G29 S33 A34	R27-Q31 PolarHBondContact O-N 3.05Å; L28-Q31 PolarHBondContact O-N 3.01Å; G29-Q31 PolarHBondContact O-N 3.11Å; Q31-S33 VanDerWaalsContact C-N 3.35Å; Q31-S33 PolarHBondContact O-N 3.17Å; Q31-A34 PolarHBondContact O-N 2.75Å
32	T	44.2	Very low	46.7	Very low	113 Å²	113	118 Å²	118	69%	0.693	66%	0.664	S	S	*	*	H	α-helix	trans	-67.2	-30.8	175.3	43.4	0	0	0	0	113.9	L28 G29 A34	L28-T32 PolarHBondContact O-N 3.32Å; L28-T32 PolarHBondContact O-OG1 2.81Å; G29-T32 WeakPolarHBondContact CA-OG1 3.2Å; G29-T32 PolarHBondContact O-N 3.34Å; G29-T32 PolarHBondContact O-OG1 3.42Å; T32-A34 VanDerWaalsContact C-N 3.31Å; T32-A34 PolarHBondContact O-N 3.15Å
33	S	39.9	Very low	44.6	Very low	97 Å²	97	120.4 Å²	120.4	68%	0.678	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-12	179.2	48.6	0	0	0	0	115.3	G29 Q30 Q31	G29-S33 PolarHBondContact O-N 2.8Å; G29-S33 PolarHBondContact O-OG 3.46Å; Q30-S33 WeakPolarHBondContact CA-OG 3.47Å; Q30-S33 PolarHBondContact O-N 3Å; Q30-S33 PolarHBondContact O-OG 3.46Å; Q31-S33 VanDerWaalsContact C-N 3.35Å; Q31-S33 PolarHBondContact O-N 3.17Å
34	A	36.8	Very low	42.3	Very low	91 Å²	91	118.6 Å²	118.6	75%	0.752	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-0	-179.8	0	0	0	0	0	113.9	Q31 T32	Q31-A34 PolarHBondContact O-N 2.75Å; T32-A34 VanDerWaalsContact C-N 3.31Å; T32-A34 PolarHBondContact O-N 3.15Å
35	G	35.7	Very low	40.5	Very low	56 Å²	56	119.6 Å²	119.6	58%	0.577	70%	0.696	S	S	*	*	S	Bend	trans	-106.8	3.5	-161.1	0	0	0	0	0	118.1
36	F	32	Very low	39	Very low	205 Å²	205	121.4 Å²	121.4	90%	0.899	70%	0.703	S	S	*	*			trans	-139.2	115.7	179.2	-91.6	-83.9	0	0	0	112.6
37	N	29.9	Very low	36.9	Very low	177 Å²	177	123.8 Å²	123.8	95%	0.947	71%	0.711	S	S	*	*			trans	-155.1	109.2	165.7	-124.6	-20.1	0	0	0	108.9
38	G	28.1	Very low	35	Very low	73 Å²	73	125.9 Å²	125.9	75%	0.753	73%	0.727	S	S	*	*			trans	176.2	126.2	-179	0	0	0	0	0	114.4
39	A	29.4	Very low	33.2	Very low	93 Å²	93	125.7 Å²	125.7	77%	0.769	73%	0.734	S	S	*	*			trans	64.1	102.1	167.4	0	0	0	0	0	119.3
40	S	27.5	Very low	32.1	Very low	108 Å²	108	131.3 Å²	131.3	76%	0.755	75%	0.75	S	S	*	*				39.4	138.7	127	63.2	0	0	0	0	120.5
41	V	28.1	Very low	30.9	Very low	140 Å²	140	130 Å²	130	85%	0.848	75%	0.747	S	S	*	*				-154.4	164.7	55	164.7	0	0	0	0	111.1
42	Q	26.8	Very low	30.3	Very low	170 Å²	170	130.9 Å²	130.9	79%	0.794	75%	0.751	S	S	*	*			trans	-81.8	147.2	178.1	-57.5	163.5	-80.5	0	0	114.1
43	T	26	Very low	29.6	Very low	140 Å²	140	135.9 Å²	135.9	86%	0.859	76%	0.757	S	S	*	*			trans	-160.6	98.8	143.5	16.4	0	0	0	0	112.9
44	D	24.3	Very low	29	Very low	121 Å²	121	138.9 Å²	138.9	65%	0.647	77%	0.766	S	S	*	*			trans	29.6	114.5	138.5	-64.9	-1.9	0	0	0	123.6
45	F	25.3	Very low	29.7	Very low	185 Å²	185	139.9 Å²	139.9	81%	0.811	77%	0.765	S	S	*	*				61	171.1	123.7	-64.4	-58.8	0	0	0	121.8
46	P	40.6	Very low	30.2	Very low	100 Å²	100	142.2 Å²	142.2	65%	0.649	77%	0.77	S	S	*	*				-138.2	165.2	-51.9	39	-24.7	0	0	0	114.8
47	K	25.5	Very low	30.1	Very low	177 Å²	177	139.9 Å²	139.9	77%	0.77	77%	0.766	S	S	*	*			trans	157.3	126	139.3	-87.1	160.8	-178.3	179.8	0	110.6
48	Q	25.3	Very low	29.9	Very low	176 Å²	176	136 Å²	136	82%	0.822	75%	0.752	S	S	*	*				62.7	124.3	77.2	-66.9	177.6	-33.2	0	0	112.6
49	S	25.5	Very low	30.1	Very low	96 Å²	96	139 Å²	139	67%	0.671	76%	0.756	S	S	*	*			cis	-158.2	-165.2	0.1	48.5	0	0	0	0	109.3
50	E	28.5	Very low	30.8	Very low	154 Å²	154	140.1 Å²	140.1	72%	0.72	76%	0.755	S	S	*	*			cis	-161.4	-164.8	15.8	-160	132.8	-39.4	0	0	114.2
51	N	27.8	Very low	31.5	Very low	112 Å²	112	140.8 Å²	140.8	60%	0.599	76%	0.757	S	S	*	*			trans	-44.7	156.3	179.1	-59.3	-41.2	0	0	0	117.6
52	H	30.1	Very low	31.8	Very low	164 Å²	164	145.4 Å²	145.4	76%	0.759	76%	0.759	S	S	*	*				-159.4	145.5	54.1	-98.9	-78	0	0	0	118.6
53	R	28.1	Very low	31.7	Very low	218 Å²	218	146.7 Å²	146.7	82%	0.823	76%	0.763	S	S	*	*			trans	6.8	114.3	150.3	-68.4	-179.3	175.6	171.1	-2.8	123
54	N	27.8	Very low	31.9	Very low	160 Å²	160	146.7 Å²	146.7	86%	0.856	76%	0.762	S	S	*	*				73	158.5	113.3	-76.7	19.6	0	0	0	124.8
55	P	51.5	Low	32.8	Very low	112 Å²	112	145.5 Å²	145.5	73%	0.727	76%	0.761	S	S	*	*			trans	-105.1	-160.3	-159.7	45.5	-37.6	0	0	0	113.4
56	P	46.6	Very low	33.8	Very low	106 Å²	106	142.4 Å²	142.4	69%	0.688	76%	0.76	S	S	*	*			cis	-151.1	-170.3	11.7	45.6	-22.8	0	0	0	120.8
57	L	29.4	Very low	33.1	Very low	156 Å²	156	146.7 Å²	146.7	82%	0.817	77%	0.768	S	S	*	*			trans	81.4	126.7	145.5	-84	167.9	0	0	0	125.6
58	S	27	Very low	33.3	Very low	95 Å²	95	146.3 Å²	146.3	66%	0.664	77%	0.767	S	S	*	*			trans	56.9	120.1	139.1	61.8	0	0	0	0	126.4
59	V	30.4	Very low	33.5	Very low	135 Å²	135	144.3 Å²	144.3	82%	0.818	76%	0.757	S	S	*	*				38.6	127.4	117.8	-179.9	0	0	0	0	118.6
60	P	44.4	Very low	33.5	Very low	117 Å²	117	145.4 Å²	145.4	76%	0.76	76%	0.755	S	S	*	*				-139.6	-142.1	57.5	34.2	-9.3	0	0	0	112.2
61	P	43.8	Very low	33.5	Very low	123 Å²	123	142.1 Å²	142.1	80%	0.799	75%	0.75	S	S	*	*			cis	-137.3	-140	-9	44.1	-22.1	0	0	0	115.6
62	R	33.3	Very low	33.4	Very low	236 Å²	236	144.6 Å²	144.6	89%	0.891	76%	0.758	S	S	*	*			trans	-150.4	162.6	176.4	-99	-174.9	174.3	177.8	-1.6	110.5
63	F	24.8	Very low	33.2	Very low	198 Å²	198	142.7 Å²	142.7	87%	0.868	75%	0.752	S	S	*	*			trans	-155.7	143	161.1	-140.2	-98.7	0	0	0	113.5
64	V	30.4	Very low	33.1	Very low	139 Å²	139	138.6 Å²	138.6	84%	0.842	75%	0.751	S	S	*	*			trans	-157.2	117.1	177.5	179.7	0	0	0	0	112.4
65	P	41.9	Very low	33	Very low	97 Å²	97	135.9 Å²	135.9	63%	0.63	75%	0.745	S	S	*	*			trans	-149	-171.5	136.9	42.8	-27.8	0	0	0	112.4
66	P	47.1	Very low	31.9	Very low	120 Å²	120	138.3 Å²	138.3	78%	0.779	75%	0.751	S	S	*	*			cis	-128.5	175.1	-13.1	39.3	-22.9	0	0	0	116.5
67	F	26.7	Very low	30.9	Very low	189 Å²	189	141.6 Å²	141.6	83%	0.829	76%	0.758	S	S	*	*			trans	-61.3	-177.6	159.5	-76	-97	0	0	0	113.5
68	K	28.8	Very low	30.9	Very low	169 Å²	169	141.2 Å²	141.2	74%	0.735	76%	0.755	S	S	*	*			cis	-169.9	176.7	30.8	-130.4	143.2	175.5	-87.2	0	106.9
69	Q	28.7	Very low	30.8	Very low	135 Å²	135	145 Å²	145	63%	0.631	76%	0.762	S	S	*	*			cis	-167.9	179.4	-5.9	-136.9	179.5	-68.8	0	0	105.1
70	D	25.9	Very low	30.6	Very low	118 Å²	118	148.8 Å²	148.8	63%	0.631	76%	0.761	S	S	*	*			cis	-162	164.2	-8.2	-155	-1.2	0	0	0	112.2
71	S	28.4	Very low	30.1	Very low	86 Å²	86	149.4 Å²	149.4	60%	0.601	77%	0.766	S	S	*	*			trans	69.1	148.9	148.8	85.6	0	0	0	0	118.8
72	Q	26.6	Very low	29.3	Very low	164 Å²	164	150.1 Å²	150.1	77%	0.766	76%	0.763	S	S	*	*			cis	-159.5	-173.5	11.6	-137.9	172	120.5	0	0	108
73	I	26.4	Very low	29.3	Very low	124 Å²	124	146.1 Å²	146.1	64%	0.636	75%	0.754	S	S	*	*			cis	-159.6	153.2	10.7	-169.3	163.7	0	0	0	112
74	T	25.8	Very low	29.5	Very low	131 Å²	131	143.9 Å²	143.9	80%	0.804	75%	0.746	S	S	*	*			trans	55.5	137.4	164.1	44.3	0	0	0	0	122.9
75	S	25.9	Very low	29.2	Very low	103 Å²	103	144.1 Å²	144.1	72%	0.72	74%	0.742	S	S	*	*			trans	-104.7	165.8	169.3	55.6	0	0	0	0	112.8
76	N	26.4	Very low	28.5	Very low	163 Å²	163	146.5 Å²	146.5	87%	0.872	75%	0.749	S	S	*	*				-158.1	157.7	129	-107.5	-20.6	0	0	0	113.7
77	Q	27.3	Very low	28.1	Very low	175 Å²	175	146.9 Å²	146.9	82%	0.818	75%	0.751	S	S	*	*			trans	-91.3	171.7	176.6	-58.4	173.2	-5.1	0	0	110.9
78	I	27.8	Very low	28	Very low	148 Å²	148	140.3 Å²	140.3	76%	0.759	74%	0.737	S	S	*	*				172.4	146.2	116.6	-91.2	165.5	0	0	0	114.5
79	H	25.9	Very low	27.9	Very low	176 Å²	176	139.2 Å²	139.2	82%	0.815	75%	0.745	S	S	*	*			trans	56	119	162	-83.1	-56.9	0	0	0	125
80	R	26.4	Very low	27.7	Very low	213 Å²	213	137 Å²	137	80%	0.804	74%	0.744	S	S	*	*			trans	-72.8	162.7	132.2	-65.1	174	170.6	168.8	-5.3	110.9
81	P	34.6	Very low	27.7	Very low	131 Å²	131	138.2 Å²	138.2	85%	0.851	75%	0.751	S	S	*	*				-115.4	166.5	129.9	36.1	-31.6	0	0	0	112.6
82	N	26.3	Very low	27.6	Very low	137 Å²	137	142.3 Å²	142.3	73%	0.733	76%	0.76	S	S	*	*			trans	-160.3	168.5	174.4	-170.4	16.9	0	0	0	109.4
83	Q	32.4	Very low	27.6	Very low	152 Å²	152	140.1 Å²	140.1	71%	0.71	76%	0.758	S	S	*	*			trans	72.6	152.3	-178.1	-58.3	-169.8	13.6	0	0	114.6
84	Q	29	Very low	27.5	Very low	152 Å²	152	141.3 Å²	141.3	71%	0.71	77%	0.765	S	S	*	*			cis	-132.6	-172.8	3.6	-132	164.1	74.4	0	0	107.8
85	L	25.4	Very low	27.8	Very low	144 Å²	144	144 Å²	144	75%	0.754	77%	0.766	S	S	*	*			cis	-151.6	178.9	20.7	-122.8	157.8	0	0	0	110.6
86	L	27.3	Very low	27.7	Very low	146 Å²	146	146.6 Å²	146.6	76%	0.764	77%	0.772	S	S	*	*			trans	-138.5	161.9	168.6	-95.1	170.6	0	0	0	106.6
87	P	38.2	Very low	27.8	Very low	129 Å²	129	144.4 Å²	144.4	84%	0.838	77%	0.765	S	S	*	*			cis	-138.9	-171.3	45.3	39	-17.8	0	0	0	113.3
88	G	24.7	Very low	27.8	Very low	51 Å²	51	144.7 Å²	144.7	53%	0.526	77%	0.766	S	S	.	*			cis	168.7	-169.4	-5.4	0	0	0	0	0	111.2
89	T	25.5	Very low	27.7	Very low	146 Å²	146	144.2 Å²	144.2	90%	0.896	77%	0.765	S	S	*	*			trans	68.8	152.3	-177.3	75.4	0	0	0	0	116.2
90	S	24.7	Very low	27.7	Very low	89 Å²	89	142.9 Å²	142.9	62%	0.622	76%	0.764	S	S	*	*			cis	-170.1	153.5	-33.6	52.8	0	0	0	0	110.2
91	N	26.9	Very low	27.6	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	76%	0.758	S	S	*	*			trans	67	122.7	167	-55.5	-15.7	0	0	0	115.8
92	Q	25.6	Very low	27.2	Very low	172 Å²	172	140.7 Å²	140.7	80%	0.804	76%	0.759	S	S	*	*				75.7	116.6	59.4	-73.3	-159.3	8	0	0	115.6
93	V	26.9	Very low	27.3	Very low	118 Å²	118	143.9 Å²	143.9	72%	0.715	76%	0.761	S	S	*	*			trans	50.1	113	135.5	-174.4	0	0	0	0	118.2
94	N	24.6	Very low	27.1	Very low	149 Å²	149	143.7 Å²	143.7	80%	0.797	76%	0.76	S	S	*	*				-153.5	138.3	118.4	-119.2	-25.9	0	0	0	114.2
95	K	32	Very low	27	Very low	186 Å²	186	142.1 Å²	142.1	81%	0.809	76%	0.761	S	S	*	*			trans	-95.9	142.6	150.6	-71.3	178.6	177.5	177.5	0	106.2
96	N	24.9	Very low	27	Very low	158 Å²	158	141.2 Å²	141.2	85%	0.845	76%	0.762	S	S	*	*			trans	-158.8	161.3	144.9	-118.5	-22.3	0	0	0	113.6
97	T	28	Very low	26.9	Very low	118 Å²	118	138.3 Å²	138.3	72%	0.724	76%	0.758	S	S	*	*			trans	-137.2	131.2	-170.3	-50.1	0	0	0	0	110
98	Q	26.3	Very low	26.9	Very low	180 Å²	180	138 Å²	138	84%	0.841	76%	0.757	S	S	*	*			trans	177.4	130.8	153.3	-97.1	156	31.2	0	0	107.2
99	N	25.7	Very low	28	Very low	138 Å²	138	141 Å²	141	74%	0.738	77%	0.766	S	S	*	*				63.1	106.9	67.8	-79.7	5.1	0	0	0	114.9
100	N	25.5	Very low	28.6	Very low	149 Å²	149	139.9 Å²	139.9	80%	0.797	76%	0.762	S	S	*	*				179.7	145.6	108.3	-95.1	-14.7	0	0	0	117.1
101	S	26.1	Very low	28.8	Very low	98 Å²	98	146.7 Å²	146.7	69%	0.685	77%	0.774	S	S	*	*			trans	59	94.9	136.1	-54	0	0	0	0	124.7
102	F	26.1	Very low	29	Very low	200 Å²	200	145.5 Å²	145.5	88%	0.877	77%	0.772	S	S	*	*				45.9	139.1	112.7	-92.4	-71.9	0	0	0	125.9
103	R	27.4	Very low	29.2	Very low	204 Å²	204	143.1 Å²	143.1	77%	0.77	77%	0.765	S	S	*	*			trans	99.6	115.1	139.4	-87.1	-170.7	170.6	-166.7	-5.2	122.6
104	Q	28.4	Very low	29.4	Very low	148 Å²	148	143.9 Å²	143.9	69%	0.692	76%	0.76	S	S	*	*			trans	70.8	149.1	132.9	-80.9	173.6	-112.7	0	0	119.8
105	V	26.9	Very low	29.5	Very low	118 Å²	118	143.5 Å²	143.5	72%	0.715	75%	0.754	S	S	*	*			cis	-147.6	-178.5	-12.5	77.6	0	0	0	0	108.1
106	T	24.8	Very low	29.3	Very low	126 Å²	126	140.1 Å²	140.1	77%	0.773	74%	0.744	S	S	*	*				-176.4	-179.6	70.2	-34.8	0	0	0	0	109.4
107	A	26	Very low	29.5	Very low	84 Å²	84	140.8 Å²	140.8	69%	0.694	74%	0.742	S	S	*	*			trans	-130.5	169.2	160	0	0	0	0	0	109.3
108	P	38.7	Very low	29.5	Very low	124 Å²	124	141.2 Å²	141.2	81%	0.805	74%	0.74	S	S	*	*				-153.9	-178.3	77.5	39.8	-18.6	0	0	0	116.6
109	P	47.5	Very low	29.5	Very low	112 Å²	112	140.3 Å²	140.3	73%	0.727	74%	0.74	S	S	*	*			trans	-116.3	174	178.3	42.2	-33.1	0	0	0	115.2
110	P	38.1	Very low	29.5	Very low	124 Å²	124	136.5 Å²	136.5	81%	0.805	73%	0.733	S	S	*	*			trans	-101.5	170.6	172.4	37.8	-32.8	0	0	0	115.6
111	R	28.7	Very low	29.6	Very low	231 Å²	231	134.7 Å²	134.7	87%	0.872	73%	0.732	S	S	*	*			trans	-146.2	173.4	177.9	-49	179.1	-177.4	163.7	-0.8	109.2
112	T	30.6	Very low	29.6	Very low	118 Å²	118	135.9 Å²	135.9	72%	0.724	74%	0.74	S	S	*	*			cis	-138.5	-145.2	-0.4	-22.8	0	0	0	0	106.4
113	N	29.8	Very low	29.6	Very low	122 Å²	122	130.4 Å²	130.4	65%	0.652	74%	0.74	S	S	*	*			cis	-158.5	-177	-5.8	-132.3	-4.1	0	0	0	106
114	Q	31.6	Very low	29.5	Very low	134 Å²	134	124.9 Å²	124.9	63%	0.626	75%	0.746	S	S	*	*			cis	-155.1	-162.4	0.5	-139.5	157.7	-58.8	0	0	104.5
115	H	27.4	Very low	29.3	Very low	142 Å²	142	121.8 Å²	121.8	66%	0.657	76%	0.755	S	S	*	*			cis	-158.8	-177.3	-4.5	-142.9	-17.6	0	0	0	109.1
116	L	26.7	Very low	29.2	Very low	114 Å²	114	123.6 Å²	123.6	60%	0.597	76%	0.76	S	S	*	*			trans	36.6	106.3	156.4	-61.8	168.6	0	0	0	119.8
117	Q	28.9	Very low	29.3	Very low	172 Å²	172	123.9 Å²	123.9	80%	0.804	76%	0.762	S	S	*	*				86.4	145.1	76.6	-84.8	-170.2	6.9	0	0	114.3
118	N	28.1	Very low	29.2	Very low	127 Å²	127	123.1 Å²	123.1	68%	0.679	76%	0.762	S	S	*	*			cis	-167.4	166.4	-22.5	-158.7	5.4	0	0	0	110
119	L	27	Very low	28.7	Very low	162 Å²	162	124 Å²	124	85%	0.848	77%	0.765	S	S	*	*			trans	65.8	148.4	167.9	-59.4	142.8	0	0	0	116.9
120	G	25.8	Very low	27.5	Very low	57 Å²	57	128 Å²	128	59%	0.588	77%	0.771	S	S	*	*			cis	167.2	158.4	-9.9	0	0	0	0	0	112.9
121	S	26.4	Very low	27.6	Very low	112 Å²	112	127.3 Å²	127.3	78%	0.783	77%	0.766	S	S	*	*			trans	56.3	112.4	163.3	34.1	0	0	0	0	118.6
122	S	27	Very low	27.4	Very low	123 Å²	123	122.5 Å²	122.5	86%	0.86	76%	0.762	S	S	*	*				86.1	128	60.8	72.9	0	0	0	0	115.1
123	G	25.6	Very low	27.2	Very low	85 Å²	85	125.2 Å²	125.2	88%	0.876	77%	0.767	S	S	*	*			trans	141	128.1	169.7	0	0	0	0	0	112.8
124	G	24.9	Very low	26.9	Very low	87 Å²	87	123.2 Å²	123.2	90%	0.897	77%	0.767	S	S	*	*			trans	-112.1	163.3	171.5	0	0	0	0	0	111.4
125	G	24.2	Very low	26.6	Very low	84 Å²	84	124.2 Å²	124.2	87%	0.866	78%	0.775	S	S	*	*			trans	-169.2	109.9	-179.7	0	0	0	0	0	111.8
126	N	25.4	Very low	26.4	Very low	155 Å²	155	122.1 Å²	122.1	83%	0.829	78%	0.777	S	S	*	*			trans	-89.8	172.6	-173.4	-172.1	17.8	0	0	0	112.2
127	V	26.4	Very low	26.3	Very low	133 Å²	133	123.1 Å²	123.1	81%	0.806	79%	0.787	S	S	*	*			trans	81.8	137.2	161.7	-170	0	0	0	0	118.5
128	G	24.9	Very low	26	Very low	68 Å²	68	121 Å²	121	70%	0.701	79%	0.786	S	S	*	*			trans	133	96.3	146.4	0	0	0	0	0	117.2
129	V	27.8	Very low	26	Very low	143 Å²	143	120.7 Å²	120.7	87%	0.867	79%	0.794	S	S	*	*			trans	-143.1	148.4	170.6	-174.6	0	0	0	0	111
130	K	23.2	Very low	25.9	Very low	195 Å²	195	116.8 Å²	116.8	85%	0.848	79%	0.793	S	S	*	*			trans	89.7	161.1	177.7	-58.7	-173.1	176.5	179.5	0	115.2
131	P	39.2	Very low	25.9	Very low	110 Å²	110	120.2 Å²	120.2	71%	0.714	81%	0.808	S	S	*	*			cis	-132.7	172.5	0.5	23.3	0.6	0	0	0	117.4
132	V	25.5	Very low	25.8	Very low	129 Å²	129	119.1 Å²	119.1	78%	0.782	81%	0.805	S	S	*	*			trans	71.6	158.9	148.6	153.8	0	0	0	0	116
133	Q	25.4	Very low	25.8	Very low	175 Å²	175	120.4 Å²	120.4	82%	0.818	81%	0.808	S	S	*	*			cis	-121.9	-120	9.4	-164.1	121.9	8	0	0	115.7
134	A	24.5	Very low	25.8	Very low	81 Å²	81	119.4 Å²	119.4	67%	0.669	80%	0.797	S	S	*	*			trans	-167.5	-171	-155	0	0	0	0	0	113.3
135	I	24.9	Very low	25.8	Very low	155 Å²	155	121.3 Å²	121.3	80%	0.795	80%	0.797	S	S	*	*			trans	76.9	107.9	178.5	-48	171.3	0	0	0	112.1
136	S	22.6	Very low	25.9	Very low	98 Å²	98	125.7 Å²	125.7	69%	0.685	79%	0.793	S	S	*	*			cis	90	140.8	34.2	84	0	0	0	0	114.5
137	V	24.1	Very low	26	Very low	135 Å²	135	129.7 Å²	129.7	82%	0.818	80%	0.798	S	S	*	*			cis	-104.2	-103.7	15.4	-167.2	0	0	0	0	113.3
138	T	23.8	Very low	25.9	Very low	126 Å²	126	132.3 Å²	132.3	77%	0.773	80%	0.798	S	S	*	*			cis	-155.5	164.2	0.3	-51.6	0	0	0	0	109.1
139	S	27.8	Very low	26.1	Very low	121 Å²	121	134.5 Å²	134.5	85%	0.846	80%	0.8	S	S	*	*			trans	-90.7	142.3	-172.7	53.4	0	0	0	0	116
140	G	24.7	Very low	26.1	Very low	80 Å²	80	134 Å²	134	83%	0.825	80%	0.8	S	S	*	*			trans	164.6	127.5	167.7	0	0	0	0	0	113.3
141	S	25.1	Very low	26.2	Very low	129 Å²	129	129.9 Å²	129.9	90%	0.902	80%	0.796	S	S	*	*			trans	-106.8	135.7	177.7	-68.7	0	0	0	0	111.9
142	A	25.1	Very low	25.8	Very low	89 Å²	89	132.7 Å²	132.7	74%	0.736	80%	0.803	S	S	*	*				163.3	158.6	113.4	0	0	0	0	0	114.3
143	V	26.3	Very low	26	Very low	151 Å²	151	132.4 Å²	132.4	92%	0.915	80%	0.803	S	S	*	*			trans	68.6	141.7	160.9	-161.4	0	0	0	0	118.9
144	G	26.3	Very low	26	Very low	63 Å²	63	129 Å²	129	65%	0.649	81%	0.805	S	S	*	*			trans	124.8	73.7	141.2	0	0	0	0	0	118.2
145	S	25.6	Very low	26	Very low	127 Å²	127	129.9 Å²	129.9	89%	0.888	81%	0.813	S	S	*	*			trans	-87.4	123.4	162.3	-174	0	0	0	0	110.5
146	F	25.2	Very low	26.1	Very low	177 Å²	177	131.7 Å²	131.7	78%	0.776	82%	0.818	S	S	*	*			trans	-106.4	136.4	170.3	-91.9	-95.8	0	0	0	110.3
147	Y	27.6	Very low	26.4	Very low	239 Å²	239	132.9 Å²	132.9	94%	0.937	82%	0.823	S	S	*	*				-161.9	150.1	126.5	-100.1	-66.4	0	0	0	109.2
148	K	24.4	Very low	26.5	Very low	187 Å²	187	132 Å²	132	81%	0.813	82%	0.82	S	S	*	*			trans	-144.2	129.9	-164.8	-168.5	-174.9	-178.2	-174.2	0	111.1
149	P	28.2	Very low	26.8	Very low	114 Å²	114	132.3 Å²	132.3	74%	0.74	82%	0.824	S	S	*	*			trans	-76.6	165.8	172.1	-15.5	31.6	0	0	0	113.5
150	P	29.7	Very low	26.7	Very low	133 Å²	133	138.3 Å²	138.3	86%	0.864	83%	0.828	S	S	*	*			trans	-86.3	176.8	-173	35.9	-37.1	0	0	0	114.8
151	S	24.9	Very low	26.6	Very low	109 Å²	109	140.4 Å²	140.4	76%	0.762	83%	0.829	S	S	*	*			trans	-148.3	140.4	-172.3	56.9	0	0	0	0	112.7
152	I	29.5	Very low	26.6	Very low	168 Å²	168	139.5 Å²	139.5	86%	0.862	82%	0.823	S	S	*	*			trans	-178.7	144.6	165	-103	151	0	0	0	108.8
153	P	29.8	Very low	26.8	Very low	123 Å²	123	141.8 Å²	141.8	80%	0.799	83%	0.828	S	S	*	*			cis	-119.9	-157.5	-43.9	39.2	-20.6	0	0	0	110.2
154	A	25.5	Very low	26.9	Very low	103 Å²	103	140.4 Å²	140.4	85%	0.851	83%	0.825	S	S	*	*			trans	-133	158.7	-177.7	0	0	0	0	0	114.5
155	A	25	Very low	26.9	Very low	100 Å²	100	142.1 Å²	142.1	83%	0.826	83%	0.833	S	S	*	*			trans	-138.1	157.1	166.3	0	0	0	0	0	110
156	Q	26.9	Very low	27.2	Very low	194 Å²	194	140.6 Å²	140.6	91%	0.907	83%	0.828	S	S	*	*			trans	-99.5	150.5	-160.3	-62	-179.3	-3.4	0	0	115.6
157	P	28.1	Very low	27.5	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	83%	0.832	S	S	*	*			trans	-114.4	146.4	164.7	38.3	-29.1	0	0	0	114.1
158	P	27.2	Very low	27.8	Very low	117 Å²	117	135.1 Å²	135.1	76%	0.76	83%	0.828	S	S	*	*			trans	-128.5	167.2	156.1	39	-28.1	0	0	0	112.9
159	P	30.7	Very low	28.7	Very low	131 Å²	131	136 Å²	136	85%	0.851	83%	0.832	S	S	*	*			cis	-117.4	-167	-21.6	37	-20.9	0	0	0	111.9
160	R	25.2	Very low	29.4	Very low	247 Å²	247	133.6 Å²	133.6	93%	0.932	82%	0.822	S	S	*	*			trans	-94.3	151.1	-171.8	-60.4	172	176.8	163.8	-2.5	113.9
161	C	22.6	Very low	30.5	Very low	125 Å²	125	131.5 Å²	131.5	85%	0.845	82%	0.816	S	S	*	*			trans	-142.4	168.1	140.5	-148.9	0	0	0	0	111.5
162	S	25.6	Very low	32.5	Very low	110 Å²	110	130.3 Å²	130.3	77%	0.769	80%	0.8	S	S	*	*			trans	-44.3	133.7	-164.8	51.7	0	0	0	0	117.9
163	T	27.8	Very low	34.6	Very low	136 Å²	136	126.8 Å²	126.8	83%	0.834	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-76.4	147.6	166.2	42.2	0	0	0	0	112.6
164	S	29.2	Very low	36.9	Very low	123 Å²	123	122 Å²	122	86%	0.86	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.2	128.1	170.5	47.2	0	0	0	0	111.3
165	A	27.3	Very low	39.7	Very low	99 Å²	99	126 Å²	126	82%	0.818	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-80.5	141.3	179.3	0	0	0	0	0	111.8
166	A	31.6	Very low	42.6	Very low	94 Å²	94	121.9 Å²	121.9	78%	0.777	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-66	135.5	171.2	0	0	0	0	0	110.9	K168	A166-K168 PolarHBondContact O-N 3.5Å
167	A	31	Very low	45.5	Very low	105 Å²	105	116.6 Å²	116.6	87%	0.868	69%	0.693	S	S	*	*			trans	-65.3	104.7	-179.7	0	0	0	0	0	111.3	K169	A167-K169 PolarHBondContact O-N 2.95Å
168	K	34.2	Very low	48.3	Very low	197 Å²	197	111 Å²	111	86%	0.857	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-65.4	129.3	167.5	-65.1	177.9	-179.4	176.4	0	108.3	A166 A170	A166-K168 PolarHBondContact O-N 3.5Å; K168-A170 PolarHBondContact O-N 3.37Å
169	K	41.9	Very low	51.1	Low	206 Å²	206	106.9 Å²	106.9	90%	0.896	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-57.8	133.6	165.3	-75.6	-169.6	173.9	-172	0	108.7	A167	A167-K169 PolarHBondContact O-N 2.95Å
170	A	44.8	Very low	53.7	Low	63 Å²	63	105 Å²	105	52%	0.521	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-58.2	144.9	174.3	0	0	0	0	0	110.3	K168 P233	K168-A170 PolarHBondContact O-N 3.37Å; A170-P233 HydrophobicContact CB-CB 4.25Å
171	A	51.8	Low	56.2	Low	89 Å²	89	97.6 Å²	97.6	74%	0.736	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-73.5	128.8	172.2	0	0	0	0	0	108.9	S173	A171-S173 PolarHBondContact O-N 3.32Å
172	I	67.3	Low	58.7	Low	83 Å²	83	94.6 Å²	94.6	43%	0.426	58%	0.577	S	S	.	*			trans	-65.9	104.4	174.7	-58.5	170.6	0	0	0	107.6	V174 R175 S234	I172-V174 WeakPolarHBondContact CG2-O 3.07Å; I172-R175 HydrophobicContact CG2-CG 3.86Å; I172-S234 CarbonylContact C-O 3.47Å
173	S	72.9	Confident	60.8	Low	95 Å²	95	98.3 Å²	98.3	66%	0.664	58%	0.582	S	S	*	*			trans	-82.9	-26.7	-176.3	-169.4	0	0	0	0	112.7	A171 S234	A171-S173 PolarHBondContact O-N 3.32Å; S173-S234 PolarHBondContact N-O 3.38Å
174	V	78.4	Confident	63.4	Low	21 Å²	21	97.3 Å²	97.3	13%	0.127	57%	0.572	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-136.2	135.5	-177.1	-179.8	0	0	0	0	110.2	I172 V190 H193 S234 V235 S236	I172-V174 WeakPolarHBondContact CG2-O 3.07Å; V174-V190 HydrophobicContact CG1-CG2 3.52Å; V174-H193 HydrophobicContact CG2-CB 4.16Å; V174-S234 PolarHBondContact N-O 2.91Å; V174-S234 VanDerWaalsContact N-O 3.09Å; V174-V235 HydrophobicContact CB-CG2 4.47Å; V174-V235 WeakPolarHBondContact O-CA 3.43Å; V174-S236 PolarHBondContact O-N 2.99Å
175	R	84.9	Confident	66.2	Low	187 Å²	187	94.5 Å²	94.5	71%	0.706	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.5	173.5	-62.5	-175.8	-175.2	179.2	1.4	110.4	I172 S236	I172-R175 HydrophobicContact CG2-CG 3.86Å; R175-S236 CarbonylContact C-O 3.57Å; R175-S236 VanDerWaalsContact CA-O 3.28Å; R175-S236 WeakPolarHBondContact CA-O 3.42Å
176	G	85.1	Confident	69.2	Low	14 Å²	14	89.8 Å²	89.8	14%	0.144	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	-174.7	175.2	0	0	0	0	0	112.7	E189 S236 L237 R238	G176-E189 CarbonylContact C-O 3.49Å; G176-E189 WeakPolarHBondContact CA-O 3.38Å; G176-S236 PolarHBondContact N-O 2.98Å; G176-L237 WeakPolarHBondContact O-CA 3.15Å; G176-R238 PolarHBondContact O-N 1.95Å
177	K	87.6	Confident	72	Confident	84 Å²	84	87.4 Å²	87.4	37%	0.365	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	142.9	176.5	57.3	-179.7	166.5	101.7	0	111.5	V179 E189 R238	K177-V179 HydrophobicContact CD-CG1 4.11Å; K177-V179 HydrophobicContact CG-CG1 4.39Å; K177-E189 WeakPolarHBondContact CE-OE2 3.29Å; K177-E189 HydrophobicContact CG-CB 4.14Å; K177-E189 PolarHBondContact N-O 3.1Å; K177-E189 IonicContact NZ-OE2 3.02Å; K177-E189 PolarHBondContact NZ-OE2 3.3Å; K177-E189 PolarHBondContact O-N 3.19Å; K177-R238 HydrophobicContact CB-CB 4.04Å
178	C	87.1	Confident	74.8	Confident	4 Å²	4	82.6 Å²	82.6	3%	0.027	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	134.3	164.1	-55.2	0	0	0	0	108.3	F186 K187 Y222 R238 L240	C178-F186 HydrophobicContact CB-CD2 3.91Å; C178-F186 HydrophobicContact CB-CE2 4.19Å; C178-K187 WeakPolarHBondContact CA-O 3.1Å; C178-Y222 HydrophobicContact CB-CE2 4.47Å; C178-R238 PolarHBondContact N-O 3.16Å; C178-L240 HydrophobicContact CB-CD1 3.47Å; C178-L240 VanDerWaalsContact CB-CD1 3.47Å; C178-L240 HydrophobicContact CB-CG 4.15Å
179	V	85.8	Confident	77.3	Confident	32 Å²	32	76.1 Å²	76.1	19%	0.194	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	148.4	-179.3	-88.6	0	0	0	0	110.5	K177 F186 K187 E189	K177-V179 HydrophobicContact CD-CG1 4.11Å; K177-V179 HydrophobicContact CG-CG1 4.39Å; V179-F186 CarbonylContact O-C 3.43Å; V179-F186 WeakPolarHBondContact O-CA 3.3Å; V179-K187 HydrophobicContact CG2-CD 4.43Å; V179-K187 HydrophobicContact CG2-CG 3.78Å; V179-K187 PolarHBondContact N-O 2.98Å; V179-K187 PolarHBondContact O-N 3.22Å; V179-E189 HydrophobicContact CG2-CG 4.09Å
180	P	85.6	Confident	79.4	Confident	92 Å²	92	68.4 Å²	68.4	60%	0.597	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.7	149.8	175.1	-24.9	34.2	0	0	0	112.7	L240	P180-L240 HydrophobicContact CG-CD2 4.2Å
181	H	77.1	Confident	81	Confident	91 Å²	91	67.5 Å²	67.5	42%	0.421	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	-41	-178.2	-174.4	32.8	0	0	0	113.7	R185 K187	H181-R185 WeakPolarHBondContact CA-O 3.28Å; H181-R185 WeakPolarHBondContact CB-O 3.37Å; H181-R185 PolarHBondContact N-O 3.06Å; H181-K187 HydrophobicContact CB-CB 4.1Å; H181-K187 HydrophobicContact CB-CD 4.48Å; H181-K187 HydrophobicContact CB-CG 4.14Å
182	A	75.3	Confident	82.4	Confident	61 Å²	61	72.7 Å²	72.7	50%	0.504	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	177.4	167.8	0	0	0	0	0	108.4	D184 R185	A182-D184 PolarHBondContact O-N 2.71Å; A182-R185 HydrophobicContact CB-CB 4.26Å; A182-R185 PolarHBondContact N-O 3.33Å; A182-R185 PolarHBondContact O-N 3.47Å
183	E	71.2	Confident	83.3	Confident	189 Å²	189	70.2 Å²	70.2	88%	0.883	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-49.2	-171.5	-63.1	-177.5	135.9	0	0	112.9
184	D	81.5	Confident	83.8	Confident	115 Å²	115	68.7 Å²	68.7	62%	0.615	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	17.9	176.4	-60.3	-53.2	0	0	0	114.3	A182 L219	A182-D184 PolarHBondContact O-N 2.71Å; D184-L219 PolarHBondContact O-N 3.19Å
185	R	89	Confident	84.1	Confident	63 Å²	63	72.9 Å²	72.9	24%	0.238	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.8	-175.3	-61.2	-173.7	69.9	83.3	-2.8	114.6	H181 A182 S205 N216 F217	H181-R185 WeakPolarHBondContact CA-O 3.28Å; H181-R185 WeakPolarHBondContact CB-O 3.37Å; H181-R185 PolarHBondContact N-O 3.06Å; A182-R185 HydrophobicContact CB-CB 4.26Å; A182-R185 PolarHBondContact N-O 3.33Å; A182-R185 PolarHBondContact O-N 3.47Å; R185-S205 PolarHBondContact NH1-O 3.35Å; R185-S205 PolarHBondContact NH2-O 3.02Å; R185-N216 VanDerWaalsContact CZ-OD1 3.31Å; R185-N216 PolarHBondContact NE-OD1 2.82Å; R185-N216 PolarHBondContact NH2-O 3.44Å; R185-N216 PolarHBondContact NH2-OD1 3.08Å; R185-F217 VanDerWaalsContact CA-O 3.25Å; R185-F217 WeakPolarHBondContact CA-O 3.48Å; R185-F217 WeakPolarHBondContact CB-O 3.43Å
186	F	89.9	Confident	84.3	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	153.1	173.5	76.3	-85.1	0	0	0	111.8	C178 V179 V188 N216 F217 S218 L219 Y222 L225 L240	C178-F186 HydrophobicContact CB-CD2 3.91Å; C178-F186 HydrophobicContact CB-CE2 4.19Å; V179-F186 CarbonylContact O-C 3.43Å; V179-F186 WeakPolarHBondContact O-CA 3.3Å; F186-V188 HydrophobicContact CD2-CG2 4.08Å; F186-V188 HydrophobicContact CE2-CG2 3.67Å; F186-N216 CarbonylContact O-C 3.53Å; F186-N216 WeakPolarHBondContact O-CA 3.4Å; F186-N216 VanDerWaalsContact O-CB 3.26Å; F186-N216 WeakPolarHBondContact O-CB 3.46Å; F186-F217 HydrophobicContact CD1-CB 4.23Å; F186-F217 HydrophobicContact CE1-CB 3.71Å; F186-F217 AromaticContact CE2-CD2 3.95Å; F186-F217 HydrophobicContact CE2-CD2 3.95Å; F186-F217 HydrophobicContact CZ-CB 3.87Å; F186-F217 HydrophobicContact CZ-CD2 4Å; F186-F217 HydrophobicContact CZ-CG 4.24Å; F186-F217 PolarHBondContact N-O 3.45Å; F186-F217 PolarHBondContact O-N 3.4Å; F186-S218 VanDerWaalsContact CE1-O 3.28Å; F186-S218 WeakPolarHBondContact CE1-O 3.41Å; F186-L219 HydrophobicContact CB-CD2 4.3Å; F186-L219 HydrophobicContact CD1-CD2 4.06Å; F186-Y222 HydrophobicContact CD1-CD2 4.43Å; F186-Y222 AromaticContact CE1-CD2 3.89Å; F186-Y222 HydrophobicContact CE1-CD2 3.89Å; F186-Y222 HydrophobicContact CE1-CG 4.31Å; F186-Y222 HydrophobicContact CE2-CD2 4.15Å; F186-Y222 AromaticContact CZ-CD2 3.74Å; F186-Y222 HydrophobicContact CZ-CD2 3.74Å; F186-Y222 HydrophobicContact CZ-CG 4.5Å; F186-L225 HydrophobicContact CE2-CD1 4.3Å; F186-L225 HydrophobicContact CE2-CD2 4.41Å; F186-L225 HydrophobicContact CZ-CD1 4.02Å; F186-L225 HydrophobicContact CZ-CD2 4.39Å; F186-L240 HydrophobicContact CB-CD1 3.76Å; F186-L240 HydrophobicContact CB-CD2 3.89Å; F186-L240 HydrophobicContact CB-CG 4.33Å; F186-L240 HydrophobicContact CD1-CD1 4.36Å; F186-L240 HydrophobicContact CD2-CD1 3.84Å; F186-L240 HydrophobicContact CE2-CD1 4.49Å; F186-L240 HydrophobicContact CG-CD1 3.75Å
187	K	90.3	Very high	84.4	Confident	45 Å²	45	64.9 Å²	64.9	20%	0.196	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	153.8	171.1	68.6	177.6	171.1	152.4	0	111.1	C178 V179 H181 E189 W215 N216	C178-K187 WeakPolarHBondContact CA-O 3.1Å; V179-K187 HydrophobicContact CG2-CD 4.43Å; V179-K187 HydrophobicContact CG2-CG 3.78Å; V179-K187 PolarHBondContact N-O 2.98Å; V179-K187 PolarHBondContact O-N 3.22Å; H181-K187 HydrophobicContact CB-CB 4.1Å; H181-K187 HydrophobicContact CB-CD 4.48Å; H181-K187 HydrophobicContact CB-CG 4.14Å; K187-E189 WeakPolarHBondContact CE-OE1 3.15Å; K187-E189 IonicContact NZ-OE1 3.19Å; K187-E189 PolarHBondContact NZ-OE1 3.09Å; K187-W215 CarbonylContact C-O 3.59Å; K187-W215 VanDerWaalsContact CA-O 3.27Å; K187-W215 WeakPolarHBondContact CA-O 3.35Å; K187-N216 HydrophobicContact CB-CB 3.89Å
188	V	89.8	Confident	84.4	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.018	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	114.3	177.1	-172.7	0	0	0	0	110	F186 V190 F200 W215 F217 L225 L237	F186-V188 HydrophobicContact CD2-CG2 4.08Å; F186-V188 HydrophobicContact CE2-CG2 3.67Å; V188-V190 HydrophobicContact CG1-CB 4.25Å; V188-V190 HydrophobicContact CG1-CG1 4.03Å; V188-F200 HydrophobicContact CB-CE1 4.42Å; V188-F200 HydrophobicContact CB-CZ 3.94Å; V188-F200 HydrophobicContact CG1-CE1 4.31Å; V188-F200 HydrophobicContact CG1-CZ 3.68Å; V188-F200 HydrophobicContact CG2-CE1 4.36Å; V188-F200 HydrophobicContact CG2-CZ 4.38Å; V188-W215 PolarHBondContact N-O 3.31Å; V188-F217 HydrophobicContact CG2-CD2 4.11Å; V188-F217 HydrophobicContact CG2-CE2 3.79Å; V188-L225 HydrophobicContact CG2-CD1 4.5Å; V188-L237 HydrophobicContact CG1-CD1 3.72Å; V188-L237 HydrophobicContact CG1-CD2 3.7Å; V188-L237 HydrophobicContact CG1-CG 4.37Å
189	E	86.9	Confident	84.5	Confident	62 Å²	62	64.2 Å²	64.2	29%	0.29	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	106.9	175.2	-69.4	179	-175.6	0	0	109.1	G176 K177 V179 K187	G176-E189 CarbonylContact C-O 3.49Å; G176-E189 WeakPolarHBondContact CA-O 3.38Å; K177-E189 WeakPolarHBondContact CE-OE2 3.29Å; K177-E189 HydrophobicContact CG-CB 4.14Å; K177-E189 PolarHBondContact N-O 3.1Å; K177-E189 IonicContact NZ-OE2 3.02Å; K177-E189 PolarHBondContact NZ-OE2 3.3Å; K177-E189 PolarHBondContact O-N 3.19Å; V179-E189 HydrophobicContact CG2-CG 4.09Å; K187-E189 WeakPolarHBondContact CE-OE1 3.15Å; K187-E189 IonicContact NZ-OE1 3.19Å; K187-E189 PolarHBondContact NZ-OE1 3.09Å
190	V	85.1	Confident	84.9	Confident	43 Å²	43	62.8 Å²	62.8	26%	0.261	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	153.1	-173.6	68.3	0	0	0	0	111.1	V174 V188 L196 F200 L237	V174-V190 HydrophobicContact CG1-CG2 3.52Å; V188-V190 HydrophobicContact CG1-CB 4.25Å; V188-V190 HydrophobicContact CG1-CG1 4.03Å; V190-L196 HydrophobicContact CB-CD2 4.26Å; V190-L196 HydrophobicContact CG1-CD2 3.75Å; V190-L196 HydrophobicContact CG2-CD2 3.61Å; V190-F200 HydrophobicContact CG1-CE2 3.84Å; V190-F200 HydrophobicContact CG1-CZ 3.93Å; V190-L237 HydrophobicContact CB-CD2 4.09Å; V190-L237 HydrophobicContact CG2-CD2 3.95Å
191	G	79.4	Confident	85	Confident	44 Å²	44	64.3 Å²	64.3	45%	0.454	34%	0.339	S	S	.	.			trans	-70.8	163.5	171.8	0	0	0	0	0	113.1	H193	G191-H193 PolarHBondContact O-N 2.91Å
192	Y	80.2	Confident	85.6	Confident	198 Å²	198	62.9 Å²	62.9	78%	0.776	34%	0.339	S	S	*	.			trans	-60.5	122.3	178.7	-179.7	-88.9	0	0	0	111.7	I197	Y192-I197 HydrophobicContact CD2-CD1 3.38Å; Y192-I197 HydrophobicContact CE2-CD1 3.43Å; Y192-I197 VanDerWaalsContact CE2-CD1 3.43Å; Y192-I197 HydrophobicContact CG-CD1 4.16Å
193	H	85.9	Confident	86.4	Confident	31 Å²	31	60 Å²	60	14%	0.144	32%	0.315	C	S	.	.			trans	-144.8	121.1	173.4	-169.6	-98	0	0	0	109.3	V174 G191 E195 L196 I197 S234 V235	V174-H193 HydrophobicContact CG2-CB 4.16Å; G191-H193 PolarHBondContact O-N 2.91Å; H193-E195 IonicContact CE1-OE2 3.16Å; H193-E195 PolarHBondContact CE1-OE2 2.9Å; H193-E195 PolarHBondContact O-N 2.82Å; H193-L196 HydrophobicContact CB-CB 3.89Å; H193-L196 PolarHBondContact O-N 3.32Å; H193-L196 VanDerWaalsContact O-N 3.17Å; H193-I197 WeakPolarHBondContact O-CG1 3.11Å; H193-I197 PolarHBondContact O-N 3.49Å; H193-S234 PolarHBondContact CE1-OG 3.49Å; H193-S234 PolarHBondContact NE2-OG 2.87Å; H193-V235 WeakPolarHBondContact ND1-CG2 3.49Å
194	A	83.4	Confident	87	Confident	63 Å²	63	55.3 Å²	55.3	52%	0.521	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-46.6	-168.5	0	0	0	0	0	113.3	L196 I197 A198	A194-L196 VanDerWaalsContact C-N 3.3Å; A194-L196 PolarHBondContact O-N 3.39Å; A194-I197 PolarHBondContact O-N 2.98Å; A194-A198 PolarHBondContact O-N 3.42Å
195	E	85.8	Confident	87.3	Confident	110 Å²	110	51.1 Å²	51.1	51%	0.514	28%	0.281	S	S	.	.	H	α-helix	trans	-65.7	-33.6	178.8	-59.4	170.7	166.7	0	0	112	H193 A198 V199 I232	H193-E195 IonicContact CE1-OE2 3.16Å; H193-E195 PolarHBondContact CE1-OE2 2.9Å; H193-E195 PolarHBondContact O-N 2.82Å; E195-A198 WeakPolarHBondContact O-CB 3.27Å; E195-A198 PolarHBondContact O-N 2.89Å; E195-V199 PolarHBondContact O-N 3.34Å; E195-V199 VanDerWaalsContact O-N 3.07Å; E195-I232 HydrophobicContact CB-CD1 4.11Å
196	L	88.7	Confident	87.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-71.9	-37.4	178.5	-175.4	58.7	0	0	0	111	V190 H193 A194 A198 V199 F200 V229 V235	V190-L196 HydrophobicContact CB-CD2 4.26Å; V190-L196 HydrophobicContact CG1-CD2 3.75Å; V190-L196 HydrophobicContact CG2-CD2 3.61Å; H193-L196 HydrophobicContact CB-CB 3.89Å; H193-L196 PolarHBondContact O-N 3.32Å; H193-L196 VanDerWaalsContact O-N 3.17Å; A194-L196 VanDerWaalsContact C-N 3.3Å; A194-L196 PolarHBondContact O-N 3.39Å; L196-A198 VanDerWaalsContact C-N 3.26Å; L196-A198 PolarHBondContact O-N 3.06Å; L196-V199 PolarHBondContact O-N 2.88Å; L196-F200 HydrophobicContact CD1-CD1 4.34Å; L196-F200 HydrophobicContact CD1-CE1 3.65Å; L196-F200 HydrophobicContact CD1-CZ 3.77Å; L196-F200 HydrophobicContact CD2-CE2 4.24Å; L196-F200 HydrophobicContact CD2-CZ 3.86Å; L196-F200 HydrophobicContact CG-CD2 4.5Å; L196-F200 HydrophobicContact CG-CE1 3.89Å; L196-F200 HydrophobicContact CG-CE2 3.88Å; L196-F200 HydrophobicContact CG-CZ 3.53Å; L196-F200 WeakPolarHBondContact O-CD1 3.42Å; L196-F200 VanDerWaalsContact O-CG 3.25Å; L196-F200 WeakPolarHBondContact O-CG 3.43Å; L196-F200 PolarHBondContact O-N 3.49Å; L196-V229 HydrophobicContact CD1-CG1 4.39Å; L196-V229 HydrophobicContact CD1-CG2 3.52Å; L196-V235 HydrophobicContact CB-CG2 4.49Å; L196-V235 HydrophobicContact CD1-CG1 4.25Å; L196-V235 HydrophobicContact CD2-CG1 3.96Å; L196-V235 HydrophobicContact CD2-CG2 4.46Å
197	I	88.1	Confident	87.2	Confident	32 Å²	32	56.3 Å²	56.3	16%	0.164	31%	0.31	C	S	.	.	H	α-helix	trans	-69.5	-26.4	172.9	-66.3	165	0	0	0	111	Y192 H193 A194 K201 W215	Y192-I197 HydrophobicContact CD2-CD1 3.38Å; Y192-I197 HydrophobicContact CE2-CD1 3.43Å; Y192-I197 VanDerWaalsContact CE2-CD1 3.43Å; Y192-I197 HydrophobicContact CG-CD1 4.16Å; H193-I197 WeakPolarHBondContact O-CG1 3.11Å; H193-I197 PolarHBondContact O-N 3.49Å; A194-I197 PolarHBondContact O-N 2.98Å; I197-K201 HydrophobicContact CG2-CD 4.34Å; I197-K201 WeakPolarHBondContact O-CB 3.38Å; I197-K201 VanDerWaalsContact O-CG 3.24Å; I197-K201 WeakPolarHBondContact O-CG 3.47Å; I197-K201 PolarHBondContact O-N 3.34Å; I197-K201 VanDerWaalsContact O-N 3.1Å; I197-W215 HydrophobicContact CG2-CZ2 4.42Å
198	A	87.6	Confident	87.2	Confident	58 Å²	58	58.7 Å²	58.7	48%	0.479	32%	0.318	S	S	.	.	H	α-helix	trans	-68	-43.1	169.7	0	0	0	0	0	111.6	A194 E195 L196 K201 S202	A194-A198 PolarHBondContact O-N 3.42Å; E195-A198 WeakPolarHBondContact O-CB 3.27Å; E195-A198 PolarHBondContact O-N 2.89Å; L196-A198 VanDerWaalsContact C-N 3.26Å; L196-A198 PolarHBondContact O-N 3.06Å; A198-K201 CarbonylContact O-C 3.55Å; A198-K201 WeakPolarHBondContact O-CA 3.27Å; A198-K201 WeakPolarHBondContact O-CB 3.43Å; A198-K201 PolarHBondContact O-N 3.38Å; A198-K201 VanDerWaalsContact O-N 3.12Å; A198-S202 PolarHBondContact O-N 2.94Å
199	V	89.1	Confident	86.8	Confident	15 Å²	15	60.5 Å²	60.5	9%	0.091	33%	0.328	C	S	.	.	H	α-helix	trans	-62.9	-44.8	171.3	172.9	0	0	0	0	111.5	E195 L196 K201 S202 I203 Q228 V229 I232	E195-V199 PolarHBondContact O-N 3.34Å; E195-V199 VanDerWaalsContact O-N 3.07Å; L196-V199 PolarHBondContact O-N 2.88Å; V199-K201 PolarHBondContact O-N 3.13Å; V199-S202 PolarHBondContact O-N 3.5Å; V199-S202 PolarHBondContact O-OG 2.98Å; V199-I203 PolarHBondContact O-N 3.17Å; V199-Q228 HydrophobicContact CG1-CB 3.58Å; V199-Q228 HydrophobicContact CG2-CB 4.08Å; V199-V229 HydrophobicContact CG1-CG2 4.2Å; V199-I232 HydrophobicContact CG2-CD1 3.9Å
200	F	92.6	Very high	86.3	Confident	3 Å²	3	62.4 Å²	62.4	1%	0.013	35%	0.345	C	S	.	.	H	α-helix	trans	-60.2	-21.7	174.4	-63.5	-14.9	0	0	0	113.3	V188 V190 L196 K206 W215 F217 L225	V188-F200 HydrophobicContact CB-CE1 4.42Å; V188-F200 HydrophobicContact CB-CZ 3.94Å; V188-F200 HydrophobicContact CG1-CE1 4.31Å; V188-F200 HydrophobicContact CG1-CZ 3.68Å; V188-F200 HydrophobicContact CG2-CE1 4.36Å; V188-F200 HydrophobicContact CG2-CZ 4.38Å; V190-F200 HydrophobicContact CG1-CE2 3.84Å; V190-F200 HydrophobicContact CG1-CZ 3.93Å; L196-F200 HydrophobicContact CD1-CD1 4.34Å; L196-F200 HydrophobicContact CD1-CE1 3.65Å; L196-F200 HydrophobicContact CD1-CZ 3.77Å; L196-F200 HydrophobicContact CD2-CE2 4.24Å; L196-F200 HydrophobicContact CD2-CZ 3.86Å; L196-F200 HydrophobicContact CG-CD2 4.5Å; L196-F200 HydrophobicContact CG-CE1 3.89Å; L196-F200 HydrophobicContact CG-CE2 3.88Å; L196-F200 HydrophobicContact CG-CZ 3.53Å; L196-F200 WeakPolarHBondContact O-CD1 3.42Å; L196-F200 VanDerWaalsContact O-CG 3.25Å; L196-F200 WeakPolarHBondContact O-CG 3.43Å; L196-F200 PolarHBondContact O-N 3.49Å; F200-K206 WeakPolarHBondContact O-CB 3.47Å; F200-K206 WeakPolarHBondContact O-CD 3.49Å; F200-W215 HydrophobicContact CB-CD2 3.86Å; F200-W215 HydrophobicContact CB-CE3 4.03Å; F200-W215 HydrophobicContact CB-CG 4.15Å; F200-W215 HydrophobicContact CD2-CB 4Å; F200-W215 AromaticContact CD2-CD1 3.51Å; F200-W215 HydrophobicContact CD2-CD2 4.14Å; F200-W215 AromaticContact CD2-CG 3.61Å; F200-W215 HydrophobicContact CD2-CG 3.61Å; F200-W215 AromaticContact CD2-NE1 3.96Å; F200-W215 HydrophobicContact CE2-CB 4.39Å; F200-W215 HydrophobicContact CE2-CG 4.3Å; F200-W215 HydrophobicContact CG-CB 4.38Å; F200-W215 HydrophobicContact CG-CD2 4.38Å; F200-W215 HydrophobicContact CG-CG 4.14Å; F200-F217 HydrophobicContact CB-CE1 4.4Å; F200-F217 HydrophobicContact CB-CZ 3.86Å; F200-F217 HydrophobicContact CD1-CE2 4.15Å; F200-F217 AromaticContact CD1-CZ 3.61Å; F200-F217 HydrophobicContact CD1-CZ 3.61Å; F200-F217 HydrophobicContact CE1-CE2 4.41Å; F200-F217 HydrophobicContact CE1-CZ 4.3Å; F200-F217 AromaticContact CG-CZ 3.78Å; F200-F217 HydrophobicContact CG-CZ 3.78Å; F200-L225 HydrophobicContact CD1-CD1 4.17Å; F200-L225 HydrophobicContact CE1-CD1 4.23Å
201	K	88.3	Confident	85.9	Confident	124 Å²	124	64.7 Å²	64.7	54%	0.539	37%	0.369	S	S	.	.	H	α-helix	trans	-88.1	-21.3	172.9	-74.1	171.9	-179.9	-177.6	0	114	I197 A198 V199 K206 W215	I197-K201 HydrophobicContact CG2-CD 4.34Å; I197-K201 WeakPolarHBondContact O-CB 3.38Å; I197-K201 VanDerWaalsContact O-CG 3.24Å; I197-K201 WeakPolarHBondContact O-CG 3.47Å; I197-K201 PolarHBondContact O-N 3.34Å; I197-K201 VanDerWaalsContact O-N 3.1Å; A198-K201 CarbonylContact O-C 3.55Å; A198-K201 WeakPolarHBondContact O-CA 3.27Å; A198-K201 WeakPolarHBondContact O-CB 3.43Å; A198-K201 PolarHBondContact O-N 3.38Å; A198-K201 VanDerWaalsContact O-N 3.12Å; V199-K201 PolarHBondContact O-N 3.13Å; K201-K206 WeakPolarHBondContact O-CE 3.18Å; K201-K206 PolarHBondContact O-NZ 3.47Å; K201-W215 HydrophobicContact CG-CH2 3.99Å
202	S	89.2	Confident	85.8	Confident	60 Å²	60	66.6 Å²	66.6	42%	0.42	37%	0.372	S	S	.	.	H	α-helix	trans	-75.5	-37.1	175.7	70.2	0	0	0	0	112.3	A198 V199 Q228	A198-S202 PolarHBondContact O-N 2.94Å; V199-S202 PolarHBondContact O-N 3.5Å; V199-S202 PolarHBondContact O-OG 2.98Å; S202-Q228 PolarHBondContact OG-OE1 2.93Å
203	I	91.4	Very high	86	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	-61.1	135.6	-176.3	-61.4	-61.6	0	0	0	112.4	V199 K206 F217 D221 Q224 L225	V199-I203 PolarHBondContact O-N 3.17Å; I203-K206 WeakPolarHBondContact O-CD 3.45Å; I203-K206 VanDerWaalsContact O-CG 3.28Å; I203-K206 WeakPolarHBondContact O-CG 3.4Å; I203-K206 PolarHBondContact O-NZ 3.43Å; I203-F217 HydrophobicContact CB-CD1 4.07Å; I203-F217 HydrophobicContact CB-CE1 4.05Å; I203-F217 HydrophobicContact CG1-CE1 4.49Å; I203-F217 HydrophobicContact CG2-CD1 3.6Å; I203-F217 HydrophobicContact CG2-CE1 4.11Å; I203-D221 HydrophobicContact CG2-CB 3.63Å; I203-D221 WeakPolarHBondContact CG2-OD2 3.35Å; I203-Q224 HydrophobicContact CD1-CB 4.24Å; I203-Q224 HydrophobicContact CD1-CG 4.14Å; I203-L225 HydrophobicContact CD1-CB 4.04Å; I203-L225 HydrophobicContact CG1-CB 4.24Å; I203-L225 HydrophobicContact CG1-CD1 4.33Å
204	P	83.8	Confident	85.9	Confident	91 Å²	91	64 Å²	64	59%	0.591	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-53.5	-178.7	-24.9	35.4	0	0	0	114.4	K206	P204-K206 PolarHBondContact O-N 3.25Å
205	S	88.7	Confident	86.3	Confident	28 Å²	28	63 Å²	63	20%	0.196	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	10.3	-172.1	69.2	0	0	0	0	115.2	R185 N207 S218 D221	R185-S205 PolarHBondContact NH1-O 3.35Å; R185-S205 PolarHBondContact NH2-O 3.02Å; S205-N207 PolarHBondContact O-N 3.45Å; S205-S218 PolarHBondContact OG-N 3.06Å; S205-D221 WeakPolarHBondContact CB-OD2 3.43Å; S205-D221 PolarHBondContact N-OD2 3.39Å; S205-D221 PolarHBondContact OG-OD2 3.42Å
206	K	89.4	Confident	86.5	Confident	85 Å²	85	58 Å²	58	37%	0.37	33%	0.325	S	S	.	.			trans	-54.5	133.4	-177.5	64.9	-177.7	165.2	-87.7	0	112.3	F200 K201 I203 P204 W215 F217	F200-K206 WeakPolarHBondContact O-CB 3.47Å; F200-K206 WeakPolarHBondContact O-CD 3.49Å; K201-K206 WeakPolarHBondContact O-CE 3.18Å; K201-K206 PolarHBondContact O-NZ 3.47Å; I203-K206 WeakPolarHBondContact O-CD 3.45Å; I203-K206 VanDerWaalsContact O-CG 3.28Å; I203-K206 WeakPolarHBondContact O-CG 3.4Å; I203-K206 PolarHBondContact O-NZ 3.43Å; P204-K206 PolarHBondContact O-N 3.25Å; K206-W215 HydrophobicContact CB-CE3 4.26Å; K206-W215 HydrophobicContact CB-CZ3 4.17Å; K206-W215 HydrophobicContact CD-CZ3 4.22Å; K206-W215 HydrophobicContact CG-CZ3 4.47Å; K206-F217 HydrophobicContact CB-CD1 4Å; K206-F217 HydrophobicContact CB-CE1 3.69Å
207	N	88.4	Confident	86.7	Confident	86 Å²	86	58 Å²	58	46%	0.46	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	140.4	168	-176.2	13.3	0	0	0	108.1	S205 W215 N216	S205-N207 PolarHBondContact O-N 3.45Å; N207-W215 CarbonylContact O-C 3.54Å; N207-W215 WeakPolarHBondContact O-CA 3.11Å; N207-N216 PolarHBondContact N-O 3.36Å; N207-N216 PolarHBondContact O-N 3.48Å
208	Y	88.8	Confident	86.7	Confident	96 Å²	96	57.3 Å²	57.3	38%	0.376	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	116.7	178	175.5	-101.6	0	0	0	108.8	P210 K213 W215	Y208-P210 VanDerWaalsContact O-CD 3.3Å; Y208-P210 WeakPolarHBondContact O-CD 3.45Å; Y208-K213 WeakPolarHBondContact CE2-O 3.48Å; Y208-K213 WeakPolarHBondContact OH-CA 3.39Å; Y208-K213 WeakPolarHBondContact OH-CB 3.48Å; Y208-W215 AromaticContact CD2-CD1 3.71Å; Y208-W215 AromaticContact CD2-CD2 3.87Å; Y208-W215 HydrophobicContact CD2-CD2 3.87Å; Y208-W215 AromaticContact CD2-CE2 3.55Å; Y208-W215 AromaticContact CD2-CG 3.98Å; Y208-W215 HydrophobicContact CD2-CG 3.98Å; Y208-W215 HydrophobicContact CD2-CZ2 4.06Å; Y208-W215 AromaticContact CD2-NE1 3.43Å; Y208-W215 AromaticContact CE2-NE1 3.8Å; Y208-W215 HydrophobicContact CG-CD2 4.42Å; Y208-W215 HydrophobicContact CG-CZ2 4.29Å
209	D	82.6	Confident	86.7	Confident	41 Å²	41	57.3 Å²	57.3	22%	0.219	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	114.9	177	170.2	19.7	0	0	0	110.1	A211 T212 K213 T214	D209-A211 PolarHBondContact O-N 3.09Å; D209-A211 WeakPolarHBondContact OD1-CB 3.37Å; D209-A211 PolarHBondContact OD1-N 3.38Å; D209-T212 WeakPolarHBondContact OD2-CB 3.33Å; D209-T212 WeakPolarHBondContact OD2-CG2 3.41Å; D209-T212 PolarHBondContact OD2-N 3.46Å; D209-T212 PolarHBondContact OD2-OG1 3.23Å; D209-K213 WeakPolarHBondContact O-CA 3.3Å; D209-K213 PolarHBondContact O-N 2.85Å; D209-T214 PolarHBondContact N-O 2.96Å
210	P	76.4	Confident	86.4	Confident	102 Å²	102	62.7 Å²	62.7	66%	0.662	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.9	178.8	-18.6	33.3	0	0	0	113.7	Y208	Y208-P210 VanDerWaalsContact O-CD 3.3Å; Y208-P210 WeakPolarHBondContact O-CD 3.45Å
211	A	76.7	Confident	86.2	Confident	91 Å²	91	63.8 Å²	63.8	75%	0.752	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-52	-176.6	0	0	0	0	0	111.8	D209	D209-A211 PolarHBondContact O-N 3.09Å; D209-A211 WeakPolarHBondContact OD1-CB 3.37Å; D209-A211 PolarHBondContact OD1-N 3.38Å
212	T	77.6	Confident	86.1	Confident	84 Å²	84	59 Å²	59	52%	0.515	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-13.9	174.8	64.9	0	0	0	0	113.9	D209 T214	D209-T212 WeakPolarHBondContact OD2-CB 3.33Å; D209-T212 WeakPolarHBondContact OD2-CG2 3.41Å; D209-T212 PolarHBondContact OD2-N 3.46Å; D209-T212 PolarHBondContact OD2-OG1 3.23Å; T212-T214 PolarHBondContact O-N 3.47Å; T212-T214 PolarHBondContact OG1-N 3.41Å; T212-T214 PolarHBondContact OG1-OG1 2.76Å
213	K	83.1	Confident	85.8	Confident	154 Å²	154	60.7 Å²	60.7	67%	0.67	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	27.7	-172.5	-55	179.3	-178.1	175.8	0	113.6	Y208 D209	Y208-K213 WeakPolarHBondContact CE2-O 3.48Å; Y208-K213 WeakPolarHBondContact OH-CA 3.39Å; Y208-K213 WeakPolarHBondContact OH-CB 3.48Å; D209-K213 WeakPolarHBondContact O-CA 3.3Å; D209-K213 PolarHBondContact O-N 2.85Å
214	T	85.3	Confident	85.7	Confident	21 Å²	21	64.9 Å²	64.9	13%	0.129	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	153.1	179.1	65.9	0	0	0	0	112.5	D209 T212	D209-T214 PolarHBondContact N-O 2.96Å; T212-T214 PolarHBondContact O-N 3.47Å; T212-T214 PolarHBondContact OG1-N 3.41Å; T212-T214 PolarHBondContact OG1-OG1 2.76Å
215	W	90.1	Very high	85.9	Confident	42 Å²	42	60.5 Å²	60.5	16%	0.159	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	137.9	171.8	-69.6	83.1	0	0	0	110	K187 V188 I197 F200 K201 K206 N207 Y208 F217	K187-W215 CarbonylContact C-O 3.59Å; K187-W215 VanDerWaalsContact CA-O 3.27Å; K187-W215 WeakPolarHBondContact CA-O 3.35Å; V188-W215 PolarHBondContact N-O 3.31Å; I197-W215 HydrophobicContact CG2-CZ2 4.42Å; F200-W215 HydrophobicContact CB-CD2 3.86Å; F200-W215 HydrophobicContact CB-CE3 4.03Å; F200-W215 HydrophobicContact CB-CG 4.15Å; F200-W215 HydrophobicContact CD2-CB 4Å; F200-W215 AromaticContact CD2-CD1 3.51Å; F200-W215 HydrophobicContact CD2-CD2 4.14Å; F200-W215 AromaticContact CD2-CG 3.61Å; F200-W215 HydrophobicContact CD2-CG 3.61Å; F200-W215 AromaticContact CD2-NE1 3.96Å; F200-W215 HydrophobicContact CE2-CB 4.39Å; F200-W215 HydrophobicContact CE2-CG 4.3Å; F200-W215 HydrophobicContact CG-CB 4.38Å; F200-W215 HydrophobicContact CG-CD2 4.38Å; F200-W215 HydrophobicContact CG-CG 4.14Å; K201-W215 HydrophobicContact CG-CH2 3.99Å; K206-W215 HydrophobicContact CB-CE3 4.26Å; K206-W215 HydrophobicContact CB-CZ3 4.17Å; K206-W215 HydrophobicContact CD-CZ3 4.22Å; K206-W215 HydrophobicContact CG-CZ3 4.47Å; N207-W215 CarbonylContact O-C 3.54Å; N207-W215 WeakPolarHBondContact O-CA 3.11Å; Y208-W215 AromaticContact CD2-CD1 3.71Å; Y208-W215 AromaticContact CD2-CD2 3.87Å; Y208-W215 HydrophobicContact CD2-CD2 3.87Å; Y208-W215 AromaticContact CD2-CE2 3.55Å; Y208-W215 AromaticContact CD2-CG 3.98Å; Y208-W215 HydrophobicContact CD2-CG 3.98Å; Y208-W215 HydrophobicContact CD2-CZ2 4.06Å; Y208-W215 AromaticContact CD2-NE1 3.43Å; Y208-W215 AromaticContact CE2-NE1 3.8Å; Y208-W215 HydrophobicContact CG-CD2 4.42Å; Y208-W215 HydrophobicContact CG-CZ2 4.29Å; W215-F217 HydrophobicContact CB-CE2 3.75Å; W215-F217 HydrophobicContact CB-CZ 3.71Å; W215-F217 HydrophobicContact CE3-CZ 4.46Å; W215-F217 HydrophobicContact CG-CZ 4.48Å
216	N	90.1	Very high	85.9	Confident	4 Å²	4	61 Å²	61	2%	0.021	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	151.6	175.1	72.8	82.7	0	0	0	112.7	R185 F186 K187 N207	R185-N216 VanDerWaalsContact CZ-OD1 3.31Å; R185-N216 PolarHBondContact NE-OD1 2.82Å; R185-N216 PolarHBondContact NH2-O 3.44Å; R185-N216 PolarHBondContact NH2-OD1 3.08Å; F186-N216 CarbonylContact O-C 3.53Å; F186-N216 WeakPolarHBondContact O-CA 3.4Å; F186-N216 VanDerWaalsContact O-CB 3.26Å; F186-N216 WeakPolarHBondContact O-CB 3.46Å; K187-N216 HydrophobicContact CB-CB 3.89Å; N207-N216 PolarHBondContact N-O 3.36Å; N207-N216 PolarHBondContact O-N 3.48Å
217	F	92.5	Very high	85.7	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	161.3	-166.7	-50.7	-87.5	0	0	0	110.3	R185 F186 V188 F200 I203 K206 W215 L225	R185-F217 VanDerWaalsContact CA-O 3.25Å; R185-F217 WeakPolarHBondContact CA-O 3.48Å; R185-F217 WeakPolarHBondContact CB-O 3.43Å; F186-F217 HydrophobicContact CD1-CB 4.23Å; F186-F217 HydrophobicContact CE1-CB 3.71Å; F186-F217 AromaticContact CE2-CD2 3.95Å; F186-F217 HydrophobicContact CE2-CD2 3.95Å; F186-F217 HydrophobicContact CZ-CB 3.87Å; F186-F217 HydrophobicContact CZ-CD2 4Å; F186-F217 HydrophobicContact CZ-CG 4.24Å; F186-F217 PolarHBondContact N-O 3.45Å; F186-F217 PolarHBondContact O-N 3.4Å; V188-F217 HydrophobicContact CG2-CD2 4.11Å; V188-F217 HydrophobicContact CG2-CE2 3.79Å; F200-F217 HydrophobicContact CB-CE1 4.4Å; F200-F217 HydrophobicContact CB-CZ 3.86Å; F200-F217 HydrophobicContact CD1-CE2 4.15Å; F200-F217 AromaticContact CD1-CZ 3.61Å; F200-F217 HydrophobicContact CD1-CZ 3.61Å; F200-F217 HydrophobicContact CE1-CE2 4.41Å; F200-F217 HydrophobicContact CE1-CZ 4.3Å; F200-F217 AromaticContact CG-CZ 3.78Å; F200-F217 HydrophobicContact CG-CZ 3.78Å; I203-F217 HydrophobicContact CB-CD1 4.07Å; I203-F217 HydrophobicContact CB-CE1 4.05Å; I203-F217 HydrophobicContact CG1-CE1 4.49Å; I203-F217 HydrophobicContact CG2-CD1 3.6Å; I203-F217 HydrophobicContact CG2-CE1 4.11Å; K206-F217 HydrophobicContact CB-CD1 4Å; K206-F217 HydrophobicContact CB-CE1 3.69Å; W215-F217 HydrophobicContact CB-CE2 3.75Å; W215-F217 HydrophobicContact CB-CZ 3.71Å; W215-F217 HydrophobicContact CE3-CZ 4.46Å; W215-F217 HydrophobicContact CG-CZ 4.48Å; F217-L225 HydrophobicContact CD1-CD1 4.05Å; F217-L225 HydrophobicContact CD2-CD1 3.59Å; F217-L225 HydrophobicContact CE1-CD1 3.96Å; F217-L225 HydrophobicContact CE2-CD1 3.51Å; F217-L225 HydrophobicContact CG-CD1 3.88Å; F217-L225 HydrophobicContact CZ-CD1 3.69Å
218	S	89.3	Confident	85.6	Confident	19 Å²	19	61.3 Å²	61.3	13%	0.133	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	152.5	168.8	-153.6	0	0	0	0	110.8	F186 S205 D220 D221	F186-S218 VanDerWaalsContact CE1-O 3.28Å; F186-S218 WeakPolarHBondContact CE1-O 3.41Å; S205-S218 PolarHBondContact OG-N 3.06Å; S218-D220 WeakPolarHBondContact CB-OD2 3.33Å; S218-D220 PolarHBondContact O-N 3.31Å; S218-D220 PolarHBondContact OG-OD2 3.09Å; S218-D221 PolarHBondContact O-N 2.9Å
219	L	86.3	Confident	85.5	Confident	57 Å²	57	57 Å²	57	30%	0.298	31%	0.314	S	S	.	.	S	Bend	trans	-62	-25.9	171.7	-70.5	178.4	0	0	0	112.7	D184 F186 D221 Y222 L240 I243	D184-L219 PolarHBondContact O-N 3.19Å; F186-L219 HydrophobicContact CB-CD2 4.3Å; F186-L219 HydrophobicContact CD1-CD2 4.06Å; L219-D221 PolarHBondContact O-N 2.87Å; L219-Y222 WeakPolarHBondContact O-CB 3.48Å; L219-Y222 PolarHBondContact O-N 3.1Å; L219-L240 HydrophobicContact CD2-CD2 4.19Å; L219-I243 HydrophobicContact CD2-CD1 3.85Å
220	D	84.8	Confident	85.5	Confident	128 Å²	128	59 Å²	59	68%	0.684	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-39.9	178.3	-42.6	-78.7	0	0	0	112.8	S218 Y222	S218-D220 WeakPolarHBondContact CB-OD2 3.33Å; S218-D220 PolarHBondContact O-N 3.31Å; S218-D220 PolarHBondContact OG-OD2 3.09Å; D220-Y222 PolarHBondContact O-N 3.32Å
221	D	87.1	Confident	85.9	Confident	27 Å²	27	58 Å²	58	14%	0.144	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-1.2	-179.6	-74.2	-12.2	0	0	0	112.6	I203 S205 S218 L219 T223 Q224 L225	I203-D221 HydrophobicContact CG2-CB 3.63Å; I203-D221 WeakPolarHBondContact CG2-OD2 3.35Å; S205-D221 WeakPolarHBondContact CB-OD2 3.43Å; S205-D221 PolarHBondContact N-OD2 3.39Å; S205-D221 PolarHBondContact OG-OD2 3.42Å; S218-D221 PolarHBondContact O-N 2.9Å; L219-D221 PolarHBondContact O-N 2.87Å; D221-T223 PolarHBondContact O-N 3.31Å; D221-Q224 PolarHBondContact O-N 2.97Å; D221-L225 WeakPolarHBondContact O-CB 3.2Å; D221-L225 PolarHBondContact O-N 3.49Å
222	Y	86.8	Confident	86.3	Confident	24 Å²	24	54.3 Å²	54.3	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-60.7	-43.7	-171.7	173.2	-114.6	0	0	0	113.3	C178 F186 L219 D220 L225 M226 P239 L240 I243	C178-Y222 HydrophobicContact CB-CE2 4.47Å; F186-Y222 HydrophobicContact CD1-CD2 4.43Å; F186-Y222 AromaticContact CE1-CD2 3.89Å; F186-Y222 HydrophobicContact CE1-CD2 3.89Å; F186-Y222 HydrophobicContact CE1-CG 4.31Å; F186-Y222 HydrophobicContact CE2-CD2 4.15Å; F186-Y222 AromaticContact CZ-CD2 3.74Å; F186-Y222 HydrophobicContact CZ-CD2 3.74Å; F186-Y222 HydrophobicContact CZ-CG 4.5Å; L219-Y222 WeakPolarHBondContact O-CB 3.48Å; L219-Y222 PolarHBondContact O-N 3.1Å; D220-Y222 PolarHBondContact O-N 3.32Å; Y222-L225 PolarHBondContact O-N 3.48Å; Y222-M226 HydrophobicContact CD2-CG 4.01Å; Y222-M226 HydrophobicContact CE1-CG 4.48Å; Y222-M226 HydrophobicContact CE2-CG 3.57Å; Y222-M226 HydrophobicContact CE2-SD 4.04Å; Y222-M226 WeakPolarHBondContact O-CB 3.44Å; Y222-M226 VanDerWaalsContact O-CG 3.28Å; Y222-M226 WeakPolarHBondContact O-CG 3.37Å; Y222-M226 PolarHBondContact O-N 3.43Å; Y222-P239 WeakPolarHBondContact OH-CA 3.47Å; Y222-P239 VanDerWaalsContact OH-CB 3.25Å; Y222-P239 WeakPolarHBondContact OH-CB 3.32Å; Y222-L240 HydrophobicContact CD2-CD1 3.69Å; Y222-L240 HydrophobicContact CE2-CD1 3.39Å; Y222-L240 PolarHBondContact OH-N 2.81Å; Y222-I243 HydrophobicContact CD1-CD1 4.35Å; Y222-I243 HydrophobicContact CD1-CG2 4.46Å; Y222-I243 HydrophobicContact CE1-CB 4.46Å; Y222-I243 HydrophobicContact CE1-CD1 4.48Å; Y222-I243 HydrophobicContact CE1-CG2 4.24Å
223	T	83.7	Confident	86.2	Confident	94 Å²	94	54.9 Å²	54.9	58%	0.577	31%	0.309	S	S	*	.	H	α-helix	trans	-64.1	-49.3	176.7	48	0	0	0	0	110.8	D221 L225 M226 D227	D221-T223 PolarHBondContact O-N 3.31Å; T223-L225 VanDerWaalsContact C-N 3.27Å; T223-L225 PolarHBondContact O-N 3Å; T223-M226 PolarHBondContact O-N 2.7Å; T223-M226 VanDerWaalsContact O-N 3.11Å; T223-D227 PolarHBondContact O-N 3.28Å
224	Q	87.6	Confident	86.2	Confident	88 Å²	88	48.7 Å²	48.7	41%	0.411	29%	0.286	S	S	.	.	H	α-helix	trans	-58.7	-36.7	178.7	-160.8	-162.7	21.1	0	0	112.8	I203 D221 Q228	I203-Q224 HydrophobicContact CD1-CB 4.24Å; I203-Q224 HydrophobicContact CD1-CG 4.14Å; D221-Q224 PolarHBondContact O-N 2.97Å; Q224-Q228 WeakPolarHBondContact O-CB 3.41Å; Q224-Q228 WeakPolarHBondContact O-CG 3.27Å; Q224-Q228 PolarHBondContact O-N 2.86Å; Q224-Q228 PolarHBondContact O-NE2 3.19Å
225	L	88.8	Confident	86.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-70.1	-47.1	174.5	-177.1	149.7	0	0	0	111.2	F186 V188 F200 I203 F217 D221 Y222 T223 D227 Q228 V229 L237	F186-L225 HydrophobicContact CE2-CD1 4.3Å; F186-L225 HydrophobicContact CE2-CD2 4.41Å; F186-L225 HydrophobicContact CZ-CD1 4.02Å; F186-L225 HydrophobicContact CZ-CD2 4.39Å; V188-L225 HydrophobicContact CG2-CD1 4.5Å; F200-L225 HydrophobicContact CD1-CD1 4.17Å; F200-L225 HydrophobicContact CE1-CD1 4.23Å; I203-L225 HydrophobicContact CD1-CB 4.04Å; I203-L225 HydrophobicContact CG1-CB 4.24Å; I203-L225 HydrophobicContact CG1-CD1 4.33Å; F217-L225 HydrophobicContact CD1-CD1 4.05Å; F217-L225 HydrophobicContact CD2-CD1 3.59Å; F217-L225 HydrophobicContact CE1-CD1 3.96Å; F217-L225 HydrophobicContact CE2-CD1 3.51Å; F217-L225 HydrophobicContact CG-CD1 3.88Å; F217-L225 HydrophobicContact CZ-CD1 3.69Å; D221-L225 WeakPolarHBondContact O-CB 3.2Å; D221-L225 PolarHBondContact O-N 3.49Å; Y222-L225 PolarHBondContact O-N 3.48Å; T223-L225 VanDerWaalsContact C-N 3.27Å; T223-L225 PolarHBondContact O-N 3Å; L225-D227 PolarHBondContact O-N 3.39Å; L225-Q228 PolarHBondContact O-N 3.29Å; L225-V229 HydrophobicContact CD2-CG2 4.16Å; L225-V229 WeakPolarHBondContact O-CB 3.31Å; L225-V229 VanDerWaalsContact O-CG2 3.24Å; L225-V229 WeakPolarHBondContact O-CG2 3.44Å; L225-V229 PolarHBondContact O-N 2.97Å; L225-L237 HydrophobicContact CD2-CD1 4.2Å
226	M	88.6	Confident	85.8	Confident	39 Å²	39	48.9 Å²	48.9	19%	0.192	29%	0.293	C	S	.	.	H	α-helix	trans	-64.4	-38.1	-178.5	-71.5	-62.8	-63.8	0	0	112.4	Y222 T223 V229 A230 P239	Y222-M226 HydrophobicContact CD2-CG 4.01Å; Y222-M226 HydrophobicContact CE1-CG 4.48Å; Y222-M226 HydrophobicContact CE2-CG 3.57Å; Y222-M226 HydrophobicContact CE2-SD 4.04Å; Y222-M226 WeakPolarHBondContact O-CB 3.44Å; Y222-M226 VanDerWaalsContact O-CG 3.28Å; Y222-M226 WeakPolarHBondContact O-CG 3.37Å; Y222-M226 PolarHBondContact O-N 3.43Å; T223-M226 PolarHBondContact O-N 2.7Å; T223-M226 VanDerWaalsContact O-N 3.11Å; M226-V229 PolarHBondContact O-N 2.87Å; M226-A230 WeakPolarHBondContact O-CB 3.39Å; M226-A230 PolarHBondContact O-N 3.48Å; M226-P239 HydrophobicContact CE-CG 4.09Å
227	D	84.8	Confident	85.5	Confident	117 Å²	117	49.3 Å²	49.3	63%	0.626	30%	0.295	S	S	*	.	H	α-helix	trans	-67.7	-45.2	176.6	-71.9	-20.7	0	0	0	112.3	T223 L225 V229 A230 A231	T223-D227 PolarHBondContact O-N 3.28Å; L225-D227 PolarHBondContact O-N 3.39Å; D227-V229 VanDerWaalsContact C-N 3.26Å; D227-V229 PolarHBondContact O-N 2.8Å; D227-A230 PolarHBondContact O-N 3.08Å; D227-A231 PolarHBondContact O-N 3.07Å
228	Q	86.1	Confident	85.1	Confident	59 Å²	59	57.5 Å²	57.5	28%	0.276	33%	0.327	S	S	.	.	H	α-helix	trans	-64.1	-31.7	175	-79.4	179.4	78.7	0	0	112.5	V199 S202 Q224 L225	V199-Q228 HydrophobicContact CG1-CB 3.58Å; V199-Q228 HydrophobicContact CG2-CB 4.08Å; S202-Q228 PolarHBondContact OG-OE1 2.93Å; Q224-Q228 WeakPolarHBondContact O-CB 3.41Å; Q224-Q228 WeakPolarHBondContact O-CG 3.27Å; Q224-Q228 PolarHBondContact O-N 2.86Å; Q224-Q228 PolarHBondContact O-NE2 3.19Å; L225-Q228 PolarHBondContact O-N 3.29Å
229	V	87.3	Confident	84.8	Confident	6 Å²	6	60.2 Å²	60.2	4%	0.036	34%	0.344	C	S	.	.	H	α-helix	trans	-74.3	-35.4	174.1	170.9	0	0	0	0	112	L196 V199 L225 M226 D227 A231 I232 V235 L237	L196-V229 HydrophobicContact CD1-CG1 4.39Å; L196-V229 HydrophobicContact CD1-CG2 3.52Å; V199-V229 HydrophobicContact CG1-CG2 4.2Å; L225-V229 HydrophobicContact CD2-CG2 4.16Å; L225-V229 WeakPolarHBondContact O-CB 3.31Å; L225-V229 VanDerWaalsContact O-CG2 3.24Å; L225-V229 WeakPolarHBondContact O-CG2 3.44Å; L225-V229 PolarHBondContact O-N 2.97Å; M226-V229 PolarHBondContact O-N 2.87Å; D227-V229 VanDerWaalsContact C-N 3.26Å; D227-V229 PolarHBondContact O-N 2.8Å; V229-A231 PolarHBondContact O-N 2.87Å; V229-I232 PolarHBondContact O-N 3.3Å; V229-V235 HydrophobicContact CG1-CG1 3.89Å; V229-L237 HydrophobicContact CB-CD1 4.45Å; V229-L237 HydrophobicContact CG1-CB 4.39Å; V229-L237 HydrophobicContact CG1-CD1 3.93Å; V229-L237 HydrophobicContact CG1-CG 3.92Å; V229-L237 HydrophobicContact CG2-CD1 4Å
230	A	82.8	Confident	84.6	Confident	84 Å²	84	58.2 Å²	58.2	69%	0.694	33%	0.333	S	S	*	.	H	α-helix	trans	-62.4	-23.2	175.8	0	0	0	0	0	113	M226 D227 I232	M226-A230 WeakPolarHBondContact O-CB 3.39Å; M226-A230 PolarHBondContact O-N 3.48Å; D227-A230 PolarHBondContact O-N 3.08Å; A230-I232 VanDerWaalsContact C-N 3.29Å; A230-I232 PolarHBondContact O-N 3.04Å
231	A	83.8	Confident	83.6	Confident	79 Å²	79	60.7 Å²	60.7	65%	0.653	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-10.5	172.9	0	0	0	0	0	114.6	D227 V229 P233	D227-A231 PolarHBondContact O-N 3.07Å; V229-A231 PolarHBondContact O-N 2.87Å; A231-P233 WeakPolarHBondContact O-CD 3.47Å
232	I	85.3	Confident	82.2	Confident	15 Å²	15	63.2 Å²	63.2	8%	0.077	37%	0.373	C	S	.	.			trans	-99.4	103.2	-178.2	-57.7	176.4	0	0	0	110.3	E195 V199 V229 A230 S234 V235	E195-I232 HydrophobicContact CB-CD1 4.11Å; V199-I232 HydrophobicContact CG2-CD1 3.9Å; V229-I232 PolarHBondContact O-N 3.3Å; A230-I232 VanDerWaalsContact C-N 3.29Å; A230-I232 PolarHBondContact O-N 3.04Å; I232-S234 WeakPolarHBondContact CG2-OG 3.4Å; I232-S234 PolarHBondContact O-N 2.95Å; I232-S234 VanDerWaalsContact O-N 3.1Å; I232-V235 HydrophobicContact CB-CB 4.29Å; I232-V235 HydrophobicContact CB-CG2 4.39Å; I232-V235 HydrophobicContact CG2-CB 3.95Å; I232-V235 HydrophobicContact CG2-CG2 3.59Å; I232-V235 PolarHBondContact O-N 3Å
233	P	76.6	Confident	80.4	Confident	96 Å²	96	65.8 Å²	65.8	62%	0.623	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-14.4	-169.4	-20.5	34.4	0	0	0	115.5	A170 A231	A170-P233 HydrophobicContact CB-CB 4.25Å; A231-P233 WeakPolarHBondContact O-CD 3.47Å
234	S	83.1	Confident	78.2	Confident	24 Å²	24	65 Å²	65	17%	0.168	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-11.1	-180	56.5	0	0	0	0	113.9	I172 S173 V174 H193 I232	I172-S234 CarbonylContact C-O 3.47Å; S173-S234 PolarHBondContact N-O 3.38Å; V174-S234 PolarHBondContact N-O 2.91Å; V174-S234 VanDerWaalsContact N-O 3.09Å; H193-S234 PolarHBondContact CE1-OG 3.49Å; H193-S234 PolarHBondContact NE2-OG 2.87Å; I232-S234 WeakPolarHBondContact CG2-OG 3.4Å; I232-S234 PolarHBondContact O-N 2.95Å; I232-S234 VanDerWaalsContact O-N 3.1Å
235	V	82.1	Confident	75.7	Confident	14 Å²	14	65.2 Å²	65.2	9%	0.085	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	145.9	-171.8	174.7	0	0	0	0	110.9	V174 H193 L196 V229 I232 L237	V174-V235 HydrophobicContact CB-CG2 4.47Å; V174-V235 WeakPolarHBondContact O-CA 3.43Å; H193-V235 WeakPolarHBondContact ND1-CG2 3.49Å; L196-V235 HydrophobicContact CB-CG2 4.49Å; L196-V235 HydrophobicContact CD1-CG1 4.25Å; L196-V235 HydrophobicContact CD2-CG1 3.96Å; L196-V235 HydrophobicContact CD2-CG2 4.46Å; V229-V235 HydrophobicContact CG1-CG1 3.89Å; I232-V235 HydrophobicContact CB-CB 4.29Å; I232-V235 HydrophobicContact CB-CG2 4.39Å; I232-V235 HydrophobicContact CG2-CB 3.95Å; I232-V235 HydrophobicContact CG2-CG2 3.59Å; I232-V235 PolarHBondContact O-N 3Å; V235-L237 HydrophobicContact CG1-CG 4.37Å
236	S	84.4	Confident	73	Confident	52 Å²	52	73.7 Å²	73.7	36%	0.364	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	111.5	167.4	-177.4	0	0	0	0	110.7	V174 R175 G176	V174-S236 PolarHBondContact O-N 2.99Å; R175-S236 CarbonylContact C-O 3.57Å; R175-S236 VanDerWaalsContact CA-O 3.28Å; R175-S236 WeakPolarHBondContact CA-O 3.42Å; G176-S236 PolarHBondContact N-O 2.98Å
237	L	83.9	Confident	70.1	Confident	13 Å²	13	78.9 Å²	78.9	7%	0.068	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.5	169.7	-64.2	-176.3	0	0	0	110.2	G176 V188 V190 L225 V229 V235	G176-L237 WeakPolarHBondContact O-CA 3.15Å; V188-L237 HydrophobicContact CG1-CD1 3.72Å; V188-L237 HydrophobicContact CG1-CD2 3.7Å; V188-L237 HydrophobicContact CG1-CG 4.37Å; V190-L237 HydrophobicContact CB-CD2 4.09Å; V190-L237 HydrophobicContact CG2-CD2 3.95Å; L225-L237 HydrophobicContact CD2-CD1 4.2Å; V229-L237 HydrophobicContact CB-CD1 4.45Å; V229-L237 HydrophobicContact CG1-CB 4.39Å; V229-L237 HydrophobicContact CG1-CD1 3.93Å; V229-L237 HydrophobicContact CG1-CG 3.92Å; V229-L237 HydrophobicContact CG2-CD1 4Å; V235-L237 HydrophobicContact CG1-CG 4.37Å
238	R	83.7	Confident	67.9	Low	173 Å²	173	79.1 Å²	79.1	65%	0.653	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	133.3	164.4	-70.3	-171.3	173.3	-164.3	-1.2	110.5	G176 K177 C178	G176-R238 PolarHBondContact O-N 1.95Å; K177-R238 HydrophobicContact CB-CB 4.04Å; C178-R238 PolarHBondContact N-O 3.16Å
239	P	83.1	Confident	65	Low	76 Å²	76	80.2 Å²	80.2	49%	0.494	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-50.4	160.9	166.5	-30.8	38	0	0	0	113.9	Y222 M226	Y222-P239 WeakPolarHBondContact OH-CA 3.47Å; Y222-P239 VanDerWaalsContact OH-CB 3.25Å; Y222-P239 WeakPolarHBondContact OH-CB 3.32Å; M226-P239 HydrophobicContact CE-CG 4.09Å
240	L	81.4	Confident	62.3	Low	14 Å²	14	85.8 Å²	85.8	7%	0.073	55%	0.546	C	S	.	.	P	Polyproline II helix	trans	-64.1	138.2	163.5	-87.3	94.6	0	0	0	110.7	C178 P180 F186 L219 Y222 G242 I243	C178-L240 HydrophobicContact CB-CD1 3.47Å; C178-L240 VanDerWaalsContact CB-CD1 3.47Å; C178-L240 HydrophobicContact CB-CG 4.15Å; P180-L240 HydrophobicContact CG-CD2 4.2Å; F186-L240 HydrophobicContact CB-CD1 3.76Å; F186-L240 HydrophobicContact CB-CD2 3.89Å; F186-L240 HydrophobicContact CB-CG 4.33Å; F186-L240 HydrophobicContact CD1-CD1 4.36Å; F186-L240 HydrophobicContact CD2-CD1 3.84Å; F186-L240 HydrophobicContact CE2-CD1 4.49Å; F186-L240 HydrophobicContact CG-CD1 3.75Å; L219-L240 HydrophobicContact CD2-CD2 4.19Å; Y222-L240 HydrophobicContact CD2-CD1 3.69Å; Y222-L240 HydrophobicContact CE2-CD1 3.39Å; Y222-L240 PolarHBondContact OH-N 2.81Å; L240-G242 PolarHBondContact O-N 3.02Å; L240-I243 HydrophobicContact CB-CD1 4.39Å; L240-I243 HydrophobicContact CD2-CD1 4.43Å
241	E	64.6	Low	59.6	Low	181 Å²	181	87 Å²	87	85%	0.846	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	116	167.4	-66.7	175.1	-179.8	0	0	108.8
242	G	57.9	Low	57.2	Low	79 Å²	79	94 Å²	94	81%	0.814	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	127.7	-32.5	177.7	0	0	0	0	0	114.9	L240 A244	L240-G242 PolarHBondContact O-N 3.02Å; G242-A244 PolarHBondContact O-N 2.95Å
243	I	48.8	Very low	54.7	Low	79 Å²	79	99.2 Å²	99.2	41%	0.405	59%	0.594	S	S	.	*			trans	-88.8	93.4	-178.1	-57.1	177.5	0	0	0	109.6	L219 Y222 L240 A245	L219-I243 HydrophobicContact CD2-CD1 3.85Å; Y222-I243 HydrophobicContact CD1-CD1 4.35Å; Y222-I243 HydrophobicContact CD1-CG2 4.46Å; Y222-I243 HydrophobicContact CE1-CB 4.46Å; Y222-I243 HydrophobicContact CE1-CD1 4.48Å; Y222-I243 HydrophobicContact CE1-CG2 4.24Å; L240-I243 HydrophobicContact CB-CD1 4.39Å; L240-I243 HydrophobicContact CD2-CD1 4.43Å; I243-A245 PolarHBondContact O-N 2.96Å
244	A	38.1	Very low	53.1	Low	76 Å²	76	97.7 Å²	97.7	63%	0.628	59%	0.585	S	S	*	*			trans	-80.5	110.4	173.2	0	0	0	0	0	110.2	G242 L246	G242-A244 PolarHBondContact O-N 2.95Å; A244-L246 PolarHBondContact O-N 3.2Å
245	A	33.8	Very low	51.8	Low	94 Å²	94	101.8 Å²	101.8	78%	0.777	61%	0.605	S	S	*	*			trans	-62.4	123	171.9	0	0	0	0	0	110.4	I243 D247	I243-A245 PolarHBondContact O-N 2.96Å; A245-D247 PolarHBondContact O-N 3.36Å
246	L	33.3	Very low	51.2	Low	177 Å²	177	103.7 Å²	103.7	93%	0.927	63%	0.628	S	S	*	*			trans	-74.5	97.2	160.5	-85	81.6	0	0	0	107.7	A244	A244-L246 PolarHBondContact O-N 3.2Å
247	D	27.8	Very low	50.9	Low	148 Å²	148	105.1 Å²	105.1	79%	0.791	64%	0.643	S	S	*	*			trans	-150.3	145.1	158.1	-136.6	-26.8	0	0	0	111.5	A245 A249	A245-D247 PolarHBondContact O-N 3.36Å; D247-A249 VanDerWaalsContact C-N 3.35Å; D247-A249 PolarHBondContact O-N 2.92Å
248	S	37.5	Very low	50.8	Low	123 Å²	123	106.1 Å²	106.1	86%	0.86	65%	0.653	S	S	*	*			trans	-84.4	71.6	-165.5	61.4	0	0	0	0	113.1
249	A	25.5	Very low	51	Low	82 Å²	82	100 Å²	100	68%	0.678	63%	0.633	S	S	*	*			trans	-91.5	150.2	166.4	0	0	0	0	0	111.2	D247	D247-A249 VanDerWaalsContact C-N 3.35Å; D247-A249 PolarHBondContact O-N 2.92Å
250	P	30.6	Very low	51.2	Low	122 Å²	122	98.6 Å²	98.6	79%	0.792	63%	0.628	S	S	*	*			trans	-60.8	147.8	178.8	26.3	-35	0	0	0	111.5	R252	P250-R252 PolarHBondContact O-N 2.71Å
251	S	26.9	Very low	51.5	Low	110 Å²	110	99.6 Å²	99.6	77%	0.769	64%	0.638	S	S	*	*			trans	-30.9	123.7	-178.3	57.2	0	0	0	0	113.7	P253	S251-P253 VanDerWaalsContact O-N 3.17Å
252	R	32	Very low	52.7	Low	227 Å²	227	91.4 Å²	91.4	86%	0.857	60%	0.6	S	S	*	*			trans	-41.3	124.3	174.2	-71.7	-177.5	178.6	176.8	-0	109.2	P250 C254	P250-R252 PolarHBondContact O-N 2.71Å; R252-C254 PolarHBondContact O-N 2.93Å
253	P	33.9	Very low	54.2	Low	123 Å²	123	88.7 Å²	88.7	80%	0.799	57%	0.566	S	S	*	*			trans	-62.4	112.1	-178.5	24.5	-32.8	0	0	0	108.7	S251 D255	S251-P253 VanDerWaalsContact O-N 3.17Å; P253-D255 PolarHBondContact O-N 2.89Å
254	C	43	Very low	56.2	Low	65 Å²	65	92.1 Å²	92.1	44%	0.439	58%	0.579	S	S	.	*			trans	-48.9	127.4	178.5	-179.3	0	0	0	0	109.4	R252 G256	R252-C254 PolarHBondContact O-N 2.93Å; C254-G256 PolarHBondContact O-N 2.83Å
255	D	55.4	Low	58.5	Low	109 Å²	109	90 Å²	90	58%	0.583	56%	0.556	S	S	*	*			trans	-43	99.1	-160.4	-87.2	-68.6	0	0	0	113.2	P253 A257 A258 L259	P253-D255 PolarHBondContact O-N 2.89Å; D255-A257 PolarHBondContact O-N 3.32Å; D255-A258 HydrophobicContact CB-CB 3.75Å; D255-A258 WeakPolarHBondContact O-CA 3.16Å; D255-A258 WeakPolarHBondContact O-CB 3.35Å; D255-A258 PolarHBondContact O-N 2.87Å; D255-L259 PolarHBondContact O-N 3.38Å
256	G	69.3	Low	61	Low	55 Å²	55	86.6 Å²	86.6	57%	0.567	53%	0.527	S	S	*	.	H	α-helix	trans	-59.9	-28.4	-172.7	0	0	0	0	0	112.2	C254 A260	C254-G256 PolarHBondContact O-N 2.83Å; G256-A260 WeakPolarHBondContact O-CB 3.4Å; G256-A260 PolarHBondContact O-N 3.06Å
257	A	79.2	Confident	63.5	Low	82 Å²	82	83.3 Å²	83.3	68%	0.678	51%	0.51	S	S	*	.	H	α-helix	trans	-71.3	-38.6	172.8	0	0	0	0	0	113.3	D255 A261	D255-A257 PolarHBondContact O-N 3.32Å; A257-A261 WeakPolarHBondContact O-CB 3.39Å; A257-A261 PolarHBondContact O-N 2.92Å
258	A	82	Confident	65.9	Low	34 Å²	34	80 Å²	80	28%	0.281	51%	0.511	S	S	.	.	H	α-helix	trans	-69.8	-48.6	177.3	0	0	0	0	0	110.8	D255 A260 A261 L262	D255-A258 HydrophobicContact CB-CB 3.75Å; D255-A258 WeakPolarHBondContact O-CA 3.16Å; D255-A258 WeakPolarHBondContact O-CB 3.35Å; D255-A258 PolarHBondContact O-N 2.87Å; A258-A260 VanDerWaalsContact C-N 3.34Å; A258-A260 PolarHBondContact O-N 3.47Å; A258-A261 WeakPolarHBondContact O-CB 3.44Å; A258-A261 PolarHBondContact O-N 3.2Å; A258-A261 VanDerWaalsContact O-N 3.09Å; A258-L262 PolarHBondContact O-N 2.97Å
259	L	86.1	Confident	68	Low	43 Å²	43	77.3 Å²	77.3	23%	0.225	48%	0.482	C	S	.	.	H	α-helix	trans	-62.3	-40.5	174.6	-178.6	57.8	0	0	0	111.3	D255 A261 L262 L263 I347 A351	D255-L259 PolarHBondContact O-N 3.38Å; L259-A261 VanDerWaalsContact C-N 3.3Å; L259-A261 PolarHBondContact O-N 3.5Å; L259-L262 PolarHBondContact O-N 3.36Å; L259-L263 HydrophobicContact CD1-CD1 3.98Å; L259-L263 HydrophobicContact CD1-CG 4.06Å; L259-L263 HydrophobicContact CG-CD1 3.8Å; L259-L263 HydrophobicContact CG-CG 4.33Å; L259-L263 VanDerWaalsContact O-CB 3.32Å; L259-L263 WeakPolarHBondContact O-CB 3.42Å; L259-L263 WeakPolarHBondContact O-CG 3.44Å; L259-L263 PolarHBondContact O-N 2.81Å; L259-I347 HydrophobicContact CD1-CG2 3.88Å; L259-A351 HydrophobicContact CD1-CB 4.06Å; L259-A351 HydrophobicContact CD2-CB 4.37Å
260	A	87.6	Confident	70.8	Confident	48 Å²	48	79.6 Å²	79.6	40%	0.397	48%	0.478	S	S	.	.	H	α-helix	trans	-64.8	-30.6	173.8	0	0	0	0	0	113.3	G256 A258 K264	G256-A260 WeakPolarHBondContact O-CB 3.4Å; G256-A260 PolarHBondContact O-N 3.06Å; A258-A260 VanDerWaalsContact C-N 3.34Å; A258-A260 PolarHBondContact O-N 3.47Å; A260-K264 WeakPolarHBondContact O-CG 3.49Å; A260-K264 PolarHBondContact O-N 3.19Å
261	A	87.9	Confident	73.3	Confident	34 Å²	34	76.2 Å²	76.2	28%	0.281	45%	0.451	S	S	.	.	H	α-helix	trans	-68.9	-45.8	173.3	0	0	0	0	0	111.5	A257 A258 L259 L263 K264	A257-A261 WeakPolarHBondContact O-CB 3.39Å; A257-A261 PolarHBondContact O-N 2.92Å; A258-A261 WeakPolarHBondContact O-CB 3.44Å; A258-A261 PolarHBondContact O-N 3.2Å; A258-A261 VanDerWaalsContact O-N 3.09Å; L259-A261 VanDerWaalsContact C-N 3.3Å; L259-A261 PolarHBondContact O-N 3.5Å; A261-L263 VanDerWaalsContact C-N 3.32Å; A261-L263 PolarHBondContact O-N 3.36Å; A261-K264 WeakPolarHBondContact O-CB 3.33Å; A261-K264 PolarHBondContact O-N 2.76Å; A261-K264 VanDerWaalsContact O-N 3.15Å
262	L	89.8	Confident	75.6	Confident	10 Å²	10	77.3 Å²	77.3	5%	0.052	46%	0.456	C	S	.	.	H	α-helix	trans	-59.7	-43.2	173.7	-64.7	172.2	0	0	0	111.6	A258 L259 K264 L265 Y324 K325 I347 F354	A258-L262 PolarHBondContact O-N 2.97Å; L259-L262 PolarHBondContact O-N 3.36Å; L262-K264 PolarHBondContact O-N 2.68Å; L262-L265 HydrophobicContact CD2-CD1 4.43Å; L262-L265 WeakPolarHBondContact O-CB 3.3Å; L262-L265 PolarHBondContact O-N 2.84Å; L262-L265 VanDerWaalsContact O-N 3.09Å; L262-Y324 HydrophobicContact CD2-CD1 3.95Å; L262-Y324 HydrophobicContact CD2-CE1 4.3Å; L262-K325 HydrophobicContact CD2-CB 3.91Å; L262-K325 HydrophobicContact CD2-CG 4.23Å; L262-I347 HydrophobicContact CB-CG2 3.64Å; L262-I347 HydrophobicContact CD1-CG2 4.3Å; L262-F354 HydrophobicContact CD1-CB 3.67Å; L262-F354 HydrophobicContact CD1-CD1 3.91Å; L262-F354 HydrophobicContact CD1-CD2 4.02Å; L262-F354 HydrophobicContact CD1-CG 3.59Å; L262-F354 HydrophobicContact CD2-CD1 4.19Å
263	L	90.1	Very high	77.7	Confident	21 Å²	21	70.4 Å²	70.4	11%	0.11	46%	0.455	C	S	.	.	H	α-helix	trans	-72.3	-5.1	178.5	-67.4	173.1	0	0	0	114.5	L259 A261 R344 I347 Q348	L259-L263 HydrophobicContact CD1-CD1 3.98Å; L259-L263 HydrophobicContact CD1-CG 4.06Å; L259-L263 HydrophobicContact CG-CD1 3.8Å; L259-L263 HydrophobicContact CG-CG 4.33Å; L259-L263 VanDerWaalsContact O-CB 3.32Å; L259-L263 WeakPolarHBondContact O-CB 3.42Å; L259-L263 WeakPolarHBondContact O-CG 3.44Å; L259-L263 PolarHBondContact O-N 2.81Å; A261-L263 VanDerWaalsContact C-N 3.32Å; A261-L263 PolarHBondContact O-N 3.36Å; L263-R344 HydrophobicContact CD2-CG 3.55Å; L263-R344 PolarHBondContact O-NH1 2.86Å; L263-R344 PolarHBondContact O-NH2 3.01Å; L263-I347 HydrophobicContact CD2-CB 4.19Å; L263-I347 HydrophobicContact CD2-CG2 3.79Å; L263-I347 HydrophobicContact CG-CG2 4.11Å; L263-Q348 HydrophobicContact CD1-CG 4.38Å; L263-Q348 HydrophobicContact CD2-CG 4.04Å
264	K	89.6	Confident	80	Confident	152 Å²	152	65.4 Å²	65.4	66%	0.661	43%	0.425	S	S	*	.	H	α-helix	trans	-82.1	-32.5	166.1	-77.9	171.2	-179.5	-176.6	0	112	A260 A261 L262 C266 N267	A260-K264 WeakPolarHBondContact O-CG 3.49Å; A260-K264 PolarHBondContact O-N 3.19Å; A261-K264 WeakPolarHBondContact O-CB 3.33Å; A261-K264 PolarHBondContact O-N 2.76Å; A261-K264 VanDerWaalsContact O-N 3.15Å; L262-K264 PolarHBondContact O-N 2.68Å; K264-C266 PolarHBondContact O-N 3.09Å; K264-N267 WeakPolarHBondContact O-CB 3.38Å; K264-N267 PolarHBondContact O-N 2.92Å
265	L	87.9	Confident	82.1	Confident	31 Å²	31	66.8 Å²	66.8	16%	0.162	44%	0.435	C	S	.	.	H	α-helix	trans	-60.1	-27.4	178.7	-59.9	172.6	0	0	0	112.3	L262 N267 Y324 K325 M328 P341	L262-L265 HydrophobicContact CD2-CD1 4.43Å; L262-L265 WeakPolarHBondContact O-CB 3.3Å; L262-L265 PolarHBondContact O-N 2.84Å; L262-L265 VanDerWaalsContact O-N 3.09Å; L265-N267 PolarHBondContact O-N 3.46Å; L265-N267 VanDerWaalsContact O-N 3.13Å; L265-Y324 HydrophobicContact CD1-CD1 4.42Å; L265-Y324 HydrophobicContact CD1-CE1 3.81Å; L265-K325 HydrophobicContact CD1-CG 4.21Å; L265-M328 HydrophobicContact CD1-CB 3.94Å; L265-M328 HydrophobicContact CD1-CG 4.27Å; L265-M328 HydrophobicContact CD2-CB 4.23Å; L265-P341 WeakPolarHBondContact O-CG 3.44Å
266	C	86.5	Confident	83.7	Confident	22 Å²	22	62.4 Å²	62.4	15%	0.149	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-13.6	172.3	-54.1	0	0	0	0	114.7	K264	K264-C266 PolarHBondContact O-N 3.09Å
267	N	85.4	Confident	84.7	Confident	109 Å²	109	66 Å²	66	58%	0.583	41%	0.414	S	S	*	.	S	Bend	trans	-118.4	135.9	-172.1	-58	-8	0	0	0	110	K264 L265 W269	K264-N267 WeakPolarHBondContact O-CB 3.38Å; K264-N267 PolarHBondContact O-N 2.92Å; L265-N267 PolarHBondContact O-N 3.46Å; L265-N267 VanDerWaalsContact O-N 3.13Å; N267-W269 PolarHBondContact O-N 3.36Å
268	G	77.3	Confident	85.3	Confident	78 Å²	78	62.9 Å²	62.9	80%	0.804	39%	0.39	S	S	*	.	S	Bend	trans	70.4	14.9	173.6	0	0	0	0	0	115.3	Q270	G268-Q270 PolarHBondContact O-N 3.42Å
269	W	82	Confident	85.9	Confident	66 Å²	66	63.7 Å²	63.7	25%	0.25	39%	0.388	C	S	.	.			trans	-70.1	-20.9	171.5	62.3	-94.1	0	0	0	113.1	N267 E338 E340 P341	N267-W269 PolarHBondContact O-N 3.36Å; W269-E338 HydrophobicContact CE3-CG 3.96Å; W269-E338 HydrophobicContact CZ3-CG 3.93Å; W269-E340 HydrophobicContact CH2-CB 3.85Å; W269-E340 HydrophobicContact CH2-CG 3.88Å; W269-E340 HydrophobicContact CZ2-CB 4.26Å; W269-E340 HydrophobicContact CZ2-CG 3.83Å; W269-E340 HydrophobicContact CZ3-CB 4Å; W269-E340 HydrophobicContact CZ3-CG 4.48Å; W269-P341 HydrophobicContact CB-CG 4.42Å; W269-P341 VanDerWaalsContact CD1-CD 3.46Å; W269-P341 HydrophobicContact CD2-CG 4.46Å; W269-P341 HydrophobicContact CG-CG 3.94Å
270	Q	84.9	Confident	86.4	Confident	130 Å²	130	61.6 Å²	61.6	61%	0.607	38%	0.377	S	S	*	.			trans	-71.2	131.1	-174.4	-65.3	179.6	-48.7	0	0	111.6	G268 E338	G268-Q270 PolarHBondContact O-N 3.42Å; Q270-E338 WeakPolarHBondContact CA-OE1 3.37Å
271	K	83.5	Confident	86.7	Confident	51 Å²	51	60.1 Å²	60.1	22%	0.222	36%	0.362	C	S	.	.			trans	-130.4	84.3	-176	-68.5	176.5	-175.3	173.3	0	110.6	G273 A274 S332 M334 V337 E338	K271-G273 PolarHBondContact O-N 3.2Å; K271-A274 HydrophobicContact CB-CB 4.18Å; K271-A274 WeakPolarHBondContact O-CB 3.4Å; K271-A274 PolarHBondContact O-N 3.23Å; K271-S332 PolarHBondContact NZ-O 2.81Å; K271-M334 PolarHBondContact NZ-O 2.76Å; K271-V337 WeakPolarHBondContact CD-O 3.29Å; K271-V337 PolarHBondContact NZ-O 2.55Å; K271-E338 HydrophobicContact CB-CB 4.28Å; K271-E338 HydrophobicContact CB-CG 4.48Å; K271-E338 PolarHBondContact N-OE1 2.85Å
272	P	74.4	Confident	87.1	Confident	133 Å²	133	58.5 Å²	58.5	86%	0.864	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	114.5	178.9	-25.2	34.9	0	0	0	111.7
273	G	76.3	Confident	87.3	Confident	82 Å²	82	61.3 Å²	61.3	85%	0.845	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.5	8.5	-176.4	0	0	0	0	0	115.9	K271	K271-G273 PolarHBondContact O-N 3.2Å
274	A	83	Confident	87.4	Confident	19 Å²	19	62 Å²	62	16%	0.157	37%	0.373	C	S	.	.			trans	-56.7	139.5	167.1	0	0	0	0	0	111.4	K271 G336 E338	K271-A274 HydrophobicContact CB-CB 4.18Å; K271-A274 WeakPolarHBondContact O-CB 3.4Å; K271-A274 PolarHBondContact O-N 3.23Å; A274-G336 CarbonylContact C-O 3.6Å; A274-E338 HydrophobicContact CB-CB 3.59Å
275	S	86.1	Confident	87.4	Confident	94 Å²	94	59.6 Å²	59.6	66%	0.657	36%	0.36	S	S	*	.	S	Bend	trans	-81.7	-21.6	179.5	55.5	0	0	0	0	113	G336	S275-G336 PolarHBondContact N-O 2.92Å; S275-G336 PolarHBondContact OG-O 2.82Å
276	V	88.8	Confident	87.6	Confident	17 Å²	17	60.9 Å²	60.9	10%	0.103	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	126.8	175.3	-174	0	0	0	0	110.1	I292 P293 H295 G336 E338	V276-I292 HydrophobicContact CG1-CD1 3.85Å; V276-I292 HydrophobicContact CG1-CG1 3.61Å; V276-P293 HydrophobicContact CG1-CB 4.18Å; V276-P293 HydrophobicContact CG1-CG 4.27Å; V276-H295 HydrophobicContact CG1-CB 4.48Å; V276-H295 HydrophobicContact CG2-CB 4.14Å; V276-G336 PolarHBondContact N-O 3.28Å; V276-E338 PolarHBondContact O-N 3.31Å
277	Q	91.4	Very high	87.9	Confident	130 Å²	130	63.9 Å²	63.9	61%	0.607	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	141.8	175.5	-65	-176.2	-37.9	0	0	110.2	P293 E338	Q277-P293 WeakPolarHBondContact O-CD 3.39Å; Q277-E338 CarbonylContact C-O 3.42Å; Q277-E338 VanDerWaalsContact CA-O 3.32Å; Q277-E338 WeakPolarHBondContact CA-O 3.17Å; Q277-E338 HydrophobicContact CG-CB 4.25Å; Q277-E338 WeakPolarHBondContact CG-OE2 3.42Å; Q277-E338 PolarHBondContact NE2-OE2 3.07Å
278	G	91.3	Very high	88.4	Confident	16 Å²	16	58.7 Å²	58.7	17%	0.165	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	-177.2	174	0	0	0	0	0	112.8	D291 E338 V339 E340	G278-D291 CarbonylContact C-O 3.54Å; G278-D291 WeakPolarHBondContact CA-O 3.32Å; G278-E338 PolarHBondContact N-O 3.4Å; G278-V339 CarbonylContact O-C 3.58Å; G278-V339 WeakPolarHBondContact O-CA 3.47Å; G278-E340 PolarHBondContact O-N 2.98Å
279	Q	93.8	Very high	89.3	Confident	51 Å²	51	56.2 Å²	56.2	24%	0.238	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	144	179.6	57	173.9	-22.4	0	0	112.4	I281 V290 D291 E340	Q279-I281 HydrophobicContact CG-CD1 4.1Å; Q279-I281 HydrophobicContact CG-CG1 4.01Å; Q279-V290 WeakPolarHBondContact O-CA 3.19Å; Q279-D291 HydrophobicContact CG-CB 4.03Å; Q279-D291 PolarHBondContact N-O 3.41Å; Q279-D291 PolarHBondContact O-N 3.05Å; Q279-E340 HydrophobicContact CB-CB 3.92Å
280	C	95.9	Very high	89.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	134.5	165.3	-67.5	0	0	0	0	109.9	F288 E289 Y324 M328 E340 L342 R556	C280-F288 HydrophobicContact CB-CD2 4.14Å; C280-E289 CarbonylContact C-O 3.54Å; C280-E289 VanDerWaalsContact CA-O 3.29Å; C280-E289 WeakPolarHBondContact CA-O 3.45Å; C280-Y324 HydrophobicContact CB-CE2 4.33Å; C280-M328 VanDerWaalsContact SG-SD 3.6Å; C280-E340 WeakPolarHBondContact CB-O 3.5Å; C280-E340 PolarHBondContact N-O 2.77Å; C280-L342 HydrophobicContact CB-CD2 3.88Å; C280-L342 HydrophobicContact CB-CG 3.88Å; C280-R556 PolarHBondContact O-NH1 2.81Å; C280-R556 PolarHBondContact O-NH2 3.07Å
281	I	95.8	Very high	90.2	Very high	16 Å²	16	49.7 Å²	49.7	8%	0.082	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	133	179.9	-50.8	168.9	0	0	0	109.7	Q279 V283 F288 E289 D291 N577 E580	Q279-I281 HydrophobicContact CG-CD1 4.1Å; Q279-I281 HydrophobicContact CG-CG1 4.01Å; I281-V283 PolarHBondContact O-N 2.96Å; I281-F288 CarbonylContact O-C 3.52Å; I281-F288 VanDerWaalsContact O-CA 3.27Å; I281-F288 WeakPolarHBondContact O-CA 3.42Å; I281-F288 WeakPolarHBondContact O-CB 3.46Å; I281-E289 PolarHBondContact N-O 2.97Å; I281-E289 PolarHBondContact O-N 2.67Å; I281-D291 HydrophobicContact CD1-CB 3.91Å; I281-N577 WeakPolarHBondContact CD1-OD1 3.36Å; I281-E580 HydrophobicContact CG2-CB 4.22Å
282	L	95.6	Very high	90.5	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	123.2	173.9	-167.8	77.3	0	0	0	111.1	S284 L321 L342 V346 F350 E580 L583	L282-S284 VanDerWaalsContact CD1-O 3.29Å; L282-S284 WeakPolarHBondContact CD1-O 3.32Å; L282-S284 WeakPolarHBondContact CG-O 3.33Å; L282-L321 HydrophobicContact CD1-CD1 4.04Å; L282-L321 HydrophobicContact CD1-CD2 3.91Å; L282-L321 HydrophobicContact CD1-CG 4.44Å; L282-L342 HydrophobicContact CB-CD2 4.48Å; L282-V346 HydrophobicContact CB-CG1 4.2Å; L282-V346 HydrophobicContact CD1-CG1 4.18Å; L282-V346 HydrophobicContact CD2-CG1 4.13Å; L282-V346 HydrophobicContact CG-CG1 4.41Å; L282-F350 HydrophobicContact CD2-CD2 3.7Å; L282-F350 HydrophobicContact CD2-CE2 3.34Å; L282-F350 HydrophobicContact CD2-CG 4.45Å; L282-F350 HydrophobicContact CD2-CZ 3.85Å; L282-E580 HydrophobicContact CB-CB 4.11Å; L282-E580 HydrophobicContact CB-CG 3.85Å; L282-E580 PolarHBondContact N-OE2 2.85Å; L282-L583 HydrophobicContact CD2-CB 3.92Å; L282-L583 HydrophobicContact CD2-CD1 3.88Å; L282-L583 HydrophobicContact CG-CD1 4.06Å
283	V	93.3	Very high	91.3	Very high	68 Å²	68	46.1 Å²	46.1	41%	0.412	27%	0.274	S	S	.	.			trans	-111.9	-17.5	179.4	-64.2	0	0	0	0	113.5	I281 K287 E289	I281-V283 PolarHBondContact O-N 2.96Å; V283-K287 HydrophobicContact CG2-CB 4.12Å; V283-K287 WeakPolarHBondContact CG2-O 3.49Å; V283-K287 PolarHBondContact N-O 3.17Å; V283-E289 HydrophobicContact CG1-CB 3.69Å; V283-E289 HydrophobicContact CG2-CB 4.46Å
284	S	92.3	Very high	91.9	Very high	37 Å²	37	51.2 Å²	51.2	26%	0.259	27%	0.269	S	S	.	.	S	Bend	trans	-156.1	172.8	169.2	80.9	0	0	0	0	111.5	L282 T286 K287	L282-S284 VanDerWaalsContact CD1-O 3.29Å; L282-S284 WeakPolarHBondContact CD1-O 3.32Å; L282-S284 WeakPolarHBondContact CG-O 3.33Å; S284-T286 PolarHBondContact O-N 3.12Å; S284-T286 PolarHBondContact OG-N 3.35Å; S284-K287 PolarHBondContact N-O 3.49Å; S284-K287 PolarHBondContact O-N 2.65Å; S284-K287 VanDerWaalsContact O-O 3.12Å; S284-K287 WeakPolarHBondContact OG-CB 3.41Å; S284-K287 PolarHBondContact OG-N 2.92Å
285	R	90.8	Very high	92.3	Very high	100 Å²	100	52.6 Å²	52.6	38%	0.377	27%	0.272	S	S	.	.	S	Bend	trans	-58.2	-14.3	177.7	-63.3	175.5	168.4	-91	-11.5	114.6	F350 S353 L583 E586 E587	R285-F350 HydrophobicContact CB-CE1 4.33Å; R285-F350 HydrophobicContact CG-CE1 4.13Å; R285-S353 WeakPolarHBondContact O-CB 3.47Å; R285-S353 PolarHBondContact O-OG 3.45Å; R285-L583 HydrophobicContact CG-CD2 4.05Å; R285-E586 IonicContact CZ-OE2 3.71Å; R285-E586 IonicContact NH2-OE2 3.03Å; R285-E586 PolarHBondContact NH2-OE2 2.82Å; R285-E587 IonicContact CZ-OE2 3.19Å; R285-E587 IonicContact NH1-OE2 2.73Å; R285-E587 PolarHBondContact NH1-OE2 2.94Å
286	T	90.8	Very high	92.5	Very high	58 Å²	58	50.9 Å²	50.9	36%	0.356	26%	0.263	S	S	.	.	S	Bend	trans	-129.9	-6.2	-179.7	55.6	0	0	0	0	114.3	S284 S320 L321	S284-T286 PolarHBondContact O-N 3.12Å; S284-T286 PolarHBondContact OG-N 3.35Å; T286-S320 WeakPolarHBondContact O-CA 3.47Å; T286-S320 PolarHBondContact O-OG 3.46Å; T286-L321 PolarHBondContact O-N 2.71Å
287	K	93.7	Very high	92.6	Very high	86 Å²	86	54.7 Å²	54.7	37%	0.374	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	144.5	-176.6	-61.7	-171.3	179.8	-173.7	0	113.5	V283 S284 F319	V283-K287 HydrophobicContact CG2-CB 4.12Å; V283-K287 WeakPolarHBondContact CG2-O 3.49Å; V283-K287 PolarHBondContact N-O 3.17Å; S284-K287 PolarHBondContact N-O 3.49Å; S284-K287 PolarHBondContact O-N 2.65Å; S284-K287 VanDerWaalsContact O-O 3.12Å; S284-K287 WeakPolarHBondContact OG-CB 3.41Å; S284-K287 PolarHBondContact OG-N 2.92Å; K287-F319 WeakPolarHBondContact CA-O 3.39Å; K287-F319 WeakPolarHBondContact CB-O 3.08Å
288	F	95.8	Very high	92.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	162.9	168.6	75.2	-76.3	0	0	0	110.5	C280 I281 V290 S318 F319 S320 L321 Y324 L327 L342	C280-F288 HydrophobicContact CB-CD2 4.14Å; I281-F288 CarbonylContact O-C 3.52Å; I281-F288 VanDerWaalsContact O-CA 3.27Å; I281-F288 WeakPolarHBondContact O-CA 3.42Å; I281-F288 WeakPolarHBondContact O-CB 3.46Å; F288-V290 HydrophobicContact CD2-CG2 4.2Å; F288-V290 HydrophobicContact CE2-CG2 3.68Å; F288-S318 CarbonylContact O-C 3.47Å; F288-S318 WeakPolarHBondContact O-CA 3.41Å; F288-S318 WeakPolarHBondContact O-CB 3.18Å; F288-F319 HydrophobicContact CD1-CB 4.32Å; F288-F319 HydrophobicContact CE1-CB 3.68Å; F288-F319 HydrophobicContact CE2-CD2 4.15Å; F288-F319 HydrophobicContact CZ-CB 3.89Å; F288-F319 HydrophobicContact CZ-CD2 4.02Å; F288-F319 HydrophobicContact CZ-CG 4.28Å; F288-F319 PolarHBondContact N-O 3.32Å; F288-F319 PolarHBondContact O-N 3.46Å; F288-S320 WeakPolarHBondContact CE1-O 3.29Å; F288-L321 HydrophobicContact CB-CD2 4.1Å; F288-L321 HydrophobicContact CD1-CD2 3.94Å; F288-L321 HydrophobicContact CG-CD2 4.39Å; F288-Y324 HydrophobicContact CD1-CD2 4.24Å; F288-Y324 HydrophobicContact CD2-CD2 4.14Å; F288-Y324 AromaticContact CE1-CD2 3.89Å; F288-Y324 HydrophobicContact CE1-CD2 3.89Å; F288-Y324 HydrophobicContact CE1-CG 4.25Å; F288-Y324 AromaticContact CE2-CD2 3.78Å; F288-Y324 HydrophobicContact CE2-CD2 3.78Å; F288-Y324 HydrophobicContact CE2-CE2 4.45Å; F288-Y324 HydrophobicContact CG-CD2 4.36Å; F288-Y324 AromaticContact CZ-CD2 3.66Å; F288-Y324 HydrophobicContact CZ-CD2 3.66Å; F288-Y324 HydrophobicContact CZ-CG 4.34Å; F288-L327 HydrophobicContact CE2-CD2 3.98Å; F288-L327 HydrophobicContact CZ-CD2 3.77Å; F288-L342 HydrophobicContact CB-CD1 4.09Å; F288-L342 HydrophobicContact CB-CD2 4.18Å; F288-L342 HydrophobicContact CG-CD1 4.29Å
289	E	95.3	Very high	92.8	Very high	26 Å²	26	48.8 Å²	48.8	12%	0.121	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	152	174.9	-168.6	-166	99.3	0	0	109.2	C280 I281 V283 K316 W317	C280-E289 CarbonylContact C-O 3.54Å; C280-E289 VanDerWaalsContact CA-O 3.29Å; C280-E289 WeakPolarHBondContact CA-O 3.45Å; I281-E289 PolarHBondContact N-O 2.97Å; I281-E289 PolarHBondContact O-N 2.67Å; V283-E289 HydrophobicContact CG1-CB 3.69Å; V283-E289 HydrophobicContact CG2-CB 4.46Å; E289-K316 VanDerWaalsContact CD-CB 3.46Å; E289-K316 HydrophobicContact CG-CB 3.85Å; E289-K316 HydrophobicContact CG-CG 4.36Å; E289-K316 VanDerWaalsContact OE1-CD 3.27Å; E289-K316 WeakPolarHBondContact OE1-CD 3.42Å; E289-K316 WeakPolarHBondContact OE1-CE 3.4Å; E289-K316 WeakPolarHBondContact OE1-CG 3.5Å; E289-K316 IonicContact OE1-NZ 3.86Å; E289-K316 PolarHBondContact OE1-NZ 3.18Å; E289-W317 CarbonylContact C-O 3.4Å; E289-W317 VanDerWaalsContact CA-O 3.26Å; E289-W317 WeakPolarHBondContact CA-O 3.49Å; E289-W317 VanDerWaalsContact CG-O 3.25Å; E289-W317 WeakPolarHBondContact CG-O 3.16Å
290	V	94	Very high	92.7	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.018	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110.9	164.9	-172.4	0	0	0	0	108.9	Q279 F288 I292 F302 W317 F319 L327 V339	Q279-V290 WeakPolarHBondContact O-CA 3.19Å; F288-V290 HydrophobicContact CD2-CG2 4.2Å; F288-V290 HydrophobicContact CE2-CG2 3.68Å; V290-I292 HydrophobicContact CG1-CB 4.31Å; V290-I292 HydrophobicContact CG1-CG2 4.14Å; V290-F302 HydrophobicContact CB-CE1 4.31Å; V290-F302 HydrophobicContact CB-CE2 4.49Å; V290-F302 HydrophobicContact CB-CZ 3.72Å; V290-F302 HydrophobicContact CG1-CE1 4.39Å; V290-F302 HydrophobicContact CG1-CZ 3.75Å; V290-F302 HydrophobicContact CG2-CE1 4.38Å; V290-F302 HydrophobicContact CG2-CZ 4.27Å; V290-W317 PolarHBondContact N-O 2.86Å; V290-F319 HydrophobicContact CG2-CD2 4.25Å; V290-F319 HydrophobicContact CG2-CE2 3.95Å; V290-L327 HydrophobicContact CG2-CD2 3.87Å; V290-V339 HydrophobicContact CG1-CG1 4.02Å
291	D	91.9	Very high	92.6	Very high	55 Å²	55	49.1 Å²	49.1	29%	0.294	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	107.6	175.9	-163.2	6.1	0	0	0	108.9	G278 Q279 I281 K316	G278-D291 CarbonylContact C-O 3.54Å; G278-D291 WeakPolarHBondContact CA-O 3.32Å; Q279-D291 HydrophobicContact CG-CB 4.03Å; Q279-D291 PolarHBondContact N-O 3.41Å; Q279-D291 PolarHBondContact O-N 3.05Å; I281-D291 HydrophobicContact CD1-CB 3.91Å; D291-K316 VanDerWaalsContact OD1-CE 3.32Å; D291-K316 WeakPolarHBondContact OD1-CE 3.22Å; D291-K316 IonicContact OD1-NZ 2.69Å; D291-K316 PolarHBondContact OD1-NZ 2.74Å; D291-K316 IonicContact OD2-NZ 2.83Å; D291-K316 PolarHBondContact OD2-NZ 2.87Å
292	I	91.3	Very high	92.6	Very high	27 Å²	27	48.4 Å²	48.4	14%	0.138	26%	0.258	C	S	.	.			trans	-152.7	142.8	-173.7	-166.3	170.2	0	0	0	110.4	V276 V290 V298 F302 V337 V339	V276-I292 HydrophobicContact CG1-CD1 3.85Å; V276-I292 HydrophobicContact CG1-CG1 3.61Å; V290-I292 HydrophobicContact CG1-CB 4.31Å; V290-I292 HydrophobicContact CG1-CG2 4.14Å; I292-V298 HydrophobicContact CD1-CG1 4.25Å; I292-V298 HydrophobicContact CD1-CG2 4.35Å; I292-V298 HydrophobicContact CG2-CG1 4.21Å; I292-F302 HydrophobicContact CG2-CE2 4.01Å; I292-F302 HydrophobicContact CG2-CZ 3.95Å; I292-V337 HydrophobicContact CD1-CG1 3.96Å; I292-V339 HydrophobicContact CD1-CG2 3.89Å
293	P	90.1	Very high	92.4	Very high	83 Å²	83	54.5 Å²	54.5	54%	0.539	29%	0.285	S	S	.	.			trans	-56.3	155.2	169.6	-25.1	35.1	0	0	0	112.6	V276 Q277 H295	V276-P293 HydrophobicContact CG1-CB 4.18Å; V276-P293 HydrophobicContact CG1-CG 4.27Å; Q277-P293 WeakPolarHBondContact O-CD 3.39Å; P293-H295 PolarHBondContact O-N 3.34Å; P293-H295 VanDerWaalsContact O-N 3.16Å
294	Y	89.1	Confident	92.4	Very high	189 Å²	189	56.8 Å²	56.8	74%	0.741	29%	0.291	S	S	*	.			trans	-61.6	118	-179.7	176.7	-92.3	0	0	0	111.7	I299	Y294-I299 HydrophobicContact CD2-CG1 4Å; Y294-I299 HydrophobicContact CE2-CG1 3.93Å
295	H	91.2	Very high	92.5	Very high	48 Å²	48	55 Å²	55	22%	0.222	28%	0.279	C	S	.	.			trans	-136.4	126.8	173.4	-167.6	-95.5	0	0	0	110.3	V276 P293 D297 V298 I299	V276-H295 HydrophobicContact CG1-CB 4.48Å; V276-H295 HydrophobicContact CG2-CB 4.14Å; P293-H295 PolarHBondContact O-N 3.34Å; P293-H295 VanDerWaalsContact O-N 3.16Å; H295-D297 IonicContact CE1-OD2 2.68Å; H295-D297 PolarHBondContact CE1-OD2 3.1Å; H295-D297 IonicContact ND1-OD2 2.86Å; H295-D297 PolarHBondContact O-N 3.28Å; H295-V298 HydrophobicContact CB-CB 4.15Å; H295-V298 HydrophobicContact CB-CG2 3.92Å; H295-V298 PolarHBondContact O-N 2.99Å; H295-V298 VanDerWaalsContact O-N 3.15Å; H295-I299 WeakPolarHBondContact O-CG1 3.37Å; H295-I299 PolarHBondContact O-N 2.97Å
296	A	90.9	Very high	92.5	Very high	58 Å²	58	54 Å²	54	48%	0.479	29%	0.285	S	S	.	.	H	α-helix	trans	-56.5	-46.9	-168.3	0	0	0	0	0	113.1	V298 I299 A300	A296-V298 VanDerWaalsContact C-N 3.34Å; A296-V298 PolarHBondContact O-N 3.46Å; A296-I299 PolarHBondContact O-N 3.2Å; A296-A300 PolarHBondContact O-N 2.92Å
297	D	91.1	Very high	92.7	Very high	97 Å²	97	53.5 Å²	53.5	52%	0.519	28%	0.282	S	S	.	.	H	α-helix	trans	-69.8	-31.6	-177.7	-51	-51.9	0	0	0	112.9	H295 A300 V301 M334	H295-D297 IonicContact CE1-OD2 2.68Å; H295-D297 PolarHBondContact CE1-OD2 3.1Å; H295-D297 IonicContact ND1-OD2 2.86Å; H295-D297 PolarHBondContact O-N 3.28Å; D297-A300 WeakPolarHBondContact O-CB 3.5Å; D297-A300 PolarHBondContact O-N 3.46Å; D297-V301 PolarHBondContact O-N 3.03Å; D297-M334 HydrophobicContact CB-CE 4.29Å; D297-M334 HydrophobicContact CB-SD 4.43Å; D297-M334 WeakPolarHBondContact O-CE 3.49Å
298	V	92.4	Very high	92.7	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-68.1	-45.4	175.1	176.7	0	0	0	0	109.4	I292 H295 A296 A300 V301 F302 L331 M334 V337	I292-V298 HydrophobicContact CD1-CG1 4.25Å; I292-V298 HydrophobicContact CD1-CG2 4.35Å; I292-V298 HydrophobicContact CG2-CG1 4.21Å; H295-V298 HydrophobicContact CB-CB 4.15Å; H295-V298 HydrophobicContact CB-CG2 3.92Å; H295-V298 PolarHBondContact O-N 2.99Å; H295-V298 VanDerWaalsContact O-N 3.15Å; A296-V298 VanDerWaalsContact C-N 3.34Å; A296-V298 PolarHBondContact O-N 3.46Å; V298-A300 VanDerWaalsContact C-N 3.26Å; V298-A300 PolarHBondContact O-N 2.9Å; V298-V301 PolarHBondContact O-N 3.32Å; V298-F302 HydrophobicContact CG1-CD1 4.08Å; V298-F302 HydrophobicContact CG1-CD2 4.21Å; V298-F302 HydrophobicContact CG1-CE1 3.54Å; V298-F302 HydrophobicContact CG1-CE2 3.7Å; V298-F302 HydrophobicContact CG1-CG 4.4Å; V298-F302 HydrophobicContact CG1-CZ 3.33Å; V298-F302 WeakPolarHBondContact O-CD1 3.34Å; V298-F302 VanDerWaalsContact O-CG 3.26Å; V298-F302 WeakPolarHBondContact O-CG 3.24Å; V298-F302 PolarHBondContact O-N 3.07Å; V298-L331 HydrophobicContact CG1-CD2 4.11Å; V298-L331 HydrophobicContact CG2-CD2 4.38Å; V298-M334 HydrophobicContact CG2-SD 3.97Å; V298-V337 HydrophobicContact CG2-CB 4.39Å; V298-V337 HydrophobicContact CG2-CG1 3.78Å; V298-V337 HydrophobicContact CG2-CG2 3.77Å
299	I	92.9	Very high	92.6	Very high	21 Å²	21	57.4 Å²	57.4	11%	0.108	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-32.8	173.9	-58.8	-53.9	0	0	0	111.3	Y294 H295 A296 F302 K303 W317	Y294-I299 HydrophobicContact CD2-CG1 4Å; Y294-I299 HydrophobicContact CE2-CG1 3.93Å; H295-I299 WeakPolarHBondContact O-CG1 3.37Å; H295-I299 PolarHBondContact O-N 2.97Å; A296-I299 PolarHBondContact O-N 3.2Å; I299-F302 HydrophobicContact CD1-CD2 3.8Å; I299-F302 HydrophobicContact CD1-CE2 4.23Å; I299-F302 PolarHBondContact O-N 2.97Å; I299-K303 HydrophobicContact CG2-CD 4.2Å; I299-K303 WeakPolarHBondContact O-CB 3.47Å; I299-K303 VanDerWaalsContact O-CG 3.24Å; I299-K303 WeakPolarHBondContact O-CG 3.28Å; I299-K303 PolarHBondContact O-N 3.1Å; I299-W317 HydrophobicContact CG2-CZ2 4.34Å
300	A	92.8	Very high	92.4	Very high	45 Å²	45	60.8 Å²	60.8	37%	0.372	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-38.7	173.6	0	0	0	0	0	112.4	A296 D297 V298 Q304	A296-A300 PolarHBondContact O-N 2.92Å; D297-A300 WeakPolarHBondContact O-CB 3.5Å; D297-A300 PolarHBondContact O-N 3.46Å; V298-A300 VanDerWaalsContact C-N 3.26Å; V298-A300 PolarHBondContact O-N 2.9Å; A300-Q304 WeakPolarHBondContact O-CG 3.41Å; A300-Q304 PolarHBondContact O-N 3.23Å; A300-Q304 PolarHBondContact O-NE2 3.16Å
301	V	94	Very high	92.3	Very high	13 Å²	13	63.3 Å²	63.3	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-70.7	-43.4	172	163.1	0	0	0	0	111.8	D297 V298 K303 Q304 M305 L327 L330 M334	D297-V301 PolarHBondContact O-N 3.03Å; V298-V301 PolarHBondContact O-N 3.32Å; V301-K303 PolarHBondContact O-N 3.49Å; V301-Q304 WeakPolarHBondContact O-CA 3.41Å; V301-Q304 WeakPolarHBondContact O-CB 3.41Å; V301-Q304 PolarHBondContact O-N 3.19Å; V301-M305 PolarHBondContact O-N 3.1Å; V301-L327 HydrophobicContact CG1-CD1 3.67Å; V301-L330 HydrophobicContact CG1-CB 3.96Å; V301-L330 HydrophobicContact CG1-CD1 4.07Å; V301-M334 HydrophobicContact CB-CE 3.99Å; V301-M334 HydrophobicContact CG2-CE 3.38Å
302	F	95	Very high	92.1	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-56.5	-38.9	175.1	-69.2	-4.7	0	0	0	111.8	V290 I292 V298 I299 Q304 M305 K308 W317 F319 L327 L331	V290-F302 HydrophobicContact CB-CE1 4.31Å; V290-F302 HydrophobicContact CB-CE2 4.49Å; V290-F302 HydrophobicContact CB-CZ 3.72Å; V290-F302 HydrophobicContact CG1-CE1 4.39Å; V290-F302 HydrophobicContact CG1-CZ 3.75Å; V290-F302 HydrophobicContact CG2-CE1 4.38Å; V290-F302 HydrophobicContact CG2-CZ 4.27Å; I292-F302 HydrophobicContact CG2-CE2 4.01Å; I292-F302 HydrophobicContact CG2-CZ 3.95Å; V298-F302 HydrophobicContact CG1-CD1 4.08Å; V298-F302 HydrophobicContact CG1-CD2 4.21Å; V298-F302 HydrophobicContact CG1-CE1 3.54Å; V298-F302 HydrophobicContact CG1-CE2 3.7Å; V298-F302 HydrophobicContact CG1-CG 4.4Å; V298-F302 HydrophobicContact CG1-CZ 3.33Å; V298-F302 WeakPolarHBondContact O-CD1 3.34Å; V298-F302 VanDerWaalsContact O-CG 3.26Å; V298-F302 WeakPolarHBondContact O-CG 3.24Å; V298-F302 PolarHBondContact O-N 3.07Å; I299-F302 HydrophobicContact CD1-CD2 3.8Å; I299-F302 HydrophobicContact CD1-CE2 4.23Å; I299-F302 PolarHBondContact O-N 2.97Å; F302-Q304 VanDerWaalsContact C-N 3.3Å; F302-Q304 PolarHBondContact O-N 3.14Å; F302-M305 PolarHBondContact O-N 3.02Å; F302-K308 WeakPolarHBondContact O-CB 3.41Å; F302-K308 WeakPolarHBondContact O-CD 3.35Å; F302-W317 HydrophobicContact CB-CD2 4.07Å; F302-W317 HydrophobicContact CB-CE3 4.02Å; F302-W317 HydrophobicContact CB-CZ3 4.39Å; F302-W317 HydrophobicContact CD2-CB 3.74Å; F302-W317 AromaticContact CD2-CD1 3.58Å; F302-W317 AromaticContact CD2-CD2 3.81Å; F302-W317 HydrophobicContact CD2-CD2 3.81Å; F302-W317 AromaticContact CD2-CG 3.42Å; F302-W317 HydrophobicContact CD2-CG 3.42Å; F302-W317 VanDerWaalsContact CD2-CG 3.42Å; F302-W317 HydrophobicContact CE2-CB 3.88Å; F302-W317 AromaticContact CE2-CD1 3.9Å; F302-W317 AromaticContact CE2-CG 3.91Å; F302-W317 HydrophobicContact CE2-CG 3.91Å; F302-W317 HydrophobicContact CG-CD2 4.37Å; F302-W317 HydrophobicContact CG-CG 4.3Å; F302-F319 HydrophobicContact CB-CE1 4.31Å; F302-F319 HydrophobicContact CB-CZ 3.88Å; F302-F319 HydrophobicContact CD1-CE2 4.23Å; F302-F319 AromaticContact CD1-CZ 3.64Å; F302-F319 HydrophobicContact CD1-CZ 3.64Å; F302-F319 HydrophobicContact CD2-CZ 4.19Å; F302-F319 HydrophobicContact CE1-CE2 4.31Å; F302-F319 HydrophobicContact CE1-CZ 4.17Å; F302-F319 HydrophobicContact CG-CE2 4.47Å; F302-F319 AromaticContact CG-CZ 3.65Å; F302-F319 HydrophobicContact CG-CZ 3.65Å; F302-L327 HydrophobicContact CD1-CD1 3.96Å; F302-L327 HydrophobicContact CE1-CD1 4.1Å; F302-L327 HydrophobicContact CE1-CD2 4.28Å; F302-L331 HydrophobicContact CE1-CD1 4.44Å; F302-L331 HydrophobicContact CE1-CD2 4.41Å
303	K	92.8	Very high	91.9	Very high	129 Å²	129	76.1 Å²	76.1	56%	0.561	39%	0.385	S	S	*	.	H	α-helix	trans	-66.3	-25.2	174.3	-76.5	170.7	178.7	177.1	0	113.9	I299 V301 K308 W317	I299-K303 HydrophobicContact CG2-CD 4.2Å; I299-K303 WeakPolarHBondContact O-CB 3.47Å; I299-K303 VanDerWaalsContact O-CG 3.24Å; I299-K303 WeakPolarHBondContact O-CG 3.28Å; I299-K303 PolarHBondContact O-N 3.1Å; V301-K303 PolarHBondContact O-N 3.49Å; K303-K308 WeakPolarHBondContact O-CD 2.96Å; K303-K308 WeakPolarHBondContact O-CE 3.36Å; K303-K308 PolarHBondContact O-NZ 3.13Å; K303-W317 HydrophobicContact CG-CH2 4.21Å
304	Q	93	Very high	91.7	Very high	117 Å²	117	75.9 Å²	75.9	55%	0.547	38%	0.382	S	S	.	.	H	α-helix	trans	-80.3	-20.3	176.3	-70	165.7	63.6	0	0	113.5	A300 V301 F302	A300-Q304 WeakPolarHBondContact O-CG 3.41Å; A300-Q304 PolarHBondContact O-N 3.23Å; A300-Q304 PolarHBondContact O-NE2 3.16Å; V301-Q304 WeakPolarHBondContact O-CA 3.41Å; V301-Q304 WeakPolarHBondContact O-CB 3.41Å; V301-Q304 PolarHBondContact O-N 3.19Å; F302-Q304 VanDerWaalsContact C-N 3.3Å; F302-Q304 PolarHBondContact O-N 3.14Å
305	M	94.4	Very high	91.7	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	38%	0.381	C	S	.	.			trans	-67.1	137	-179	-60.4	-53.2	-60.9	0	0	111.8	V301 F302 K308 F319 D323 R326 L327 L330	V301-M305 PolarHBondContact O-N 3.1Å; F302-M305 PolarHBondContact O-N 3.02Å; M305-K308 HydrophobicContact CB-CB 4.35Å; M305-K308 WeakPolarHBondContact O-CD 3.32Å; M305-K308 WeakPolarHBondContact O-CG 3.25Å; M305-K308 PolarHBondContact O-NZ 3.24Å; M305-F319 HydrophobicContact CB-CD1 3.77Å; M305-F319 HydrophobicContact CB-CE1 3.79Å; M305-F319 HydrophobicContact CG-CD1 4.02Å; M305-F319 HydrophobicContact CG-CE1 3.83Å; M305-D323 HydrophobicContact CE-CB 3.59Å; M305-D323 VanDerWaalsContact CE-CG 3.43Å; M305-D323 VanDerWaalsContact CE-OD1 3.3Å; M305-D323 WeakPolarHBondContact CE-OD1 3.11Å; M305-R326 HydrophobicContact CE-CB 4.17Å; M305-R326 HydrophobicContact CE-CG 4.03Å; M305-R326 HydrophobicContact SD-CG 4.49Å; M305-L327 HydrophobicContact CE-CB 3.9Å; M305-L327 HydrophobicContact CG-CD1 3.97Å; M305-L327 HydrophobicContact SD-CB 4.14Å; M305-L327 HydrophobicContact SD-CD1 3.98Å; M305-L330 HydrophobicContact SD-CD1 4.14Å
306	P	90.9	Very high	91.6	Very high	78 Å²	78	76.3 Å²	76.3	51%	0.506	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-54.9	174.9	-25.5	33	0	0	0	113.2	K308 D323	P306-K308 VanDerWaalsContact C-N 3.26Å; P306-K308 PolarHBondContact O-N 3.12Å; P306-D323 WeakPolarHBondContact CD-OD1 3.33Å; P306-D323 WeakPolarHBondContact CD-OD2 3.37Å
307	T	93.5	Very high	91.8	Very high	48 Å²	48	75.3 Å²	75.3	29%	0.294	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	18	-169.7	62.1	0	0	0	0	114.8	S320 D323	T307-S320 WeakPolarHBondContact OG1-CB 3.48Å; T307-S320 PolarHBondContact OG1-N 3.5Å; T307-D323 WeakPolarHBondContact CB-OD2 3.33Å; T307-D323 WeakPolarHBondContact CG2-OD2 3.25Å; T307-D323 PolarHBondContact N-OD2 3.12Å; T307-D323 PolarHBondContact OG1-OD2 2.83Å
308	K	93.9	Very high	92	Very high	89 Å²	89	71.4 Å²	71.4	39%	0.387	35%	0.345	S	S	.	.			trans	-57.3	137	-178.6	65.3	-178.5	165.9	-85.2	0	112.7	F302 K303 M305 P306 W317 S318 F319	F302-K308 WeakPolarHBondContact O-CB 3.41Å; F302-K308 WeakPolarHBondContact O-CD 3.35Å; K303-K308 WeakPolarHBondContact O-CD 2.96Å; K303-K308 WeakPolarHBondContact O-CE 3.36Å; K303-K308 PolarHBondContact O-NZ 3.13Å; M305-K308 HydrophobicContact CB-CB 4.35Å; M305-K308 WeakPolarHBondContact O-CD 3.32Å; M305-K308 WeakPolarHBondContact O-CG 3.25Å; M305-K308 PolarHBondContact O-NZ 3.24Å; P306-K308 VanDerWaalsContact C-N 3.26Å; P306-K308 PolarHBondContact O-N 3.12Å; K308-W317 HydrophobicContact CB-CE3 4.31Å; K308-W317 HydrophobicContact CB-CZ3 4.09Å; K308-W317 HydrophobicContact CD-CZ3 4.24Å; K308-W317 HydrophobicContact CG-CZ3 4.47Å; K308-S318 CarbonylContact C-O 3.39Å; K308-F319 HydrophobicContact CB-CD1 4.05Å; K308-F319 HydrophobicContact CB-CE1 3.75Å
309	N	93.7	Very high	92.1	Very high	79 Å²	79	71.3 Å²	71.3	42%	0.422	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	123.7	174	170.9	61.5	0	0	0	109.9	S318	N309-S318 WeakPolarHBondContact CB-OG 3.33Å; N309-S318 PolarHBondContact N-O 2.93Å; N309-S318 PolarHBondContact ND2-OG 3.35Å; N309-S318 PolarHBondContact O-N 2.92Å; N309-S318 PolarHBondContact O-OG 2.82Å
310	Y	92.7	Very high	92.2	Very high	97 Å²	97	70.8 Å²	70.8	38%	0.38	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.7	-179.4	177.8	-107.2	0	0	0	110.3	M312 R315 K316 W317	Y310-M312 HydrophobicContact CD1-CG 4.3Å; Y310-M312 HydrophobicContact CE1-CG 4.22Å; Y310-R315 VanDerWaalsContact CE2-C 3.45Å; Y310-R315 WeakPolarHBondContact CE2-O 3.45Å; Y310-K316 WeakPolarHBondContact CD2-O 3.46Å; Y310-W317 AromaticContact CD2-CD1 3.57Å; Y310-W317 AromaticContact CD2-CD2 3.82Å; Y310-W317 HydrophobicContact CD2-CD2 3.82Å; Y310-W317 AromaticContact CD2-CE2 3.45Å; Y310-W317 VanDerWaalsContact CD2-CE2 3.45Å; Y310-W317 AromaticContact CD2-CG 3.91Å; Y310-W317 HydrophobicContact CD2-CG 3.91Å; Y310-W317 AromaticContact CD2-CZ2 4Å; Y310-W317 HydrophobicContact CD2-CZ2 4Å; Y310-W317 AromaticContact CD2-NE1 3.26Å; Y310-W317 VanDerWaalsContact CD2-NE1 3.26Å; Y310-W317 AromaticContact CE2-CD1 3.94Å; Y310-W317 AromaticContact CE2-NE1 3.57Å; Y310-W317 HydrophobicContact CG-CD2 4.35Å; Y310-W317 AromaticContact CG-CE2 3.99Å; Y310-W317 HydrophobicContact CG-CZ2 4.13Å
311	D	90	Very high	92.2	Very high	55 Å²	55	68.7 Å²	68.7	29%	0.294	33%	0.326	S	S	.	.			trans	-87.8	120.3	173.7	171.6	29.9	0	0	0	110.6	K313 T314 R315 K316	D311-K313 VanDerWaalsContact C-N 3.26Å; D311-K313 PolarHBondContact O-N 2.93Å; D311-K313 WeakPolarHBondContact OD1-CB 3.33Å; D311-K313 PolarHBondContact OD1-N 3.37Å; D311-T314 WeakPolarHBondContact CB-OG1 3.36Å; D311-T314 VanDerWaalsContact OD2-CB 3.32Å; D311-T314 WeakPolarHBondContact OD2-CB 3.49Å; D311-T314 VanDerWaalsContact OD2-CG2 3.28Å; D311-T314 WeakPolarHBondContact OD2-CG2 3.39Å; D311-T314 PolarHBondContact OD2-N 2.93Å; D311-T314 PolarHBondContact OD2-OG1 3.09Å; D311-R315 WeakPolarHBondContact O-CA 3.48Å; D311-R315 PolarHBondContact O-N 3.36Å; D311-K316 PolarHBondContact N-O 3.32Å; D311-K316 VanDerWaalsContact N-O 3.11Å
312	M	88.3	Confident	92	Very high	159 Å²	159	72.9 Å²	72.9	78%	0.783	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-21.9	178.2	-66.4	-177.6	-76.6	0	0	113.6	Y310	Y310-M312 HydrophobicContact CD1-CG 4.3Å; Y310-M312 HydrophobicContact CE1-CG 4.22Å
313	K	88.3	Confident	91.9	Very high	193 Å²	193	73.7 Å²	73.7	84%	0.839	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-54.1	179.3	-63.4	-179.5	179.7	179.3	0	111.6	D311	D311-K313 VanDerWaalsContact C-N 3.26Å; D311-K313 PolarHBondContact O-N 2.93Å; D311-K313 WeakPolarHBondContact OD1-CB 3.33Å; D311-K313 PolarHBondContact OD1-N 3.37Å
314	T	85.2	Confident	92	Very high	78 Å²	78	67.5 Å²	67.5	48%	0.479	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-14.3	178.9	58.1	0	0	0	0	113.6	D311 K316	D311-T314 WeakPolarHBondContact CB-OG1 3.36Å; D311-T314 VanDerWaalsContact OD2-CB 3.32Å; D311-T314 WeakPolarHBondContact OD2-CB 3.49Å; D311-T314 VanDerWaalsContact OD2-CG2 3.28Å; D311-T314 WeakPolarHBondContact OD2-CG2 3.39Å; D311-T314 PolarHBondContact OD2-N 2.93Å; D311-T314 PolarHBondContact OD2-OG1 3.09Å; T314-K316 PolarHBondContact O-N 3.3Å
315	R	88.6	Confident	91.9	Very high	194 Å²	194	66.6 Å²	66.6	73%	0.732	32%	0.316	S	S	*	.			trans	60.5	26.2	-176.2	-57	-178.3	176.8	-179.2	-1.6	114.2	Y310 D311	Y310-R315 VanDerWaalsContact CE2-C 3.45Å; Y310-R315 WeakPolarHBondContact CE2-O 3.45Å; D311-R315 WeakPolarHBondContact O-CA 3.48Å; D311-R315 PolarHBondContact O-N 3.36Å
316	K	89.3	Confident	91.9	Very high	51 Å²	51	72.5 Å²	72.5	22%	0.222	34%	0.338	C	S	.	.			trans	-109.4	153.8	-175.4	-83.6	145.1	162.4	-95.2	0	112.6	E289 D291 Y310 D311 T314	E289-K316 VanDerWaalsContact CD-CB 3.46Å; E289-K316 HydrophobicContact CG-CB 3.85Å; E289-K316 HydrophobicContact CG-CG 4.36Å; E289-K316 VanDerWaalsContact OE1-CD 3.27Å; E289-K316 WeakPolarHBondContact OE1-CD 3.42Å; E289-K316 WeakPolarHBondContact OE1-CE 3.4Å; E289-K316 WeakPolarHBondContact OE1-CG 3.5Å; E289-K316 IonicContact OE1-NZ 3.86Å; E289-K316 PolarHBondContact OE1-NZ 3.18Å; D291-K316 VanDerWaalsContact OD1-CE 3.32Å; D291-K316 WeakPolarHBondContact OD1-CE 3.22Å; D291-K316 IonicContact OD1-NZ 2.69Å; D291-K316 PolarHBondContact OD1-NZ 2.74Å; D291-K316 IonicContact OD2-NZ 2.83Å; D291-K316 PolarHBondContact OD2-NZ 2.87Å; Y310-K316 WeakPolarHBondContact CD2-O 3.46Å; D311-K316 PolarHBondContact N-O 3.32Å; D311-K316 VanDerWaalsContact N-O 3.11Å; T314-K316 PolarHBondContact O-N 3.3Å
317	W	94.6	Very high	92	Very high	38 Å²	38	68.8 Å²	68.8	14%	0.144	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.6	-179.3	-75	86.4	0	0	0	111.2	E289 V290 I299 F302 K303 K308 Y310 F319	E289-W317 CarbonylContact C-O 3.4Å; E289-W317 VanDerWaalsContact CA-O 3.26Å; E289-W317 WeakPolarHBondContact CA-O 3.49Å; E289-W317 VanDerWaalsContact CG-O 3.25Å; E289-W317 WeakPolarHBondContact CG-O 3.16Å; V290-W317 PolarHBondContact N-O 2.86Å; I299-W317 HydrophobicContact CG2-CZ2 4.34Å; F302-W317 HydrophobicContact CB-CD2 4.07Å; F302-W317 HydrophobicContact CB-CE3 4.02Å; F302-W317 HydrophobicContact CB-CZ3 4.39Å; F302-W317 HydrophobicContact CD2-CB 3.74Å; F302-W317 AromaticContact CD2-CD1 3.58Å; F302-W317 AromaticContact CD2-CD2 3.81Å; F302-W317 HydrophobicContact CD2-CD2 3.81Å; F302-W317 AromaticContact CD2-CG 3.42Å; F302-W317 HydrophobicContact CD2-CG 3.42Å; F302-W317 VanDerWaalsContact CD2-CG 3.42Å; F302-W317 HydrophobicContact CE2-CB 3.88Å; F302-W317 AromaticContact CE2-CD1 3.9Å; F302-W317 AromaticContact CE2-CG 3.91Å; F302-W317 HydrophobicContact CE2-CG 3.91Å; F302-W317 HydrophobicContact CG-CD2 4.37Å; F302-W317 HydrophobicContact CG-CG 4.3Å; K303-W317 HydrophobicContact CG-CH2 4.21Å; K308-W317 HydrophobicContact CB-CE3 4.31Å; K308-W317 HydrophobicContact CB-CZ3 4.09Å; K308-W317 HydrophobicContact CD-CZ3 4.24Å; K308-W317 HydrophobicContact CG-CZ3 4.47Å; Y310-W317 AromaticContact CD2-CD1 3.57Å; Y310-W317 AromaticContact CD2-CD2 3.82Å; Y310-W317 HydrophobicContact CD2-CD2 3.82Å; Y310-W317 AromaticContact CD2-CE2 3.45Å; Y310-W317 VanDerWaalsContact CD2-CE2 3.45Å; Y310-W317 AromaticContact CD2-CG 3.91Å; Y310-W317 HydrophobicContact CD2-CG 3.91Å; Y310-W317 AromaticContact CD2-CZ2 4Å; Y310-W317 HydrophobicContact CD2-CZ2 4Å; Y310-W317 AromaticContact CD2-NE1 3.26Å; Y310-W317 VanDerWaalsContact CD2-NE1 3.26Å; Y310-W317 AromaticContact CE2-CD1 3.94Å; Y310-W317 AromaticContact CE2-NE1 3.57Å; Y310-W317 HydrophobicContact CG-CD2 4.35Å; Y310-W317 AromaticContact CG-CE2 3.99Å; Y310-W317 HydrophobicContact CG-CZ2 4.13Å; W317-F319 HydrophobicContact CB-CE2 3.91Å; W317-F319 HydrophobicContact CB-CZ 3.87Å; W317-F319 HydrophobicContact CE3-CZ 4.35Å
318	S	95	Very high	92	Very high	14 Å²	14	67.1 Å²	67.1	10%	0.098	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150.5	-178.3	57.1	0	0	0	0	112.2	F288 K308 N309	F288-S318 CarbonylContact O-C 3.47Å; F288-S318 WeakPolarHBondContact O-CA 3.41Å; F288-S318 WeakPolarHBondContact O-CB 3.18Å; K308-S318 CarbonylContact C-O 3.39Å; N309-S318 WeakPolarHBondContact CB-OG 3.33Å; N309-S318 PolarHBondContact N-O 2.93Å; N309-S318 PolarHBondContact ND2-OG 3.35Å; N309-S318 PolarHBondContact O-N 2.92Å; N309-S318 PolarHBondContact O-OG 2.82Å
319	F	95.7	Very high	91.9	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	160.2	-172.4	-48.9	-86.9	0	0	0	110.6	K287 F288 V290 F302 M305 K308 W317 L327	K287-F319 WeakPolarHBondContact CA-O 3.39Å; K287-F319 WeakPolarHBondContact CB-O 3.08Å; F288-F319 HydrophobicContact CD1-CB 4.32Å; F288-F319 HydrophobicContact CE1-CB 3.68Å; F288-F319 HydrophobicContact CE2-CD2 4.15Å; F288-F319 HydrophobicContact CZ-CB 3.89Å; F288-F319 HydrophobicContact CZ-CD2 4.02Å; F288-F319 HydrophobicContact CZ-CG 4.28Å; F288-F319 PolarHBondContact N-O 3.32Å; F288-F319 PolarHBondContact O-N 3.46Å; V290-F319 HydrophobicContact CG2-CD2 4.25Å; V290-F319 HydrophobicContact CG2-CE2 3.95Å; F302-F319 HydrophobicContact CB-CE1 4.31Å; F302-F319 HydrophobicContact CB-CZ 3.88Å; F302-F319 HydrophobicContact CD1-CE2 4.23Å; F302-F319 AromaticContact CD1-CZ 3.64Å; F302-F319 HydrophobicContact CD1-CZ 3.64Å; F302-F319 HydrophobicContact CD2-CZ 4.19Å; F302-F319 HydrophobicContact CE1-CE2 4.31Å; F302-F319 HydrophobicContact CE1-CZ 4.17Å; F302-F319 HydrophobicContact CG-CE2 4.47Å; F302-F319 AromaticContact CG-CZ 3.65Å; F302-F319 HydrophobicContact CG-CZ 3.65Å; M305-F319 HydrophobicContact CB-CD1 3.77Å; M305-F319 HydrophobicContact CB-CE1 3.79Å; M305-F319 HydrophobicContact CG-CD1 4.02Å; M305-F319 HydrophobicContact CG-CE1 3.83Å; K308-F319 HydrophobicContact CB-CD1 4.05Å; K308-F319 HydrophobicContact CB-CE1 3.75Å; W317-F319 HydrophobicContact CB-CE2 3.91Å; W317-F319 HydrophobicContact CB-CZ 3.87Å; W317-F319 HydrophobicContact CE3-CZ 4.35Å; F319-L327 HydrophobicContact CD1-CD2 4.47Å; F319-L327 HydrophobicContact CD2-CD2 3.64Å; F319-L327 HydrophobicContact CE1-CD2 4.46Å; F319-L327 HydrophobicContact CE2-CD2 3.64Å; F319-L327 HydrophobicContact CG-CD2 4.09Å; F319-L327 HydrophobicContact CZ-CD2 4.07Å
320	S	94.1	Very high	91.9	Very high	10 Å²	10	65.8 Å²	65.8	7%	0.07	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	147.5	169.9	-174.3	0	0	0	0	111	T286 F288 T307 E322 D323 Y324	T286-S320 WeakPolarHBondContact O-CA 3.47Å; T286-S320 PolarHBondContact O-OG 3.46Å; F288-S320 WeakPolarHBondContact CE1-O 3.29Å; T307-S320 WeakPolarHBondContact OG1-CB 3.48Å; T307-S320 PolarHBondContact OG1-N 3.5Å; S320-E322 PolarHBondContact O-N 3.05Å; S320-E322 PolarHBondContact OG-N 3.02Å; S320-E322 PolarHBondContact OG-OE1 2.99Å; S320-D323 PolarHBondContact O-N 2.83Å; S320-Y324 PolarHBondContact O-N 2.71Å
321	L	92.4	Very high	91.8	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.005	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-59.4	-25.6	172.8	-68.4	172.4	0	0	0	112.7	L282 T286 F288 D323 Y324 L342 F350 F354	L282-L321 HydrophobicContact CD1-CD1 4.04Å; L282-L321 HydrophobicContact CD1-CD2 3.91Å; L282-L321 HydrophobicContact CD1-CG 4.44Å; T286-L321 PolarHBondContact O-N 2.71Å; F288-L321 HydrophobicContact CB-CD2 4.1Å; F288-L321 HydrophobicContact CD1-CD2 3.94Å; F288-L321 HydrophobicContact CG-CD2 4.39Å; L321-D323 VanDerWaalsContact C-N 3.3Å; L321-D323 PolarHBondContact O-N 3.16Å; L321-Y324 WeakPolarHBondContact O-CB 3.48Å; L321-Y324 PolarHBondContact O-N 3.06Å; L321-L342 HydrophobicContact CD2-CD1 3.73Å; L321-F350 HydrophobicContact CD1-CB 4.29Å; L321-F354 HydrophobicContact CB-CD1 4.01Å; L321-F354 HydrophobicContact CB-CE1 4.13Å; L321-F354 HydrophobicContact CB-CG 4.37Å; L321-F354 HydrophobicContact CD2-CD1 4.49Å; L321-F354 HydrophobicContact CD2-CE1 3.75Å; L321-F354 HydrophobicContact CD2-CZ 3.82Å; L321-F354 HydrophobicContact CG-CE1 4.45Å; L321-F354 VanDerWaalsContact O-CD1 3.25Å; L321-F354 WeakPolarHBondContact O-CD1 3.44Å
322	E	91.3	Very high	91.6	Very high	101 Å²	101	62.3 Å²	62.3	47%	0.472	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-57	-41.6	170.7	-66.6	151.8	-116	0	0	112.7	S320 Y324	S320-E322 PolarHBondContact O-N 3.05Å; S320-E322 PolarHBondContact OG-N 3.02Å; S320-E322 PolarHBondContact OG-OE1 2.99Å; E322-Y324 VanDerWaalsContact C-N 3.3Å; E322-Y324 PolarHBondContact O-N 3.21Å
323	D	92.1	Very high	91.5	Very high	16 Å²	16	58 Å²	58	9%	0.086	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-80	-11	-178.8	-101.5	-31.6	0	0	0	112.4	M305 P306 T307 S320 L321 K325 R326 L327	M305-D323 HydrophobicContact CE-CB 3.59Å; M305-D323 VanDerWaalsContact CE-CG 3.43Å; M305-D323 VanDerWaalsContact CE-OD1 3.3Å; M305-D323 WeakPolarHBondContact CE-OD1 3.11Å; P306-D323 WeakPolarHBondContact CD-OD1 3.33Å; P306-D323 WeakPolarHBondContact CD-OD2 3.37Å; T307-D323 WeakPolarHBondContact CB-OD2 3.33Å; T307-D323 WeakPolarHBondContact CG2-OD2 3.25Å; T307-D323 PolarHBondContact N-OD2 3.12Å; T307-D323 PolarHBondContact OG1-OD2 2.83Å; S320-D323 PolarHBondContact O-N 2.83Å; L321-D323 VanDerWaalsContact C-N 3.3Å; L321-D323 PolarHBondContact O-N 3.16Å; D323-K325 PolarHBondContact O-N 2.68Å; D323-R326 PolarHBondContact O-N 3.41Å; D323-L327 PolarHBondContact O-N 2.92Å
324	Y	94.2	Very high	91.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-55	-50.3	-171.8	172.3	-104.9	0	0	0	113.1	L262 L265 C280 F288 S320 L321 E322 R326 L327 M328 P341 L342 I347 F354	L262-Y324 HydrophobicContact CD2-CD1 3.95Å; L262-Y324 HydrophobicContact CD2-CE1 4.3Å; L265-Y324 HydrophobicContact CD1-CD1 4.42Å; L265-Y324 HydrophobicContact CD1-CE1 3.81Å; C280-Y324 HydrophobicContact CB-CE2 4.33Å; F288-Y324 HydrophobicContact CD1-CD2 4.24Å; F288-Y324 HydrophobicContact CD2-CD2 4.14Å; F288-Y324 AromaticContact CE1-CD2 3.89Å; F288-Y324 HydrophobicContact CE1-CD2 3.89Å; F288-Y324 HydrophobicContact CE1-CG 4.25Å; F288-Y324 AromaticContact CE2-CD2 3.78Å; F288-Y324 HydrophobicContact CE2-CD2 3.78Å; F288-Y324 HydrophobicContact CE2-CE2 4.45Å; F288-Y324 HydrophobicContact CG-CD2 4.36Å; F288-Y324 AromaticContact CZ-CD2 3.66Å; F288-Y324 HydrophobicContact CZ-CD2 3.66Å; F288-Y324 HydrophobicContact CZ-CG 4.34Å; S320-Y324 PolarHBondContact O-N 2.71Å; L321-Y324 WeakPolarHBondContact O-CB 3.48Å; L321-Y324 PolarHBondContact O-N 3.06Å; E322-Y324 VanDerWaalsContact C-N 3.3Å; E322-Y324 PolarHBondContact O-N 3.21Å; Y324-R326 VanDerWaalsContact C-N 3.34Å; Y324-R326 PolarHBondContact O-N 2.8Å; Y324-L327 PolarHBondContact O-N 2.65Å; Y324-M328 HydrophobicContact CD2-CG 4.03Å; Y324-M328 HydrophobicContact CE1-CG 4.14Å; Y324-M328 HydrophobicContact CE2-CG 3.53Å; Y324-M328 HydrophobicContact CE2-SD 3.97Å; Y324-M328 WeakPolarHBondContact O-CG 3.28Å; Y324-M328 PolarHBondContact O-N 3.46Å; Y324-P341 WeakPolarHBondContact OH-CA 3.47Å; Y324-P341 WeakPolarHBondContact OH-CB 3.19Å; Y324-L342 HydrophobicContact CD2-CD1 3.78Å; Y324-L342 HydrophobicContact CD2-CG 4.19Å; Y324-L342 HydrophobicContact CE2-CB 4.13Å; Y324-L342 HydrophobicContact CE2-CD1 3.73Å; Y324-L342 HydrophobicContact CE2-CG 3.66Å; Y324-L342 HydrophobicContact CG-CD1 4.28Å; Y324-L342 PolarHBondContact OH-N 3.48Å; Y324-I347 HydrophobicContact CE1-CD1 4.08Å; Y324-F354 HydrophobicContact CD1-CD1 4.03Å; Y324-F354 AromaticContact CD1-CE1 3.53Å; Y324-F354 HydrophobicContact CD1-CE1 3.53Å; Y324-F354 HydrophobicContact CE1-CE1 4.24Å; Y324-F354 HydrophobicContact CG-CD1 4.38Å; Y324-F354 AromaticContact CG-CE1 3.82Å; Y324-F354 HydrophobicContact CG-CE1 3.82Å
325	K	92.4	Very high	91.4	Very high	97 Å²	97	51.6 Å²	51.6	42%	0.422	28%	0.276	S	S	.	.	H	α-helix	trans	-60.7	-46.3	-178.4	-167.2	-153.2	167.1	-151.4	0	110.9	L262 L265 D323 L327 M328 D329	L262-K325 HydrophobicContact CD2-CB 3.91Å; L262-K325 HydrophobicContact CD2-CG 4.23Å; L265-K325 HydrophobicContact CD1-CG 4.21Å; D323-K325 PolarHBondContact O-N 2.68Å; K325-L327 VanDerWaalsContact C-N 3.33Å; K325-L327 PolarHBondContact O-N 2.81Å; K325-M328 PolarHBondContact O-N 2.69Å; K325-D329 VanDerWaalsContact CE-OD2 3.23Å; K325-D329 WeakPolarHBondContact CE-OD2 3.29Å; K325-D329 IonicContact NZ-OD2 3.41Å; K325-D329 PolarHBondContact NZ-OD2 3.03Å; K325-D329 WeakPolarHBondContact O-CB 3.39Å; K325-D329 PolarHBondContact O-N 3.28Å
326	R	92.9	Very high	91.3	Very high	125 Å²	125	43.5 Å²	43.5	47%	0.472	25%	0.253	S	S	.	.	H	α-helix	trans	-61	-41.2	179.2	178	-177.4	178.2	-177.4	1.1	111.7	M305 D323 Y324 L330	M305-R326 HydrophobicContact CE-CB 4.17Å; M305-R326 HydrophobicContact CE-CG 4.03Å; M305-R326 HydrophobicContact SD-CG 4.49Å; D323-R326 PolarHBondContact O-N 3.41Å; Y324-R326 VanDerWaalsContact C-N 3.34Å; Y324-R326 PolarHBondContact O-N 2.8Å; R326-L330 HydrophobicContact CG-CD1 4.31Å; R326-L330 VanDerWaalsContact O-CG 3.32Å; R326-L330 WeakPolarHBondContact O-CG 3.25Å; R326-L330 PolarHBondContact O-N 2.86Å; R326-L330 VanDerWaalsContact O-N 3.13Å
327	L	94.3	Very high	91.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66	-46.4	176.9	-177.5	56.1	0	0	0	111.5	F288 V290 V301 F302 M305 F319 D323 Y324 K325 L330 L331	F288-L327 HydrophobicContact CE2-CD2 3.98Å; F288-L327 HydrophobicContact CZ-CD2 3.77Å; V290-L327 HydrophobicContact CG2-CD2 3.87Å; V301-L327 HydrophobicContact CG1-CD1 3.67Å; F302-L327 HydrophobicContact CD1-CD1 3.96Å; F302-L327 HydrophobicContact CE1-CD1 4.1Å; F302-L327 HydrophobicContact CE1-CD2 4.28Å; M305-L327 HydrophobicContact CE-CB 3.9Å; M305-L327 HydrophobicContact CG-CD1 3.97Å; M305-L327 HydrophobicContact SD-CB 4.14Å; M305-L327 HydrophobicContact SD-CD1 3.98Å; F319-L327 HydrophobicContact CD1-CD2 4.47Å; F319-L327 HydrophobicContact CD2-CD2 3.64Å; F319-L327 HydrophobicContact CE1-CD2 4.46Å; F319-L327 HydrophobicContact CE2-CD2 3.64Å; F319-L327 HydrophobicContact CG-CD2 4.09Å; F319-L327 HydrophobicContact CZ-CD2 4.07Å; D323-L327 PolarHBondContact O-N 2.92Å; Y324-L327 PolarHBondContact O-N 2.65Å; K325-L327 VanDerWaalsContact C-N 3.33Å; K325-L327 PolarHBondContact O-N 2.81Å; L327-L330 PolarHBondContact O-N 3Å; L327-L331 HydrophobicContact CD1-CD1 3.86Å; L327-L331 HydrophobicContact CD1-CG 4.02Å; L327-L331 HydrophobicContact CD2-CD1 4.44Å; L327-L331 HydrophobicContact CG-CD1 3.75Å; L327-L331 HydrophobicContact CG-CG 4.35Å; L327-L331 VanDerWaalsContact O-CG 3.3Å; L327-L331 WeakPolarHBondContact O-CG 3.47Å; L327-L331 PolarHBondContact O-N 3.44Å
328	M	93.7	Very high	91.1	Very high	12 Å²	12	40 Å²	40	6%	0.059	24%	0.24	C	C	.	.	H	α-helix	trans	-64.6	-41	178.2	-66.7	-53.3	-60.4	0	0	112.3	L265 C280 Y324 K325 L330 L331 S332 V339 P341	L265-M328 HydrophobicContact CD1-CB 3.94Å; L265-M328 HydrophobicContact CD1-CG 4.27Å; L265-M328 HydrophobicContact CD2-CB 4.23Å; C280-M328 VanDerWaalsContact SG-SD 3.6Å; Y324-M328 HydrophobicContact CD2-CG 4.03Å; Y324-M328 HydrophobicContact CE1-CG 4.14Å; Y324-M328 HydrophobicContact CE2-CG 3.53Å; Y324-M328 HydrophobicContact CE2-SD 3.97Å; Y324-M328 WeakPolarHBondContact O-CG 3.28Å; Y324-M328 PolarHBondContact O-N 3.46Å; K325-M328 PolarHBondContact O-N 2.69Å; M328-L330 VanDerWaalsContact C-N 3.33Å; M328-L330 PolarHBondContact O-N 3.44Å; M328-L331 PolarHBondContact O-N 3.36Å; M328-L331 HydrophobicContact SD-CD1 4.49Å; M328-S332 VanDerWaalsContact O-CB 3.3Å; M328-S332 WeakPolarHBondContact O-CB 3.25Å; M328-S332 PolarHBondContact O-N 2.79Å; M328-V339 HydrophobicContact CE-CB 4.43Å; M328-V339 HydrophobicContact CE-CG1 4.47Å; M328-P341 HydrophobicContact CE-CB 4.17Å
329	D	91.4	Very high	91	Very high	71 Å²	71	39.8 Å²	39.8	38%	0.38	24%	0.237	S	C	.	.	H	α-helix	trans	-57.4	-45.7	174.6	-70.6	-20.4	0	0	0	110.1	K325 S332	K325-D329 VanDerWaalsContact CE-OD2 3.23Å; K325-D329 WeakPolarHBondContact CE-OD2 3.29Å; K325-D329 IonicContact NZ-OD2 3.41Å; K325-D329 PolarHBondContact NZ-OD2 3.03Å; K325-D329 WeakPolarHBondContact O-CB 3.39Å; K325-D329 PolarHBondContact O-N 3.28Å; D329-S332 PolarHBondContact O-N 2.82Å; D329-S332 PolarHBondContact O-OG 2.83Å
330	L	92.6	Very high	90.8	Very high	69 Å²	69	42.4 Å²	42.4	36%	0.361	25%	0.249	S	C	.	.	H	α-helix	trans	-67	-43.4	177.6	-71.7	170.1	0	0	0	113.9	V301 M305 R326 L327 M328 S332 G333	V301-L330 HydrophobicContact CG1-CB 3.96Å; V301-L330 HydrophobicContact CG1-CD1 4.07Å; M305-L330 HydrophobicContact SD-CD1 4.14Å; R326-L330 HydrophobicContact CG-CD1 4.31Å; R326-L330 VanDerWaalsContact O-CG 3.32Å; R326-L330 WeakPolarHBondContact O-CG 3.25Å; R326-L330 PolarHBondContact O-N 2.86Å; R326-L330 VanDerWaalsContact O-N 3.13Å; L327-L330 PolarHBondContact O-N 3Å; M328-L330 VanDerWaalsContact C-N 3.33Å; M328-L330 PolarHBondContact O-N 3.44Å; L330-S332 VanDerWaalsContact C-N 3.32Å; L330-G333 PolarHBondContact O-N 2.84Å
331	L	91.1	Very high	90.9	Very high	6 Å²	6	42.2 Å²	42.2	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-68	-32.7	177.8	-67.3	168.6	0	0	0	111.9	V298 F302 L327 M328 G333 M334 V339	V298-L331 HydrophobicContact CG1-CD2 4.11Å; V298-L331 HydrophobicContact CG2-CD2 4.38Å; F302-L331 HydrophobicContact CE1-CD1 4.44Å; F302-L331 HydrophobicContact CE1-CD2 4.41Å; L327-L331 HydrophobicContact CD1-CD1 3.86Å; L327-L331 HydrophobicContact CD1-CG 4.02Å; L327-L331 HydrophobicContact CD2-CD1 4.44Å; L327-L331 HydrophobicContact CG-CD1 3.75Å; L327-L331 HydrophobicContact CG-CG 4.35Å; L327-L331 VanDerWaalsContact O-CG 3.3Å; L327-L331 WeakPolarHBondContact O-CG 3.47Å; L327-L331 PolarHBondContact O-N 3.44Å; M328-L331 PolarHBondContact O-N 3.36Å; M328-L331 HydrophobicContact SD-CD1 4.49Å; L331-G333 PolarHBondContact O-N 2.96Å; L331-M334 HydrophobicContact CD2-CE 4.36Å; L331-M334 HydrophobicContact CD2-SD 4.35Å; L331-M334 PolarHBondContact O-N 2.74Å; L331-V339 HydrophobicContact CD1-CG2 4.16Å
332	S	86.7	Confident	91	Very high	73 Å²	73	42.1 Å²	42.1	51%	0.51	25%	0.248	S	C	.	.	H	α-helix	trans	-59.4	-35.3	178.4	78.6	0	0	0	0	112.4	K271 M328 D329 L330 M334	K271-S332 PolarHBondContact NZ-O 2.81Å; M328-S332 VanDerWaalsContact O-CB 3.3Å; M328-S332 WeakPolarHBondContact O-CB 3.25Å; M328-S332 PolarHBondContact O-N 2.79Å; D329-S332 PolarHBondContact O-N 2.82Å; D329-S332 PolarHBondContact O-OG 2.83Å; L330-S332 VanDerWaalsContact C-N 3.32Å; S332-M334 VanDerWaalsContact C-N 3.3Å; S332-M334 PolarHBondContact O-N 3.37Å
333	G	86.3	Confident	91	Very high	70 Å²	70	38.2 Å²	38.2	72%	0.722	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-11.5	179.9	0	0	0	0	0	115.8	L330 L331	L330-G333 PolarHBondContact O-N 2.84Å; L331-G333 PolarHBondContact O-N 2.96Å
334	M	88	Confident	91	Very high	33 Å²	33	42.8 Å²	42.8	16%	0.163	25%	0.247	C	C	.	.			trans	-81.1	123.3	178.2	-64.8	-175.6	-174.8	0	0	111.3	K271 D297 V298 V301 L331 S332 G336 V337	K271-M334 PolarHBondContact NZ-O 2.76Å; D297-M334 HydrophobicContact CB-CE 4.29Å; D297-M334 HydrophobicContact CB-SD 4.43Å; D297-M334 WeakPolarHBondContact O-CE 3.49Å; V298-M334 HydrophobicContact CG2-SD 3.97Å; V301-M334 HydrophobicContact CB-CE 3.99Å; V301-M334 HydrophobicContact CG2-CE 3.38Å; L331-M334 HydrophobicContact CD2-CE 4.36Å; L331-M334 HydrophobicContact CD2-SD 4.35Å; L331-M334 PolarHBondContact O-N 2.74Å; S332-M334 VanDerWaalsContact C-N 3.3Å; S332-M334 PolarHBondContact O-N 3.37Å; M334-G336 PolarHBondContact O-N 3.34Å; M334-V337 HydrophobicContact CB-CB 3.89Å; M334-V337 HydrophobicContact CB-CG2 4.01Å; M334-V337 HydrophobicContact SD-CB 4.17Å; M334-V337 HydrophobicContact SD-CG2 3.82Å
335	A	82.3	Confident	90.9	Very high	102 Å²	102	42.9 Å²	42.9	84%	0.843	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-38.1	-177	0	0	0	0	0	113.8
336	G	86.3	Confident	91	Very high	25 Å²	25	38.3 Å²	38.3	26%	0.258	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	0.2	-176	0	0	0	0	0	116.2	A274 S275 V276 M334	A274-G336 CarbonylContact C-O 3.6Å; S275-G336 PolarHBondContact N-O 2.92Å; S275-G336 PolarHBondContact OG-O 2.82Å; V276-G336 PolarHBondContact N-O 3.28Å; M334-G336 PolarHBondContact O-N 3.34Å
337	V	89.2	Confident	91	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.018	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.3	-170.7	-176.5	0	0	0	0	111.7	K271 I292 V298 M334 V339	K271-V337 WeakPolarHBondContact CD-O 3.29Å; K271-V337 PolarHBondContact NZ-O 2.55Å; I292-V337 HydrophobicContact CD1-CG1 3.96Å; V298-V337 HydrophobicContact CG2-CB 4.39Å; V298-V337 HydrophobicContact CG2-CG1 3.78Å; V298-V337 HydrophobicContact CG2-CG2 3.77Å; M334-V337 HydrophobicContact CB-CB 3.89Å; M334-V337 HydrophobicContact CB-CG2 4.01Å; M334-V337 HydrophobicContact SD-CB 4.17Å; M334-V337 HydrophobicContact SD-CG2 3.82Å; V337-V339 HydrophobicContact CG1-CG2 4.06Å
338	E	91.5	Very high	90.8	Very high	13 Å²	13	36.3 Å²	36.3	6%	0.061	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130	177.1	178.9	171.6	-149.2	0	0	109.4	W269 Q270 K271 A274 V276 Q277 G278	W269-E338 HydrophobicContact CE3-CG 3.96Å; W269-E338 HydrophobicContact CZ3-CG 3.93Å; Q270-E338 WeakPolarHBondContact CA-OE1 3.37Å; K271-E338 HydrophobicContact CB-CB 4.28Å; K271-E338 HydrophobicContact CB-CG 4.48Å; K271-E338 PolarHBondContact N-OE1 2.85Å; A274-E338 HydrophobicContact CB-CB 3.59Å; V276-E338 PolarHBondContact O-N 3.31Å; Q277-E338 CarbonylContact C-O 3.42Å; Q277-E338 VanDerWaalsContact CA-O 3.32Å; Q277-E338 WeakPolarHBondContact CA-O 3.17Å; Q277-E338 HydrophobicContact CG-CB 4.25Å; Q277-E338 WeakPolarHBondContact CG-OE2 3.42Å; Q277-E338 PolarHBondContact NE2-OE2 3.07Å; G278-E338 PolarHBondContact N-O 3.4Å
339	V	91.8	Very high	90.6	Very high	9 Å²	9	36.7 Å²	36.7	6%	0.055	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	121.3	178.2	-178.2	0	0	0	0	109.4	G278 V290 I292 M328 L331 V337 P341	G278-V339 CarbonylContact O-C 3.58Å; G278-V339 WeakPolarHBondContact O-CA 3.47Å; V290-V339 HydrophobicContact CG1-CG1 4.02Å; I292-V339 HydrophobicContact CD1-CG2 3.89Å; M328-V339 HydrophobicContact CE-CB 4.43Å; M328-V339 HydrophobicContact CE-CG1 4.47Å; L331-V339 HydrophobicContact CD1-CG2 4.16Å; V337-V339 HydrophobicContact CG1-CG2 4.06Å; V339-P341 WeakPolarHBondContact O-CD 3.38Å
340	E	93.3	Very high	90.6	Very high	54 Å²	54	33.7 Å²	33.7	25%	0.252	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	122.6	173.4	-173.7	-178	131.6	0	0	109.3	W269 G278 Q279 C280 R556	W269-E340 HydrophobicContact CH2-CB 3.85Å; W269-E340 HydrophobicContact CH2-CG 3.88Å; W269-E340 HydrophobicContact CZ2-CB 4.26Å; W269-E340 HydrophobicContact CZ2-CG 3.83Å; W269-E340 HydrophobicContact CZ3-CB 4Å; W269-E340 HydrophobicContact CZ3-CG 4.48Å; G278-E340 PolarHBondContact O-N 2.98Å; Q279-E340 HydrophobicContact CB-CB 3.92Å; C280-E340 WeakPolarHBondContact CB-O 3.5Å; C280-E340 PolarHBondContact N-O 2.77Å; E340-R556 IonicContact OE1-CZ 3.34Å; E340-R556 IonicContact OE1-NH1 3.51Å; E340-R556 PolarHBondContact OE1-NH1 3.24Å
341	P	94.3	Very high	90.4	Very high	6 Å²	6	31.1 Å²	31.1	4%	0.039	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-68	162.8	177.3	29.1	-35.6	0	0	0	111.4	L265 W269 Y324 M328 V339	L265-P341 WeakPolarHBondContact O-CG 3.44Å; W269-P341 HydrophobicContact CB-CG 4.42Å; W269-P341 VanDerWaalsContact CD1-CD 3.46Å; W269-P341 HydrophobicContact CD2-CG 4.46Å; W269-P341 HydrophobicContact CG-CG 3.94Å; Y324-P341 WeakPolarHBondContact OH-CA 3.47Å; Y324-P341 WeakPolarHBondContact OH-CB 3.19Å; M328-P341 HydrophobicContact CE-CB 4.17Å; V339-P341 WeakPolarHBondContact O-CD 3.38Å
342	L	94.9	Very high	90	Very high	0 Å²	0	33 Å²	33	0%	0	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-55	137.4	170.2	-72.2	173.6	0	0	0	110.5	C280 L282 F288 L321 Y324 V346 I347 F354	C280-L342 HydrophobicContact CB-CD2 3.88Å; C280-L342 HydrophobicContact CB-CG 3.88Å; L282-L342 HydrophobicContact CB-CD2 4.48Å; F288-L342 HydrophobicContact CB-CD1 4.09Å; F288-L342 HydrophobicContact CB-CD2 4.18Å; F288-L342 HydrophobicContact CG-CD1 4.29Å; L321-L342 HydrophobicContact CD2-CD1 3.73Å; Y324-L342 HydrophobicContact CD2-CD1 3.78Å; Y324-L342 HydrophobicContact CD2-CG 4.19Å; Y324-L342 HydrophobicContact CE2-CB 4.13Å; Y324-L342 HydrophobicContact CE2-CD1 3.73Å; Y324-L342 HydrophobicContact CE2-CG 3.66Å; Y324-L342 HydrophobicContact CG-CD1 4.28Å; Y324-L342 PolarHBondContact OH-N 3.48Å; L342-V346 HydrophobicContact CB-CG1 4.32Å; L342-V346 HydrophobicContact CD1-CG1 4.42Å; L342-V346 HydrophobicContact CD2-CG1 4.43Å; L342-I347 HydrophobicContact CB-CD1 4.31Å; L342-I347 HydrophobicContact CB-CG1 4.04Å; L342-I347 WeakPolarHBondContact O-CD1 3.37Å; L342-F354 HydrophobicContact CD1-CE1 4.21Å; L342-F354 HydrophobicContact CD1-CZ 4.06Å
343	P	92.8	Very high	89.9	Confident	19 Å²	19	30.7 Å²	30.7	12%	0.123	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-54.7	147.1	-177.1	-29.4	35	0	0	0	113.2	A345 V346 I347 R556	P343-A345 PolarHBondContact O-N 2.88Å; P343-A345 VanDerWaalsContact O-N 3.08Å; P343-V346 HydrophobicContact CB-CB 4.47Å; P343-V346 HydrophobicContact CB-CG2 4.16Å; P343-V346 HydrophobicContact CG-CG2 4.22Å; P343-V346 WeakPolarHBondContact O-CA 3.38Å; P343-V346 WeakPolarHBondContact O-CB 3.36Å; P343-V346 PolarHBondContact O-N 2.98Å; P343-I347 PolarHBondContact O-N 2.89Å; P343-R556 HydrophobicContact CG-CG 3.99Å; P343-R556 VanDerWaalsContact CG-NE 3.28Å
344	R	92.2	Very high	89.8	Confident	111 Å²	111	28.1 Å²	28.1	42%	0.419	17%	0.171	S	C	.	.	H	α-helix	trans	-52.9	-36.4	179.2	-155.9	176.5	-168.2	75.6	1.3	112.6	L263 Q348	L263-R344 HydrophobicContact CD2-CG 3.55Å; L263-R344 PolarHBondContact O-NH1 2.86Å; L263-R344 PolarHBondContact O-NH2 3.01Å; R344-Q348 WeakPolarHBondContact O-CB 3.37Å; R344-Q348 VanDerWaalsContact O-CG 3.29Å; R344-Q348 WeakPolarHBondContact O-CG 3.33Å; R344-Q348 PolarHBondContact O-N 3.25Å; R344-Q348 VanDerWaalsContact O-N 3.1Å
345	A	92.1	Very high	89.3	Confident	3 Å²	3	29.7 Å²	29.7	3%	0.025	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-42.6	173.7	0	0	0	0	0	113.5	P343 Q348 A349 L546 F547 L584	P343-A345 PolarHBondContact O-N 2.88Å; P343-A345 VanDerWaalsContact O-N 3.08Å; A345-Q348 PolarHBondContact O-N 3.35Å; A345-A349 VanDerWaalsContact O-CB 3.3Å; A345-A349 WeakPolarHBondContact O-CB 3.05Å; A345-A349 PolarHBondContact O-N 2.85Å; A345-L546 HydrophobicContact CB-CD1 3.69Å; A345-L546 HydrophobicContact CB-CG 3.95Å; A345-F547 HydrophobicContact CB-CE1 3.88Å; A345-F547 HydrophobicContact CB-CE2 4.19Å; A345-F547 HydrophobicContact CB-CZ 3.64Å; A345-L584 HydrophobicContact CB-CD1 4.39Å; A345-L584 HydrophobicContact CB-CD2 3.98Å
346	V	93.5	Very high	88.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.9	-47.2	178.2	171	0	0	0	0	110.5	L282 L342 P343 Q348 A349 F350 E580 L584	L282-V346 HydrophobicContact CB-CG1 4.2Å; L282-V346 HydrophobicContact CD1-CG1 4.18Å; L282-V346 HydrophobicContact CD2-CG1 4.13Å; L282-V346 HydrophobicContact CG-CG1 4.41Å; L342-V346 HydrophobicContact CB-CG1 4.32Å; L342-V346 HydrophobicContact CD1-CG1 4.42Å; L342-V346 HydrophobicContact CD2-CG1 4.43Å; P343-V346 HydrophobicContact CB-CB 4.47Å; P343-V346 HydrophobicContact CB-CG2 4.16Å; P343-V346 HydrophobicContact CG-CG2 4.22Å; P343-V346 WeakPolarHBondContact O-CA 3.38Å; P343-V346 WeakPolarHBondContact O-CB 3.36Å; P343-V346 PolarHBondContact O-N 2.98Å; V346-Q348 VanDerWaalsContact C-N 3.27Å; V346-Q348 PolarHBondContact O-N 3.22Å; V346-A349 PolarHBondContact O-N 3.03Å; V346-A349 VanDerWaalsContact O-N 3.17Å; V346-F350 HydrophobicContact CG1-CD2 4.11Å; V346-F350 PolarHBondContact O-N 2.82Å; V346-E580 HydrophobicContact CG2-CG 3.92Å; V346-L584 HydrophobicContact CG2-CD1 4.3Å; V346-L584 HydrophobicContact CG2-CD2 4.3Å
347	I	92.6	Very high	87.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.6	-37.7	177.7	-65.7	178.3	0	0	0	111.4	L259 L262 L263 Y324 L342 P343 A351 F354	L259-I347 HydrophobicContact CD1-CG2 3.88Å; L262-I347 HydrophobicContact CB-CG2 3.64Å; L262-I347 HydrophobicContact CD1-CG2 4.3Å; L263-I347 HydrophobicContact CD2-CB 4.19Å; L263-I347 HydrophobicContact CD2-CG2 3.79Å; L263-I347 HydrophobicContact CG-CG2 4.11Å; Y324-I347 HydrophobicContact CE1-CD1 4.08Å; L342-I347 HydrophobicContact CB-CD1 4.31Å; L342-I347 HydrophobicContact CB-CG1 4.04Å; L342-I347 WeakPolarHBondContact O-CD1 3.37Å; P343-I347 PolarHBondContact O-N 2.89Å; I347-A351 WeakPolarHBondContact O-CA 3.29Å; I347-A351 PolarHBondContact O-N 3.39Å; I347-F354 HydrophobicContact CG1-CZ 4.05Å
348	Q	90.6	Very high	85.6	Confident	84 Å²	84	34.2 Å²	34.2	39%	0.393	20%	0.199	S	C	.	.	H	α-helix	trans	-73.8	-34.2	175.4	-74.2	178	-16.5	0	0	113.9	L263 R344 A345 V346	L263-Q348 HydrophobicContact CD1-CG 4.38Å; L263-Q348 HydrophobicContact CD2-CG 4.04Å; R344-Q348 WeakPolarHBondContact O-CB 3.37Å; R344-Q348 VanDerWaalsContact O-CG 3.29Å; R344-Q348 WeakPolarHBondContact O-CG 3.33Å; R344-Q348 PolarHBondContact O-N 3.25Å; R344-Q348 VanDerWaalsContact O-N 3.1Å; A345-Q348 PolarHBondContact O-N 3.35Å; V346-Q348 VanDerWaalsContact C-N 3.27Å; V346-Q348 PolarHBondContact O-N 3.22Å
349	A	90.2	Very high	83.5	Confident	20 Å²	20	36.4 Å²	36.4	17%	0.165	22%	0.219	C	C	.	.	H	α-helix	trans	-72.6	-46.4	179.8	0	0	0	0	0	112	A345 V346 L584 E587 C588	A345-A349 VanDerWaalsContact O-CB 3.3Å; A345-A349 WeakPolarHBondContact O-CB 3.05Å; A345-A349 PolarHBondContact O-N 2.85Å; V346-A349 PolarHBondContact O-N 3.03Å; V346-A349 VanDerWaalsContact O-N 3.17Å; A349-L584 HydrophobicContact CB-CD1 3.52Å; A349-E587 HydrophobicContact CB-CG 4.35Å; A349-C588 VanDerWaalsContact CB-SG 3.58Å
350	F	91	Very high	81.2	Confident	7 Å²	7	44.9 Å²	44.9	3%	0.031	26%	0.255	C	S	.	.	S	Bend	trans	-98.5	23	-174.7	-64	-78.6	0	0	0	113.2	L282 R285 L321 V346 A352 S353 F354 L583 E587	L282-F350 HydrophobicContact CD2-CD2 3.7Å; L282-F350 HydrophobicContact CD2-CE2 3.34Å; L282-F350 HydrophobicContact CD2-CG 4.45Å; L282-F350 HydrophobicContact CD2-CZ 3.85Å; R285-F350 HydrophobicContact CB-CE1 4.33Å; R285-F350 HydrophobicContact CG-CE1 4.13Å; L321-F350 HydrophobicContact CD1-CB 4.29Å; V346-F350 HydrophobicContact CG1-CD2 4.11Å; V346-F350 PolarHBondContact O-N 2.82Å; F350-A352 PolarHBondContact O-N 3.26Å; F350-S353 WeakPolarHBondContact O-CB 3.26Å; F350-S353 PolarHBondContact O-N 3Å; F350-F354 HydrophobicContact CB-CE2 4.18Å; F350-F354 WeakPolarHBondContact O-CD2 3.38Å; F350-L583 HydrophobicContact CZ-CB 4.18Å; F350-E587 HydrophobicContact CD1-CG 4.32Å; F350-E587 HydrophobicContact CE1-CB 3.89Å; F350-E587 HydrophobicContact CE1-CG 3.82Å; F350-E587 HydrophobicContact CE2-CB 4.31Å; F350-E587 HydrophobicContact CZ-CB 3.61Å; F350-E587 HydrophobicContact CZ-CG 3.97Å
351	A	88.2	Confident	78.9	Confident	15 Å²	15	46.8 Å²	46.8	12%	0.124	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-34.3	-173.4	0	0	0	0	0	114.3	L259 I347	L259-A351 HydrophobicContact CD1-CB 4.06Å; L259-A351 HydrophobicContact CD2-CB 4.37Å; I347-A351 WeakPolarHBondContact O-CA 3.29Å; I347-A351 PolarHBondContact O-N 3.39Å
352	A	82.1	Confident	76.9	Confident	47 Å²	47	51 Å²	51	39%	0.388	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-39.2	175.9	0	0	0	0	0	113	F350 F354 N355	F350-A352 PolarHBondContact O-N 3.26Å; A352-F354 PolarHBondContact O-N 3.41Å; A352-N355 PolarHBondContact O-N 2.94Å; A352-N355 VanDerWaalsContact O-N 3.13Å
353	S	85.1	Confident	75.4	Confident	23 Å²	23	57.7 Å²	57.7	16%	0.161	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-64.5	-24.6	-178.1	-56.1	0	0	0	0	113.5	R285 F350 N355	R285-S353 WeakPolarHBondContact O-CB 3.47Å; R285-S353 PolarHBondContact O-OG 3.45Å; F350-S353 WeakPolarHBondContact O-CB 3.26Å; F350-S353 PolarHBondContact O-N 3Å; S353-N355 VanDerWaalsContact C-N 3.28Å; S353-N355 PolarHBondContact O-N 3.44Å
354	F	84	Confident	74.8	Confident	16 Å²	16	59.6 Å²	59.6	7%	0.07	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-72.8	-19.3	176.6	-67.1	-87.7	0	0	0	113.4	L262 L321 Y324 L342 I347 F350 A352	L262-F354 HydrophobicContact CD1-CB 3.67Å; L262-F354 HydrophobicContact CD1-CD1 3.91Å; L262-F354 HydrophobicContact CD1-CD2 4.02Å; L262-F354 HydrophobicContact CD1-CG 3.59Å; L262-F354 HydrophobicContact CD2-CD1 4.19Å; L321-F354 HydrophobicContact CB-CD1 4.01Å; L321-F354 HydrophobicContact CB-CE1 4.13Å; L321-F354 HydrophobicContact CB-CG 4.37Å; L321-F354 HydrophobicContact CD2-CD1 4.49Å; L321-F354 HydrophobicContact CD2-CE1 3.75Å; L321-F354 HydrophobicContact CD2-CZ 3.82Å; L321-F354 HydrophobicContact CG-CE1 4.45Å; L321-F354 VanDerWaalsContact O-CD1 3.25Å; L321-F354 WeakPolarHBondContact O-CD1 3.44Å; Y324-F354 HydrophobicContact CD1-CD1 4.03Å; Y324-F354 AromaticContact CD1-CE1 3.53Å; Y324-F354 HydrophobicContact CD1-CE1 3.53Å; Y324-F354 HydrophobicContact CE1-CE1 4.24Å; Y324-F354 HydrophobicContact CG-CD1 4.38Å; Y324-F354 AromaticContact CG-CE1 3.82Å; Y324-F354 HydrophobicContact CG-CE1 3.82Å; L342-F354 HydrophobicContact CD1-CE1 4.21Å; L342-F354 HydrophobicContact CD1-CZ 4.06Å; I347-F354 HydrophobicContact CG1-CZ 4.05Å; F350-F354 HydrophobicContact CB-CE2 4.18Å; F350-F354 WeakPolarHBondContact O-CD2 3.38Å; A352-F354 PolarHBondContact O-N 3.41Å
355	N	78.3	Confident	74.4	Confident	66 Å²	66	59 Å²	59	35%	0.353	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-96	11.1	-175.3	-70	-3.2	0	0	0	113.2	A352 S353 T357	A352-N355 PolarHBondContact O-N 2.94Å; A352-N355 VanDerWaalsContact O-N 3.13Å; S353-N355 VanDerWaalsContact C-N 3.28Å; S353-N355 PolarHBondContact O-N 3.44Å; N355-T357 PolarHBondContact O-N 2.93Å
356	G	66.2	Low	74.3	Confident	34 Å²	34	66.4 Å²	66.4	35%	0.351	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	-1.5	-174	0	0	0	0	0	114.5	V358	G356-V358 PolarHBondContact O-N 3.15Å
357	T	60.7	Low	74.2	Confident	95 Å²	95	66.8 Å²	66.8	58%	0.583	40%	0.399	S	S	*	.			trans	-73.7	80.6	169.7	-52.8	0	0	0	0	107.6	N355 A359	N355-T357 PolarHBondContact O-N 2.93Å; T357-A359 PolarHBondContact O-N 3.16Å
358	V	53.2	Low	74.2	Confident	97 Å²	97	71.7 Å²	71.7	59%	0.588	43%	0.425	S	S	*	.			trans	-57.9	104	171.1	179.4	0	0	0	0	107.2	G356 K360	G356-V358 PolarHBondContact O-N 3.15Å; V358-K360 PolarHBondContact O-N 3.42Å
359	A	45.9	Very low	74.3	Confident	59 Å²	59	69 Å²	69	49%	0.488	41%	0.413	S	S	.	.			trans	-62.5	93.2	161.2	0	0	0	0	0	106.8	T357 S361	T357-A359 PolarHBondContact O-N 3.16Å; A359-S361 PolarHBondContact O-N 3Å
360	K	43.3	Very low	74.4	Confident	186 Å²	186	72.7 Å²	72.7	81%	0.809	44%	0.438	S	S	*	.			trans	-41.5	130	143.9	-71.5	-176.4	176.7	-177.9	0	105.5	V358 S362	V358-K360 PolarHBondContact O-N 3.42Å; K360-S362 PolarHBondContact O-N 3.26Å
361	S	46.3	Very low	74.3	Confident	95 Å²	95	76.9 Å²	76.9	66%	0.664	47%	0.468	S	S	*	.			trans	-30.6	112.1	-175.2	43.4	0	0	0	0	110.1	A359 D363	A359-S361 PolarHBondContact O-N 3Å; S361-D363 VanDerWaalsContact C-N 3.26Å; S361-D363 PolarHBondContact O-N 3.43Å
362	S	51.9	Low	74.6	Confident	93 Å²	93	76.5 Å²	76.5	65%	0.65	46%	0.464	S	S	*	.			trans	-62	94.6	-175.7	-58.5	0	0	0	0	107.8	K360 V364	K360-S362 PolarHBondContact O-N 3.26Å; S362-V364 WeakPolarHBondContact O-CG2 3.5Å; S362-V364 PolarHBondContact O-N 3.32Å
363	D	63.8	Low	75.1	Confident	141 Å²	141	75.6 Å²	75.6	75%	0.754	45%	0.453	S	S	*	.			trans	-58.6	107	-172.5	-73	-37.7	0	0	0	107.1	S361 P365	S361-D363 VanDerWaalsContact C-N 3.26Å; S361-D363 PolarHBondContact O-N 3.43Å; D363-P365 WeakPolarHBondContact O-CD 3.36Å
364	V	79.1	Confident	75.5	Confident	60 Å²	60	78.9 Å²	78.9	36%	0.364	47%	0.474	S	S	.	.			trans	-67.5	113.4	-161.7	-176.4	0	0	0	0	106.9	S362 E366 N389	S362-V364 WeakPolarHBondContact O-CG2 3.5Å; S362-V364 PolarHBondContact O-N 3.32Å; V364-E366 PolarHBondContact O-N 3.39Å; V364-N389 HydrophobicContact CB-CB 4.47Å; V364-N389 VanDerWaalsContact CG1-C 3.43Å; V364-N389 HydrophobicContact CG1-CB 3.91Å; V364-N389 WeakPolarHBondContact CG1-O 3.49Å
365	P	85.3	Confident	75.9	Confident	98 Å²	98	81.8 Å²	81.8	64%	0.636	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-55	134.2	-167.3	-29.3	36.3	0	0	0	111.3	D363 A367	D363-P365 WeakPolarHBondContact O-CD 3.36Å; P365-A367 PolarHBondContact O-N 2.89Å
366	E	90	Very high	76.6	Confident	158 Å²	158	78.7 Å²	78.7	74%	0.738	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-62.8	126.2	179.8	-170.4	163.9	-155.2	0	0	109.5	V364	V364-E366 PolarHBondContact O-N 3.39Å
367	A	90.7	Very high	77.9	Confident	9 Å²	9	78.4 Å²	78.4	7%	0.074	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-75.4	135.9	-178.7	0	0	0	0	0	109.9	P365 L369 N389 V392 Y418	P365-A367 PolarHBondContact O-N 2.89Å; A367-L369 HydrophobicContact CB-CD2 3.81Å; A367-L369 WeakPolarHBondContact O-CG 3.41Å; A367-L369 PolarHBondContact O-N 3.12Å; A367-N389 PolarHBondContact N-OD1 3.39Å; A367-V392 HydrophobicContact CB-CB 4.06Å; A367-V392 HydrophobicContact CB-CG1 4.15Å; A367-V392 HydrophobicContact CB-CG2 3.82Å; A367-Y418 HydrophobicContact CB-CD2 4.47Å; A367-Y418 HydrophobicContact CB-CE2 4Å
368	D	92.9	Very high	79.4	Confident	103 Å²	103	78.3 Å²	78.3	55%	0.551	47%	0.471	S	S	*	.			trans	-69.6	100.9	172.8	178.4	14	0	0	0	110.4	S370 Y418	D368-S370 VanDerWaalsContact CG-OG 3.27Å; D368-S370 WeakPolarHBondContact OD1-CB 3.31Å; D368-S370 PolarHBondContact OD1-N 3.2Å; D368-S370 PolarHBondContact OD1-OG 3.04Å; D368-S370 PolarHBondContact OD2-OG 3.35Å; D368-Y418 WeakPolarHBondContact O-CE2 3.47Å
369	L	93.3	Very high	81.2	Confident	27 Å²	27	75.6 Å²	75.6	14%	0.141	46%	0.456	C	S	.	.			trans	-93.1	9.8	177.9	-47.6	-172.7	0	0	0	112.9	A367 S371 I372 T377 L380 V388 Y418	A367-L369 HydrophobicContact CB-CD2 3.81Å; A367-L369 WeakPolarHBondContact O-CG 3.41Å; A367-L369 PolarHBondContact O-N 3.12Å; L369-S371 PolarHBondContact O-N 3.25Å; L369-S371 VanDerWaalsContact O-N 3.17Å; L369-I372 HydrophobicContact CB-CD1 4.29Å; L369-I372 HydrophobicContact CD2-CD1 3.97Å; L369-I372 WeakPolarHBondContact O-CB 3.48Å; L369-I372 PolarHBondContact O-N 2.87Å; L369-T377 HydrophobicContact CB-CG2 3.71Å; L369-T377 HydrophobicContact CD1-CG2 4.18Å; L369-L380 HydrophobicContact CD1-CD1 4.43Å; L369-V388 HydrophobicContact CD1-CG1 4.45Å; L369-V388 HydrophobicContact CD2-CG1 3.77Å; L369-Y418 HydrophobicContact CD2-CD2 4.04Å
370	S	91.3	Very high	83.4	Confident	98 Å²	98	73.2 Å²	73.2	69%	0.685	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.1	-177.3	64.5	0	0	0	0	114.1	D368 I372	D368-S370 VanDerWaalsContact CG-OG 3.27Å; D368-S370 WeakPolarHBondContact OD1-CB 3.31Å; D368-S370 PolarHBondContact OD1-N 3.2Å; D368-S370 PolarHBondContact OD1-OG 3.04Å; D368-S370 PolarHBondContact OD2-OG 3.35Å; S370-I372 VanDerWaalsContact C-N 3.32Å
371	S	89.8	Confident	85.7	Confident	94 Å²	94	67.3 Å²	67.3	66%	0.657	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	0.9	177.6	59.7	0	0	0	0	114.6	L369	L369-S371 PolarHBondContact O-N 3.25Å; L369-S371 VanDerWaalsContact O-N 3.17Å
372	I	93.8	Very high	87.9	Confident	8 Å²	8	67.6 Å²	67.6	4%	0.041	41%	0.411	C	S	.	.	S	Bend	trans	-110.3	144	-176.4	-55.4	176.6	0	0	0	109.7	L369 S370 L376 T377 A417 L445	L369-I372 HydrophobicContact CB-CD1 4.29Å; L369-I372 HydrophobicContact CD2-CD1 3.97Å; L369-I372 WeakPolarHBondContact O-CB 3.48Å; L369-I372 PolarHBondContact O-N 2.87Å; S370-I372 VanDerWaalsContact C-N 3.32Å; I372-L376 HydrophobicContact CG2-CB 4.47Å; I372-L376 HydrophobicContact CG2-CD2 3.87Å; I372-L376 HydrophobicContact CG2-CG 4.33Å; I372-T377 HydrophobicContact CB-CG2 3.77Å; I372-T377 HydrophobicContact CG2-CG2 3.81Å; I372-A417 HydrophobicContact CD1-CB 4.2Å; I372-A417 HydrophobicContact CG1-CB 4.17Å; I372-A417 HydrophobicContact CG2-CB 4Å; I372-L445 HydrophobicContact CG2-CD2 4.22Å
373	D	93.1	Very high	89.7	Confident	27 Å²	27	63.9 Å²	63.9	14%	0.144	38%	0.383	C	S	.	.			trans	-47.6	122.4	-179.4	-78	-55	0	0	0	112.4	T375 L376 T377 L445 P446 S447	D373-T375 PolarHBondContact O-N 2.79Å; D373-T375 VanDerWaalsContact O-N 3.09Å; D373-L376 WeakPolarHBondContact O-CB 3.28Å; D373-L376 PolarHBondContact O-N 2.73Å; D373-T377 PolarHBondContact O-N 3.1Å; D373-L445 HydrophobicContact CB-CD2 4.27Å; D373-L445 WeakPolarHBondContact OD2-CA 3.44Å; D373-P446 HydrophobicContact CB-CG 4.31Å; D373-P446 WeakPolarHBondContact OD2-CD 3.38Å; D373-S447 VanDerWaalsContact CG-OG 3.26Å; D373-S447 VanDerWaalsContact OD1-CB 3.32Å; D373-S447 WeakPolarHBondContact OD1-CB 3.32Å; D373-S447 PolarHBondContact OD1-OG 3.36Å; D373-S447 WeakPolarHBondContact OD2-CB 3.29Å; D373-S447 PolarHBondContact OD2-N 3.48Å; D373-S447 PolarHBondContact OD2-OG 3.04Å
374	P	92.4	Very high	91.2	Very high	93 Å²	93	57.5 Å²	57.5	60%	0.604	35%	0.349	S	S	*	.	H	α-helix	trans	-56.4	-30.1	-177.1	-30.8	37	0	0	0	114.6	L376 T377 S378	P374-L376 PolarHBondContact O-N 2.88Å; P374-T377 PolarHBondContact O-N 3.43Å; P374-T377 PolarHBondContact O-OG1 3.25Å; P374-S378 VanDerWaalsContact O-CB 3.26Å; P374-S378 WeakPolarHBondContact O-CB 3.41Å; P374-S378 PolarHBondContact O-N 3.39Å; P374-S378 PolarHBondContact O-OG 2.67Å
375	T	92.4	Very high	91.9	Very high	77 Å²	77	58.1 Å²	58.1	47%	0.472	35%	0.346	S	S	.	.	H	α-helix	trans	-57.3	-32.7	174.1	-48.8	0	0	0	0	112.7	D373 S379	D373-T375 PolarHBondContact O-N 2.79Å; D373-T375 VanDerWaalsContact O-N 3.09Å; T375-S379 WeakPolarHBondContact O-CB 3.46Å; T375-S379 PolarHBondContact O-OG 2.98Å
376	L	93.5	Very high	92.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-81.5	-54.5	175	173.6	51	0	0	0	110.8	I372 D373 P374 S378 S379 L380 V410 I413 C414 W444 L445	I372-L376 HydrophobicContact CG2-CB 4.47Å; I372-L376 HydrophobicContact CG2-CD2 3.87Å; I372-L376 HydrophobicContact CG2-CG 4.33Å; D373-L376 WeakPolarHBondContact O-CB 3.28Å; D373-L376 PolarHBondContact O-N 2.73Å; P374-L376 PolarHBondContact O-N 2.88Å; L376-S378 VanDerWaalsContact C-N 3.32Å; L376-S378 PolarHBondContact O-N 2.79Å; L376-S379 PolarHBondContact O-N 2.92Å; L376-S379 PolarHBondContact O-OG 3.29Å; L376-L380 HydrophobicContact CD1-CD2 4.35Å; L376-L380 PolarHBondContact O-N 3.04Å; L376-V410 HydrophobicContact CD1-CG2 3.26Å; L376-I413 HydrophobicContact CD2-CG2 3.91Å; L376-C414 HydrophobicContact CD1-CB 4.33Å; L376-C414 HydrophobicContact CD2-CB 3.94Å; L376-C414 HydrophobicContact CG-CB 4.17Å; L376-W444 WeakPolarHBondContact CB-O 3.29Å; L376-W444 HydrophobicContact CD1-CB 4.23Å; L376-W444 HydrophobicContact CD1-CG 4.44Å; L376-W444 HydrophobicContact CD2-CB 4.48Å; L376-L445 HydrophobicContact CD2-CD2 3.69Å; L376-L445 HydrophobicContact CD2-CG 4.36Å
377	T	93.7	Very high	92.4	Very high	28 Å²	28	50.9 Å²	50.9	17%	0.172	30%	0.304	C	S	.	.	H	α-helix	trans	-66.8	-30.4	-170.9	62	0	0	0	0	113.5	L369 I372 D373 P374 K385	L369-T377 HydrophobicContact CB-CG2 3.71Å; L369-T377 HydrophobicContact CD1-CG2 4.18Å; I372-T377 HydrophobicContact CB-CG2 3.77Å; I372-T377 HydrophobicContact CG2-CG2 3.81Å; D373-T377 PolarHBondContact O-N 3.1Å; P374-T377 PolarHBondContact O-N 3.43Å; P374-T377 PolarHBondContact O-OG1 3.25Å; T377-K385 WeakPolarHBondContact O-CE 3.38Å
378	S	91.9	Very high	92.7	Very high	93 Å²	93	50.5 Å²	50.5	65%	0.65	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-23.4	172	62.4	0	0	0	0	113.9	P374 L376	P374-S378 VanDerWaalsContact O-CB 3.26Å; P374-S378 WeakPolarHBondContact O-CB 3.41Å; P374-S378 PolarHBondContact O-N 3.39Å; P374-S378 PolarHBondContact O-OG 2.67Å; L376-S378 VanDerWaalsContact C-N 3.32Å; L376-S378 PolarHBondContact O-N 2.79Å
379	S	91.3	Very high	92.8	Very high	41 Å²	41	46.3 Å²	46.3	29%	0.287	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-16.4	-179.1	76.5	0	0	0	0	114.5	T375 L376 M381 W444	T375-S379 WeakPolarHBondContact O-CB 3.46Å; T375-S379 PolarHBondContact O-OG 2.98Å; L376-S379 PolarHBondContact O-N 2.92Å; L376-S379 PolarHBondContact O-OG 3.29Å; S379-M381 PolarHBondContact O-N 2.9Å; S379-W444 VanDerWaalsContact OG-CZ3 3.27Å; S379-W444 WeakPolarHBondContact OG-CZ3 3.31Å
380	L	92.3	Very high	92.9	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.042	28%	0.277	C	S	.	.			trans	-70.7	122.2	-178.6	-65.7	174.4	0	0	0	111	L369 L376 Q384 K385 V388 V410 C414	L369-L380 HydrophobicContact CD1-CD1 4.43Å; L376-L380 HydrophobicContact CD1-CD2 4.35Å; L376-L380 PolarHBondContact O-N 3.04Å; L380-Q384 HydrophobicContact CB-CB 4.18Å; L380-Q384 HydrophobicContact CD2-CB 4.01Å; L380-K385 HydrophobicContact CB-CG 3.75Å; L380-K385 HydrophobicContact CD1-CG 4.34Å; L380-K385 WeakPolarHBondContact O-CE 3.42Å; L380-V388 HydrophobicContact CD1-CG2 4.13Å; L380-V410 HydrophobicContact CD2-CG1 4.19Å; L380-V410 HydrophobicContact CD2-CG2 4.05Å; L380-C414 HydrophobicContact CD1-CB 4.2Å
381	M	91.3	Very high	93.1	Very high	63 Å²	63	41.6 Å²	41.6	31%	0.31	24%	0.244	S	C	.	.			trans	-61.3	156.5	169.4	-65.9	-178.3	-77.7	0	0	110.8	S379 F383 Q384 K385	S379-M381 PolarHBondContact O-N 2.9Å; M381-F383 HydrophobicContact CB-CD1 4.03Å; M381-F383 HydrophobicContact CB-CE1 3.85Å; M381-F383 HydrophobicContact CE-CE1 3.66Å; M381-F383 HydrophobicContact CE-CZ 3.59Å; M381-F383 HydrophobicContact CG-CE1 4.48Å; M381-F383 PolarHBondContact O-N 2.92Å; M381-F383 HydrophobicContact SD-CE1 3.86Å; M381-F383 HydrophobicContact SD-CZ 4.41Å; M381-Q384 HydrophobicContact CB-CG 4.13Å; M381-Q384 HydrophobicContact CE-CG 4.33Å; M381-Q384 VanDerWaalsContact CE-NE2 3.32Å; M381-Q384 WeakPolarHBondContact O-CA 3.31Å; M381-Q384 VanDerWaalsContact O-CB 3.28Å; M381-Q384 WeakPolarHBondContact O-CB 3.49Å; M381-Q384 PolarHBondContact O-N 2.95Å; M381-K385 PolarHBondContact O-N 2.62Å; M381-K385 VanDerWaalsContact O-N 3.12Å
382	P	91.3	Very high	93.3	Very high	101 Å²	101	38.3 Å²	38.3	66%	0.656	22%	0.22	S	C	*	.	H	α-helix	trans	-51.2	-49	-175.5	-29.9	36.4	0	0	0	114	Q384 K385 E386	P382-Q384 PolarHBondContact O-N 2.91Å; P382-K385 WeakPolarHBondContact O-CB 3.29Å; P382-K385 PolarHBondContact O-N 3.08Å; P382-E386 PolarHBondContact O-N 3.28Å; P382-E386 VanDerWaalsContact O-N 3.1Å
383	F	91.7	Very high	93.3	Very high	15 Å²	15	40.7 Å²	40.7	7%	0.066	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-30.7	175.8	77.5	-95.3	0	0	0	113.1	M381 K385 E386 G387 L406 R593 V598	M381-F383 HydrophobicContact CB-CD1 4.03Å; M381-F383 HydrophobicContact CB-CE1 3.85Å; M381-F383 HydrophobicContact CE-CE1 3.66Å; M381-F383 HydrophobicContact CE-CZ 3.59Å; M381-F383 HydrophobicContact CG-CE1 4.48Å; M381-F383 PolarHBondContact O-N 2.92Å; M381-F383 HydrophobicContact SD-CE1 3.86Å; M381-F383 HydrophobicContact SD-CZ 4.41Å; F383-K385 VanDerWaalsContact C-N 3.32Å; F383-K385 PolarHBondContact O-N 3.35Å; F383-E386 WeakPolarHBondContact O-CB 3.29Å; F383-E386 PolarHBondContact O-N 3.04Å; F383-G387 PolarHBondContact O-N 2.76Å; F383-L406 HydrophobicContact CE2-CB 4.02Å; F383-L406 HydrophobicContact CZ-CB 4.19Å; F383-L406 HydrophobicContact CZ-CD2 4.28Å; F383-R593 VanDerWaalsContact O-CZ 3.31Å; F383-R593 PolarHBondContact O-NH1 3.16Å; F383-R593 PolarHBondContact O-NH2 3.26Å; F383-V598 HydrophobicContact CB-CG1 3.92Å; F383-V598 HydrophobicContact CD1-CB 3.81Å; F383-V598 HydrophobicContact CD1-CG1 4.06Å; F383-V598 HydrophobicContact CD1-CG2 4.26Å; F383-V598 HydrophobicContact CD2-CG1 4.29Å; F383-V598 HydrophobicContact CD2-CG2 4.47Å; F383-V598 HydrophobicContact CE1-CB 4.04Å; F383-V598 HydrophobicContact CE1-CG2 4.07Å; F383-V598 HydrophobicContact CE2-CG2 4.3Å; F383-V598 HydrophobicContact CG-CB 4.08Å; F383-V598 HydrophobicContact CG-CG1 3.84Å; F383-V598 HydrophobicContact CG-CG2 4.46Å; F383-V598 HydrophobicContact CZ-CG2 4.09Å
384	Q	94.1	Very high	93.3	Very high	6 Å²	6	42 Å²	42	3%	0.028	24%	0.242	C	C	.	.	H	α-helix	trans	-69.5	-33.2	176.2	-62.5	-179.7	-34.7	0	0	111.3	L380 M381 P382 G387 V388 L406 Q411	L380-Q384 HydrophobicContact CB-CB 4.18Å; L380-Q384 HydrophobicContact CD2-CB 4.01Å; M381-Q384 HydrophobicContact CB-CG 4.13Å; M381-Q384 HydrophobicContact CE-CG 4.33Å; M381-Q384 VanDerWaalsContact CE-NE2 3.32Å; M381-Q384 WeakPolarHBondContact O-CA 3.31Å; M381-Q384 VanDerWaalsContact O-CB 3.28Å; M381-Q384 WeakPolarHBondContact O-CB 3.49Å; M381-Q384 PolarHBondContact O-N 2.95Å; P382-Q384 PolarHBondContact O-N 2.91Å; Q384-G387 PolarHBondContact O-N 2.88Å; Q384-V388 WeakPolarHBondContact O-CG2 3.4Å; Q384-V388 PolarHBondContact O-N 3.29Å; Q384-V388 VanDerWaalsContact O-N 3.12Å; Q384-L406 PolarHBondContact NE2-O 3.38Å; Q384-Q411 HydrophobicContact CB-CG 3.68Å; Q384-Q411 HydrophobicContact CG-CG 3.9Å
385	K	93.7	Very high	93.4	Very high	73 Å²	73	44 Å²	44	32%	0.317	24%	0.243	S	C	.	.	H	α-helix	trans	-67.7	-44.5	172.4	-60.4	-173.3	177.6	-171.6	0	111.9	T377 L380 M381 P382 F383 G387 V388 N389	T377-K385 WeakPolarHBondContact O-CE 3.38Å; L380-K385 HydrophobicContact CB-CG 3.75Å; L380-K385 HydrophobicContact CD1-CG 4.34Å; L380-K385 WeakPolarHBondContact O-CE 3.42Å; M381-K385 PolarHBondContact O-N 2.62Å; M381-K385 VanDerWaalsContact O-N 3.12Å; P382-K385 WeakPolarHBondContact O-CB 3.29Å; P382-K385 PolarHBondContact O-N 3.08Å; F383-K385 VanDerWaalsContact C-N 3.32Å; F383-K385 PolarHBondContact O-N 3.35Å; K385-G387 PolarHBondContact O-N 3.28Å; K385-V388 PolarHBondContact O-N 2.71Å; K385-N389 VanDerWaalsContact O-CG 3.28Å; K385-N389 PolarHBondContact O-N 3.15Å; K385-N389 PolarHBondContact O-OD1 3.02Å
386	E	92.6	Very high	93.6	Very high	105 Å²	105	40.3 Å²	40.3	49%	0.491	22%	0.221	S	C	.	.	H	α-helix	trans	-53.4	-38	170.4	-62.6	158.4	-157	0	0	111.9	P382 F383 N389 F390 R593	P382-E386 PolarHBondContact O-N 3.28Å; P382-E386 VanDerWaalsContact O-N 3.1Å; F383-E386 WeakPolarHBondContact O-CB 3.29Å; F383-E386 PolarHBondContact O-N 3.04Å; E386-N389 PolarHBondContact O-N 2.99Å; E386-F390 WeakPolarHBondContact O-CB 3.07Å; E386-F390 PolarHBondContact O-N 3.32Å; E386-R593 IonicContact OE2-NH1 2.74Å; E386-R593 PolarHBondContact OE2-NH1 3.48Å
387	G	94.3	Very high	93.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.4	-35.8	177.5	0	0	0	0	0	113.8	F383 Q384 K385 A391 L591	F383-G387 PolarHBondContact O-N 2.76Å; Q384-G387 PolarHBondContact O-N 2.88Å; K385-G387 PolarHBondContact O-N 3.28Å; G387-A391 WeakPolarHBondContact O-CB 3.48Å; G387-A391 PolarHBondContact O-N 3.38Å; G387-L591 VanDerWaalsContact CA-CD2 3.47Å
388	V	96.3	Very high	93.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-67.3	-46.4	170.4	-180	0	0	0	0	110.5	L369 L380 Q384 K385 F390 A391 V392 C414 I415	L369-V388 HydrophobicContact CD1-CG1 4.45Å; L369-V388 HydrophobicContact CD2-CG1 3.77Å; L380-V388 HydrophobicContact CD1-CG2 4.13Å; Q384-V388 WeakPolarHBondContact O-CG2 3.4Å; Q384-V388 PolarHBondContact O-N 3.29Å; Q384-V388 VanDerWaalsContact O-N 3.12Å; K385-V388 PolarHBondContact O-N 2.71Å; V388-F390 VanDerWaalsContact C-N 3.34Å; V388-F390 PolarHBondContact O-N 2.67Å; V388-A391 WeakPolarHBondContact O-CB 3.48Å; V388-A391 PolarHBondContact O-N 3.38Å; V388-A391 VanDerWaalsContact O-N 3.17Å; V388-V392 HydrophobicContact CG1-CG2 4.47Å; V388-V392 WeakPolarHBondContact O-CG2 3.11Å; V388-V392 PolarHBondContact O-N 2.86Å; V388-C414 HydrophobicContact CG2-CB 3.96Å; V388-I415 HydrophobicContact CB-CG1 4.39Å; V388-I415 HydrophobicContact CG1-CG1 4.32Å; V388-I415 HydrophobicContact CG2-CG1 4.11Å
389	N	95	Very high	94.2	Very high	16 Å²	16	37 Å²	37	9%	0.086	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-45.1	177.4	-62.5	-10.5	0	0	0	111.1	V364 A367 K385 E386 A391 V392 S393	V364-N389 HydrophobicContact CB-CB 4.47Å; V364-N389 VanDerWaalsContact CG1-C 3.43Å; V364-N389 HydrophobicContact CG1-CB 3.91Å; V364-N389 WeakPolarHBondContact CG1-O 3.49Å; A367-N389 PolarHBondContact N-OD1 3.39Å; K385-N389 VanDerWaalsContact O-CG 3.28Å; K385-N389 PolarHBondContact O-N 3.15Å; K385-N389 PolarHBondContact O-OD1 3.02Å; E386-N389 PolarHBondContact O-N 2.99Å; N389-A391 PolarHBondContact O-N 2.77Å; N389-V392 PolarHBondContact O-N 2.97Å; N389-S393 WeakPolarHBondContact O-CB 3.42Å; N389-S393 PolarHBondContact O-N 2.9Å
390	F	94.4	Very high	94.5	Very high	25 Å²	25	35 Å²	35	11%	0.11	18%	0.177	C	C	.	.	H	α-helix	trans	-59.2	-48.3	174.9	-178.8	-93.4	0	0	0	111.2	E386 V388 V392 S393 K394 L398 L591	E386-F390 WeakPolarHBondContact O-CB 3.07Å; E386-F390 PolarHBondContact O-N 3.32Å; V388-F390 VanDerWaalsContact C-N 3.34Å; V388-F390 PolarHBondContact O-N 2.67Å; F390-V392 VanDerWaalsContact C-N 3.32Å; F390-V392 PolarHBondContact O-N 3.16Å; F390-S393 PolarHBondContact O-N 3.28Å; F390-S393 PolarHBondContact O-OG 3.5Å; F390-K394 HydrophobicContact CD1-CG 4.22Å; F390-K394 HydrophobicContact CE1-CG 3.91Å; F390-K394 VanDerWaalsContact CE2-CE 3.45Å; F390-K394 HydrophobicContact CE2-CG 4.33Å; F390-K394 HydrophobicContact CZ-CD 4.38Å; F390-K394 HydrophobicContact CZ-CG 3.99Å; F390-K394 WeakPolarHBondContact O-CG 3.46Å; F390-K394 PolarHBondContact O-N 2.92Å; F390-L398 HydrophobicContact CD1-CD1 4.08Å; F390-L398 HydrophobicContact CE1-CB 4.41Å; F390-L398 HydrophobicContact CE1-CD1 4.47Å; F390-L591 HydrophobicContact CB-CD2 4.15Å; F390-L591 HydrophobicContact CD1-CB 3.87Å; F390-L591 HydrophobicContact CD1-CD2 4.23Å; F390-L591 HydrophobicContact CE1-CB 3.86Å; F390-L591 HydrophobicContact CG-CB 4.48Å; F390-L591 HydrophobicContact CG-CD2 4.28Å; F390-L591 HydrophobicContact CZ-CB 4.44Å
391	A	96	Very high	94.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.6	-42.2	177.3	0	0	0	0	0	112.7	G387 V388 N389 K394 Q395 G396 L398 I415	G387-A391 WeakPolarHBondContact O-CB 3.48Å; G387-A391 PolarHBondContact O-N 3.38Å; V388-A391 WeakPolarHBondContact O-CB 3.48Å; V388-A391 PolarHBondContact O-N 3.38Å; V388-A391 VanDerWaalsContact O-N 3.17Å; N389-A391 PolarHBondContact O-N 2.77Å; A391-K394 CarbonylContact O-C 3.59Å; A391-K394 PolarHBondContact O-N 3.48Å; A391-Q395 PolarHBondContact O-N 3.49Å; A391-G396 WeakPolarHBondContact O-CA 3.22Å; A391-G396 PolarHBondContact O-N 2.62Å; A391-L398 HydrophobicContact CB-CD1 3.61Å; A391-L398 HydrophobicContact CB-CD2 3.65Å; A391-L398 HydrophobicContact CB-CG 4.26Å; A391-I415 HydrophobicContact CB-CB 4.32Å; A391-I415 HydrophobicContact CB-CD1 3.47Å; A391-I415 VanDerWaalsContact CB-CD1 3.47Å; A391-I415 HydrophobicContact CB-CG1 3.62Å; A391-I415 HydrophobicContact CB-CG2 3.66Å
392	V	95.2	Very high	94.7	Very high	25 Å²	25	31.7 Å²	31.7	15%	0.152	16%	0.161	C	C	.	.	H	α-helix	trans	-66.4	-42.2	176.9	171.8	0	0	0	0	111.1	A367 V388 N389 F390 K394 Q395 Y418	A367-V392 HydrophobicContact CB-CB 4.06Å; A367-V392 HydrophobicContact CB-CG1 4.15Å; A367-V392 HydrophobicContact CB-CG2 3.82Å; V388-V392 HydrophobicContact CG1-CG2 4.47Å; V388-V392 WeakPolarHBondContact O-CG2 3.11Å; V388-V392 PolarHBondContact O-N 2.86Å; N389-V392 PolarHBondContact O-N 2.97Å; F390-V392 VanDerWaalsContact C-N 3.32Å; F390-V392 PolarHBondContact O-N 3.16Å; V392-K394 VanDerWaalsContact C-N 3.28Å; V392-K394 PolarHBondContact O-N 3.31Å; V392-Q395 WeakPolarHBondContact O-CA 3.44Å; V392-Q395 PolarHBondContact O-N 3.38Å; V392-Y418 HydrophobicContact CB-CE1 4.42Å; V392-Y418 HydrophobicContact CG1-CE1 3.76Å; V392-Y418 HydrophobicContact CG1-CE2 4.39Å; V392-Y418 HydrophobicContact CG2-CD1 3.72Å; V392-Y418 HydrophobicContact CG2-CD2 4.07Å; V392-Y418 HydrophobicContact CG2-CE1 3.76Å; V392-Y418 HydrophobicContact CG2-CE2 4.1Å; V392-Y418 HydrophobicContact CG2-CG 3.89Å
393	S	92.9	Very high	94.5	Very high	58 Å²	58	27.2 Å²	27.2	41%	0.406	13%	0.132	S	C	.	.	H	α-helix	trans	-61.3	-35	175.2	82.4	0	0	0	0	112.9	N389 F390 Q395	N389-S393 WeakPolarHBondContact O-CB 3.42Å; N389-S393 PolarHBondContact O-N 2.9Å; F390-S393 PolarHBondContact O-N 3.28Å; F390-S393 PolarHBondContact O-OG 3.5Å; S393-Q395 PolarHBondContact O-N 2.87Å
394	K	93.1	Very high	94.2	Very high	54 Å²	54	26.8 Å²	26.8	24%	0.235	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	21.8	173.5	-51.8	-65.6	175.5	175.5	0	112.2	F390 A391 V392 G396 R397 E587	F390-K394 HydrophobicContact CD1-CG 4.22Å; F390-K394 HydrophobicContact CE1-CG 3.91Å; F390-K394 VanDerWaalsContact CE2-CE 3.45Å; F390-K394 HydrophobicContact CE2-CG 4.33Å; F390-K394 HydrophobicContact CZ-CD 4.38Å; F390-K394 HydrophobicContact CZ-CG 3.99Å; F390-K394 WeakPolarHBondContact O-CG 3.46Å; F390-K394 PolarHBondContact O-N 2.92Å; A391-K394 CarbonylContact O-C 3.59Å; A391-K394 PolarHBondContact O-N 3.48Å; V392-K394 VanDerWaalsContact C-N 3.28Å; V392-K394 PolarHBondContact O-N 3.31Å; K394-G396 VanDerWaalsContact C-N 3.26Å; K394-G396 PolarHBondContact O-N 2.73Å; K394-R397 PolarHBondContact O-N 3.27Å; K394-E587 PolarHBondContact NZ-O 3.18Å; K394-E587 IonicContact NZ-OE1 2.73Å
395	Q	95.1	Very high	93.7	Very high	135 Å²	135	28.1 Å²	28.1	63%	0.631	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	55	33.6	174.5	-58	-175.3	-2	0	0	114.6	A391 V392 S393 R397 R519	A391-Q395 PolarHBondContact O-N 3.49Å; V392-Q395 WeakPolarHBondContact O-CA 3.44Å; V392-Q395 PolarHBondContact O-N 3.38Å; S393-Q395 PolarHBondContact O-N 2.87Å; Q395-R397 PolarHBondContact O-N 2.74Å; Q395-R519 WeakPolarHBondContact O-CD 3.23Å; Q395-R519 PolarHBondContact O-NH1 3.45Å
396	G	95.3	Very high	93.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	18.3	-177	0	0	0	0	0	113.9	A391 K394 Y419 R519 V520	A391-G396 WeakPolarHBondContact O-CA 3.22Å; A391-G396 PolarHBondContact O-N 2.62Å; K394-G396 VanDerWaalsContact C-N 3.26Å; K394-G396 PolarHBondContact O-N 2.73Å; G396-Y419 PolarHBondContact N-OH 3.21Å; G396-R519 CarbonylContact O-C 3.58Å; G396-R519 WeakPolarHBondContact O-CA 3.39Å; G396-V520 CarbonylContact O-C 3.57Å; G396-V520 PolarHBondContact O-N 3.1Å
397	R	96.8	Very high	93.2	Very high	50 Å²	50	20.8 Å²	20.8	19%	0.189	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	97.6	173.5	-60.9	-164	78.2	93	-1.5	109.7	K394 Q395 L514 A517 K518 V520 S541 V542	K394-R397 PolarHBondContact O-N 3.27Å; Q395-R397 PolarHBondContact O-N 2.74Å; R397-L514 PolarHBondContact NH2-O 2.68Å; R397-A517 PolarHBondContact NH1-O 2.87Å; R397-K518 WeakPolarHBondContact CD-O 3.3Å; R397-K518 WeakPolarHBondContact CG-O 3.43Å; R397-K518 PolarHBondContact NH1-O 2.68Å; R397-V520 CarbonylContact C-O 3.56Å; R397-V520 VanDerWaalsContact CA-O 3.32Å; R397-V520 WeakPolarHBondContact CA-O 3.25Å; R397-S541 PolarHBondContact NH2-O 3.38Å; R397-V542 VanDerWaalsContact C-CG1 3.4Å; R397-V542 HydrophobicContact CB-CG1 4Å; R397-V542 PolarHBondContact NE-O 3.09Å; R397-V542 WeakPolarHBondContact O-CG1 3.39Å
398	L	97.4	Very high	93.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	165	-177.9	76.4	163	0	0	0	113.9	F390 A391 L400 V520 I521 L522 L589	F390-L398 HydrophobicContact CD1-CD1 4.08Å; F390-L398 HydrophobicContact CE1-CB 4.41Å; F390-L398 HydrophobicContact CE1-CD1 4.47Å; A391-L398 HydrophobicContact CB-CD1 3.61Å; A391-L398 HydrophobicContact CB-CD2 3.65Å; A391-L398 HydrophobicContact CB-CG 4.26Å; L398-L400 HydrophobicContact CD1-CB 4.35Å; L398-V520 PolarHBondContact N-O 2.95Å; L398-I521 HydrophobicContact CD2-CB 4.46Å; L398-I521 HydrophobicContact CD2-CG1 4.18Å; L398-I521 HydrophobicContact CD2-CG2 4.28Å; L398-L522 PolarHBondContact O-N 3.36Å; L398-L589 CarbonylContact C-O 3.5Å; L398-L589 WeakPolarHBondContact CA-O 3.36Å
399	L	97.8	Very high	93.2	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	104.7	161.4	173.1	62.4	0	0	0	108.7	A401 L522 P527 L589 M590 L591	L399-A401 HydrophobicContact CG-CB 4.27Å; L399-A401 PolarHBondContact O-N 2.93Å; L399-L522 CarbonylContact C-O 3.59Å; L399-L522 WeakPolarHBondContact CA-O 3.42Å; L399-L522 HydrophobicContact CB-CB 4.35Å; L399-L522 HydrophobicContact CD1-CB 3.61Å; L399-L522 HydrophobicContact CD1-CD1 4.44Å; L399-P527 HydrophobicContact CD1-CB 4.4Å; L399-P527 HydrophobicContact CD2-CB 3.88Å; L399-L589 HydrophobicContact CB-CD1 3.93Å; L399-L589 HydrophobicContact CD2-CD1 4.3Å; L399-L589 PolarHBondContact N-O 3.12Å; L399-M590 HydrophobicContact CD2-CG 4.09Å; L399-M590 HydrophobicContact CD2-SD 4.1Å; L399-M590 HydrophobicContact CG-CG 4.24Å; L399-M590 WeakPolarHBondContact O-CA 3.38Å; L399-L591 PolarHBondContact O-N 3.46Å
400	L	97.1	Very high	93.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	94.7	170.6	-172.4	63.7	0	0	0	108.3	L398 D402 K408 Q411 L522 L523 S524 L591	L398-L400 HydrophobicContact CD1-CB 4.35Å; L400-D402 HydrophobicContact CD1-CB 4.5Å; L400-K408 HydrophobicContact CD2-CB 4.09Å; L400-K408 HydrophobicContact CD2-CD 4.44Å; L400-K408 HydrophobicContact CD2-CG 3.95Å; L400-K408 HydrophobicContact CG-CD 4.14Å; L400-K408 HydrophobicContact CG-CG 4.08Å; L400-K408 WeakPolarHBondContact O-CD 3.38Å; L400-Q411 HydrophobicContact CD2-CB 3.73Å; L400-Q411 HydrophobicContact CD2-CG 4.39Å; L400-L522 PolarHBondContact N-O 2.8Å; L400-L523 HydrophobicContact CB-CD2 3.84Å; L400-L523 HydrophobicContact CD2-CD2 4.06Å; L400-L523 HydrophobicContact CG-CD2 4.5Å; L400-S524 PolarHBondContact O-N 2.87Å; L400-L591 HydrophobicContact CD1-CB 4.22Å; L400-L591 HydrophobicContact CD1-CD2 3.95Å; L400-L591 HydrophobicContact CD1-CG 4.29Å
401	A	95.3	Very high	93.3	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.133	C	C	.	.			trans	-95.1	2.1	-174.8	0	0	0	0	0	113.9	L399 S524 P527 M590 L591 R592	L399-A401 HydrophobicContact CG-CB 4.27Å; L399-A401 PolarHBondContact O-N 2.93Å; A401-S524 CarbonylContact C-O 3.53Å; A401-S524 WeakPolarHBondContact CA-O 3.41Å; A401-P527 HydrophobicContact CB-CG 4.01Å; A401-M590 HydrophobicContact CB-CG 3.67Å; A401-M590 HydrophobicContact CB-SD 3.88Å; A401-L591 WeakPolarHBondContact CA-O 3.36Å; A401-L591 WeakPolarHBondContact CB-O 3.31Å; A401-L591 PolarHBondContact N-O 3.44Å; A401-R592 HydrophobicContact CB-CB 4.16Å; A401-R592 WeakPolarHBondContact O-CD 3.5Å; A401-R592 PolarHBondContact O-NE 2.99Å; A401-R592 PolarHBondContact O-NH1 2.72Å
402	D	92.9	Very high	93.3	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.133	C	C	.	.			trans	-36	147.9	174.4	-80.6	-12.5	0	0	0	113.5	L400 L406 K408 Q411 L591 R593	L400-D402 HydrophobicContact CD1-CB 4.5Å; D402-L406 HydrophobicContact CB-CB 4.32Å; D402-L406 HydrophobicContact CB-CD1 4.22Å; D402-K408 HydrophobicContact CB-CD 4.15Å; D402-K408 HydrophobicContact CB-CG 3.93Å; D402-K408 PolarHBondContact O-NZ 3.17Å; D402-Q411 PolarHBondContact OD2-NE2 3.42Å; D402-L591 PolarHBondContact N-O 3.43Å; D402-R593 IonicContact OD1-CZ 2.68Å; D402-R593 PolarHBondContact OD1-N 3.16Å; D402-R593 VanDerWaalsContact OD1-N 3.16Å; D402-R593 IonicContact OD1-NE 2.69Å; D402-R593 PolarHBondContact OD1-NE 2.84Å; D402-R593 IonicContact OD1-NH2 3.27Å; D402-R593 PolarHBondContact OD1-NH2 3.01Å; D402-R593 IonicContact OD2-CZ 2.81Å; D402-R593 IonicContact OD2-NE 3.39Å; D402-R593 IonicContact OD2-NH2 3.15Å; D402-R593 PolarHBondContact OD2-NH2 2.68Å
403	D	88.4	Confident	93.5	Very high	8 Å²	8	21.8 Å²	21.8	4%	0.043	13%	0.125	C	C	.	.			trans	-53.2	163	178.3	-93.4	11.2	0	0	0	115.1	G405 L406 K408 R592 R593 L594 K595	D403-G405 PolarHBondContact O-N 3.25Å; D403-L406 HydrophobicContact CB-CD1 3.77Å; D403-L406 HydrophobicContact CB-CG 3.95Å; D403-L406 PolarHBondContact O-N 3.5Å; D403-K408 PolarHBondContact O-NZ 3.02Å; D403-R592 IonicContact OD1-CZ 3.15Å; D403-R592 IonicContact OD1-NE 2.85Å; D403-R592 PolarHBondContact OD1-NE 3.37Å; D403-R592 IonicContact OD1-NH1 2.7Å; D403-R592 IonicContact OD1-NH2 2.68Å; D403-R592 PolarHBondContact OD1-NH2 3.13Å; D403-R593 PolarHBondContact N-O 3.29Å; D403-L594 WeakPolarHBondContact OD2-CA 3.47Å; D403-K595 HydrophobicContact CB-CD 4.46Å; D403-K595 HydrophobicContact CB-CG 3.92Å; D403-K595 PolarHBondContact OD2-N 3.33Å
404	M	85.6	Confident	93.7	Very high	6 Å²	6	19 Å²	19	3%	0.03	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	117.2	-177.9	-63.2	175.8	69.6	0	0	111.3	K595 Q761 D764	M404-K595 WeakPolarHBondContact O-CE 3.35Å; M404-K595 PolarHBondContact O-NZ 2.97Å; M404-Q761 HydrophobicContact CE-CB 3.86Å; M404-Q761 HydrophobicContact CE-CG 3.71Å; M404-Q761 HydrophobicContact SD-CB 4.09Å; M404-Q761 HydrophobicContact SD-CG 3.62Å; M404-D764 HydrophobicContact CB-CB 3.9Å; M404-D764 HydrophobicContact CE-CB 4.26Å; M404-D764 HydrophobicContact CG-CB 4.48Å; M404-D764 HydrophobicContact SD-CB 3.88Å
405	G	82.5	Confident	93.9	Very high	33 Å²	33	16.5 Å²	16.5	34%	0.34	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	105.6	-10.7	-177.1	0	0	0	0	0	114.6	D403 G407 I769	D403-G405 PolarHBondContact O-N 3.25Å; G405-G407 PolarHBondContact O-N 2.67Å; G405-I769 WeakPolarHBondContact O-CD1 3.29Å
406	L	87.8	Confident	94	Very high	1 Å²	1	10 Å²	10	1%	0.005	7%	0.065	C	C	.	.	S	Bend	trans	-72.4	18.6	176.9	-61.3	-170.9	0	0	0	114.8	F383 Q384 D402 D403 K595 V598 L599	F383-L406 HydrophobicContact CE2-CB 4.02Å; F383-L406 HydrophobicContact CZ-CB 4.19Å; F383-L406 HydrophobicContact CZ-CD2 4.28Å; Q384-L406 PolarHBondContact NE2-O 3.38Å; D402-L406 HydrophobicContact CB-CB 4.32Å; D402-L406 HydrophobicContact CB-CD1 4.22Å; D403-L406 HydrophobicContact CB-CD1 3.77Å; D403-L406 HydrophobicContact CB-CG 3.95Å; D403-L406 PolarHBondContact O-N 3.5Å; L406-K595 HydrophobicContact CD2-CG 4.13Å; L406-V598 HydrophobicContact CD1-CG2 3.66Å; L406-V598 HydrophobicContact CD2-CG2 3.68Å; L406-V598 HydrophobicContact CG-CG2 4.32Å; L406-L599 HydrophobicContact CD2-CD1 3.48Å; L406-L599 VanDerWaalsContact CD2-CD1 3.48Å; L406-L599 HydrophobicContact CD2-CG 4.04Å
407	G	88.8	Confident	94.1	Very high	24 Å²	24	10.4 Å²	10.4	25%	0.247	7%	0.068	C	C	.	.			trans	69.5	35	175.6	0	0	0	0	0	115.6	G405 T409 V410 Q411	G405-G407 PolarHBondContact O-N 2.67Å; G407-T409 PolarHBondContact O-N 3.39Å; G407-T409 VanDerWaalsContact O-N 3.13Å; G407-V410 WeakPolarHBondContact O-CG1 3.19Å; G407-V410 PolarHBondContact O-N 2.88Å; G407-Q411 PolarHBondContact O-N 2.91Å
408	K	94.2	Very high	94.1	Very high	20 Å²	20	11.3 Å²	11.3	9%	0.087	7%	0.071	C	C	.	.	H	α-helix	trans	-50.3	-37.3	175.3	-72.1	-163.1	-69.6	-81.8	0	113.7	L400 D402 D403 Q411 A412 L523 S524	L400-K408 HydrophobicContact CD2-CB 4.09Å; L400-K408 HydrophobicContact CD2-CD 4.44Å; L400-K408 HydrophobicContact CD2-CG 3.95Å; L400-K408 HydrophobicContact CG-CD 4.14Å; L400-K408 HydrophobicContact CG-CG 4.08Å; L400-K408 WeakPolarHBondContact O-CD 3.38Å; D402-K408 HydrophobicContact CB-CD 4.15Å; D402-K408 HydrophobicContact CB-CG 3.93Å; D402-K408 PolarHBondContact O-NZ 3.17Å; D403-K408 PolarHBondContact O-NZ 3.02Å; K408-Q411 PolarHBondContact O-N 3.29Å; K408-A412 VanDerWaalsContact O-CB 3.25Å; K408-A412 WeakPolarHBondContact O-CB 3.39Å; K408-A412 PolarHBondContact O-N 2.85Å; K408-L523 HydrophobicContact CD-CB 4.4Å; K408-S524 VanDerWaalsContact CE-C 3.48Å; K408-S524 WeakPolarHBondContact CE-O 3.3Å; K408-S524 PolarHBondContact NZ-O 3.43Å
409	T	94.8	Very high	94.1	Very high	50 Å²	50	12 Å²	12	31%	0.307	7%	0.074	S	C	.	.	H	α-helix	trans	-60	-45.1	176.9	-47.5	0	0	0	0	112.7	G407 A412 I413 W437 A440	G407-T409 PolarHBondContact O-N 3.39Å; G407-T409 VanDerWaalsContact O-N 3.13Å; T409-A412 PolarHBondContact O-N 2.95Å; T409-I413 HydrophobicContact CG2-CD1 4.15Å; T409-I413 VanDerWaalsContact O-CG1 3.29Å; T409-I413 WeakPolarHBondContact O-CG1 3.43Å; T409-I413 PolarHBondContact O-N 2.8Å; T409-W437 HydrophobicContact CG2-CD2 4.13Å; T409-W437 HydrophobicContact CG2-CE3 3.97Å; T409-W437 HydrophobicContact CG2-CH2 3.79Å; T409-W437 HydrophobicContact CG2-CZ2 3.91Å; T409-W437 HydrophobicContact CG2-CZ3 3.82Å; T409-A440 HydrophobicContact CG2-CB 4.1Å
410	V	95	Very high	93.9	Very high	17 Å²	17	16 Å²	16	10%	0.103	9%	0.089	C	C	.	.	H	α-helix	trans	-73.6	-36.5	-178.3	68.4	0	0	0	0	111.5	L376 L380 G407 C414 W444	L376-V410 HydrophobicContact CD1-CG2 3.26Å; L380-V410 HydrophobicContact CD2-CG1 4.19Å; L380-V410 HydrophobicContact CD2-CG2 4.05Å; G407-V410 WeakPolarHBondContact O-CG1 3.19Å; G407-V410 PolarHBondContact O-N 2.88Å; V410-C414 PolarHBondContact O-N 3.1Å; V410-C414 VanDerWaalsContact O-N 3.16Å; V410-W444 HydrophobicContact CG2-CD2 4.03Å; V410-W444 HydrophobicContact CG2-CG 4.24Å; V410-W444 HydrophobicContact CG2-CZ2 4.37Å
411	Q	96.4	Very high	93.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-57.6	-50.5	167.5	-70.8	-176.4	77.3	0	0	111.1	Q384 L400 D402 G407 K408 I413 C414 I415	Q384-Q411 HydrophobicContact CB-CG 3.68Å; Q384-Q411 HydrophobicContact CG-CG 3.9Å; L400-Q411 HydrophobicContact CD2-CB 3.73Å; L400-Q411 HydrophobicContact CD2-CG 4.39Å; D402-Q411 PolarHBondContact OD2-NE2 3.42Å; G407-Q411 PolarHBondContact O-N 2.91Å; K408-Q411 PolarHBondContact O-N 3.29Å; Q411-I413 PolarHBondContact O-N 3.24Å; Q411-C414 WeakPolarHBondContact O-CB 3.39Å; Q411-C414 PolarHBondContact O-N 3.22Å; Q411-C414 VanDerWaalsContact O-N 3.15Å; Q411-I415 WeakPolarHBondContact O-CD1 3.49Å; Q411-I415 VanDerWaalsContact O-CG1 3.25Å; Q411-I415 WeakPolarHBondContact O-CG1 3.21Å; Q411-I415 PolarHBondContact O-N 3.1Å
412	A	97.9	Very high	93.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.4	-39.9	-177.6	0	0	0	0	0	113.6	K408 T409 C414 I415 A416 W437 I492 I521 L523	K408-A412 VanDerWaalsContact O-CB 3.25Å; K408-A412 WeakPolarHBondContact O-CB 3.39Å; K408-A412 PolarHBondContact O-N 2.85Å; T409-A412 PolarHBondContact O-N 2.95Å; A412-C414 VanDerWaalsContact C-N 3.35Å; A412-I415 PolarHBondContact O-N 3.28Å; A412-A416 WeakPolarHBondContact O-CB 3.38Å; A412-A416 PolarHBondContact O-N 3.21Å; A412-W437 HydrophobicContact CB-CH2 3.98Å; A412-I492 HydrophobicContact CB-CD1 4.23Å; A412-I521 HydrophobicContact CB-CG2 4.27Å; A412-L523 HydrophobicContact CB-CD1 3.7Å; A412-L523 HydrophobicContact CB-CD2 3.84Å; A412-L523 HydrophobicContact CB-CG 4.37Å
413	I	97.7	Very high	93.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.1	-42.4	174.6	-68.1	169.6	0	0	0	110.1	L376 T409 Q411 A416 A417 W437 A440 F441 W444 L445	L376-I413 HydrophobicContact CD2-CG2 3.91Å; T409-I413 HydrophobicContact CG2-CD1 4.15Å; T409-I413 VanDerWaalsContact O-CG1 3.29Å; T409-I413 WeakPolarHBondContact O-CG1 3.43Å; T409-I413 PolarHBondContact O-N 2.8Å; Q411-I413 PolarHBondContact O-N 3.24Å; I413-A416 PolarHBondContact O-N 2.81Å; I413-A417 VanDerWaalsContact O-CB 3.28Å; I413-A417 WeakPolarHBondContact O-CB 3.36Å; I413-A417 PolarHBondContact O-N 2.95Å; I413-W437 HydrophobicContact CD1-CZ3 4.35Å; I413-W437 HydrophobicContact CG1-CE3 4.49Å; I413-W437 HydrophobicContact CG1-CZ3 3.92Å; I413-A440 HydrophobicContact CD1-CB 3.71Å; I413-F441 HydrophobicContact CB-CE1 4.43Å; I413-F441 HydrophobicContact CD1-CD1 4.42Å; I413-F441 HydrophobicContact CG1-CD1 4.19Å; I413-F441 HydrophobicContact CG1-CE1 3.84Å; I413-F441 HydrophobicContact CG1-CZ 4.07Å; I413-F441 HydrophobicContact CG2-CD1 4.13Å; I413-F441 HydrophobicContact CG2-CE1 4.11Å; I413-W444 HydrophobicContact CG2-CB 4.34Å; I413-L445 HydrophobicContact CG2-CD1 3.7Å; I413-L445 HydrophobicContact CG2-CD2 4.44Å; I413-L445 HydrophobicContact CG2-CG 3.74Å
414	C	97.7	Very high	94	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.5	-44.3	176.6	-165.8	0	0	0	0	112.4	L376 L380 V388 V410 Q411 A412 A416 A417 Y418	L376-C414 HydrophobicContact CD1-CB 4.33Å; L376-C414 HydrophobicContact CD2-CB 3.94Å; L376-C414 HydrophobicContact CG-CB 4.17Å; L380-C414 HydrophobicContact CD1-CB 4.2Å; V388-C414 HydrophobicContact CG2-CB 3.96Å; V410-C414 PolarHBondContact O-N 3.1Å; V410-C414 VanDerWaalsContact O-N 3.16Å; Q411-C414 WeakPolarHBondContact O-CB 3.39Å; Q411-C414 PolarHBondContact O-N 3.22Å; Q411-C414 VanDerWaalsContact O-N 3.15Å; A412-C414 VanDerWaalsContact C-N 3.35Å; C414-A416 VanDerWaalsContact C-N 3.33Å; C414-A416 PolarHBondContact O-N 3.36Å; C414-A417 PolarHBondContact O-N 3.41Å; C414-Y418 PolarHBondContact O-N 3.29Å
415	I	97.6	Very high	94.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.7	-41.2	177.4	-61.3	160	0	0	0	110.7	V388 A391 Q411 A412 Y419 I521	V388-I415 HydrophobicContact CB-CG1 4.39Å; V388-I415 HydrophobicContact CG1-CG1 4.32Å; V388-I415 HydrophobicContact CG2-CG1 4.11Å; A391-I415 HydrophobicContact CB-CB 4.32Å; A391-I415 HydrophobicContact CB-CD1 3.47Å; A391-I415 VanDerWaalsContact CB-CD1 3.47Å; A391-I415 HydrophobicContact CB-CG1 3.62Å; A391-I415 HydrophobicContact CB-CG2 3.66Å; Q411-I415 WeakPolarHBondContact O-CD1 3.49Å; Q411-I415 VanDerWaalsContact O-CG1 3.25Å; Q411-I415 WeakPolarHBondContact O-CG1 3.21Å; Q411-I415 PolarHBondContact O-N 3.1Å; A412-I415 PolarHBondContact O-N 3.28Å; I415-Y419 VanDerWaalsContact O-CD2 3.3Å; I415-Y419 WeakPolarHBondContact O-CD2 3.38Å; I415-I521 HydrophobicContact CB-CD1 4.03Å; I415-I521 HydrophobicContact CG2-CD1 3.58Å; I415-I521 HydrophobicContact CG2-CG1 3.98Å
416	A	97.6	Very high	95.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.7	-35.5	176.5	0	0	0	0	0	112.5	A412 I413 C414 Y419 R420 W423 L425 V490 I492 I521	A412-A416 WeakPolarHBondContact O-CB 3.38Å; A412-A416 PolarHBondContact O-N 3.21Å; I413-A416 PolarHBondContact O-N 2.81Å; C414-A416 VanDerWaalsContact C-N 3.33Å; C414-A416 PolarHBondContact O-N 3.36Å; A416-Y419 CarbonylContact O-C 3.56Å; A416-Y419 PolarHBondContact O-N 3.37Å; A416-R420 PolarHBondContact O-N 3.4Å; A416-W423 HydrophobicContact CB-CZ2 4.3Å; A416-W423 WeakPolarHBondContact O-CZ2 3.33Å; A416-W423 PolarHBondContact O-NE1 2.97Å; A416-L425 HydrophobicContact CB-CD1 4.18Å; A416-L425 HydrophobicContact CB-CD2 3.97Å; A416-V490 HydrophobicContact CB-CG1 4.3Å; A416-I492 HydrophobicContact CB-CD1 4.03Å; A416-I521 HydrophobicContact CB-CD1 4.16Å
417	A	96.8	Very high	95.7	Very high	7 Å²	7	24.6 Å²	24.6	6%	0.058	13%	0.127	C	C	.	.	H	α-helix	trans	-66.8	-35.6	176.2	0	0	0	0	0	112.8	I372 I413 C414 Y419 R420 L445	I372-A417 HydrophobicContact CD1-CB 4.2Å; I372-A417 HydrophobicContact CG1-CB 4.17Å; I372-A417 HydrophobicContact CG2-CB 4Å; I413-A417 VanDerWaalsContact O-CB 3.28Å; I413-A417 WeakPolarHBondContact O-CB 3.36Å; I413-A417 PolarHBondContact O-N 2.95Å; C414-A417 PolarHBondContact O-N 3.41Å; A417-Y419 PolarHBondContact O-N 3.13Å; A417-R420 WeakPolarHBondContact O-CB 3.13Å; A417-R420 PolarHBondContact O-N 2.71Å; A417-L445 HydrophobicContact CB-CD1 4.04Å; A417-L445 HydrophobicContact CB-CD2 4Å
418	Y	97	Very high	96.1	Very high	69 Å²	69	23.5 Å²	23.5	27%	0.271	12%	0.115	S	C	.	.	H	α-helix	trans	-57.1	-31.5	171.6	-172.5	-88	0	0	0	112.4	A367 D368 L369 V392 C414	A367-Y418 HydrophobicContact CB-CD2 4.47Å; A367-Y418 HydrophobicContact CB-CE2 4Å; D368-Y418 WeakPolarHBondContact O-CE2 3.47Å; L369-Y418 HydrophobicContact CD2-CD2 4.04Å; V392-Y418 HydrophobicContact CB-CE1 4.42Å; V392-Y418 HydrophobicContact CG1-CE1 3.76Å; V392-Y418 HydrophobicContact CG1-CE2 4.39Å; V392-Y418 HydrophobicContact CG2-CD1 3.72Å; V392-Y418 HydrophobicContact CG2-CD2 4.07Å; V392-Y418 HydrophobicContact CG2-CE1 3.76Å; V392-Y418 HydrophobicContact CG2-CE2 4.1Å; V392-Y418 HydrophobicContact CG2-CG 3.89Å; C414-Y418 PolarHBondContact O-N 3.29Å
419	Y	96.8	Very high	96.1	Very high	15 Å²	15	22.5 Å²	22.5	6%	0.059	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	28.5	175.5	-59.8	-66.9	0	0	0	113.4	G396 I415 A416 A417 N421 E422 W423 R519	G396-Y419 PolarHBondContact N-OH 3.21Å; I415-Y419 VanDerWaalsContact O-CD2 3.3Å; I415-Y419 WeakPolarHBondContact O-CD2 3.38Å; A416-Y419 CarbonylContact O-C 3.56Å; A416-Y419 PolarHBondContact O-N 3.37Å; A417-Y419 PolarHBondContact O-N 3.13Å; Y419-N421 PolarHBondContact O-N 2.95Å; Y419-E422 PolarHBondContact O-N 2.88Å; Y419-W423 PolarHBondContact O-NE1 3.44Å; Y419-R519 HydrophobicContact CD1-CG 4.39Å; Y419-R519 HydrophobicContact CD2-CG 4.01Å; Y419-R519 HydrophobicContact CG-CG 3.94Å
420	R	94.7	Very high	95.9	Very high	85 Å²	85	20.4 Å²	20.4	32%	0.321	10%	0.098	S	C	.	.	G	3₁₀ helix	trans	-60.8	-26	-178	-177.1	170.6	177.7	169.3	-4.1	114.4	A416 A417 E422 W423 S447	A416-R420 PolarHBondContact O-N 3.4Å; A417-R420 WeakPolarHBondContact O-CB 3.13Å; A417-R420 PolarHBondContact O-N 2.71Å; R420-E422 PolarHBondContact O-N 3.47Å; R420-W423 HydrophobicContact CB-CD2 4.48Å; R420-W423 HydrophobicContact CB-CZ2 4.38Å; R420-W423 HydrophobicContact CG-CD2 4.18Å; R420-W423 HydrophobicContact CG-CE3 4.27Å; R420-W423 HydrophobicContact CG-CZ2 4.44Å; R420-W423 HydrophobicContact CG-CZ3 4.44Å; R420-W423 PolarHBondContact O-N 3.04Å; R420-S447 PolarHBondContact NH1-OG 2.92Å; R420-S447 PolarHBondContact NH2-O 3.33Å
421	N	94.1	Very high	95.4	Very high	140 Å²	140	21.6 Å²	21.6	75%	0.749	11%	0.107	S	C	*	.	G	3₁₀ helix	trans	-68.1	-13.3	171.9	63.5	-18.3	0	0	0	114.3	Y419	Y419-N421 PolarHBondContact O-N 2.95Å
422	E	95	Very high	94.6	Very high	27 Å²	27	23.4 Å²	23.4	13%	0.126	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-101.1	-1.2	177.6	-66	-174.1	-179.1	0	0	113.7	Y419 R420 N489 V490 K518 R519	Y419-E422 PolarHBondContact O-N 2.88Å; R420-E422 PolarHBondContact O-N 3.47Å; E422-N489 HydrophobicContact CB-CB 3.99Å; E422-N489 VanDerWaalsContact O-CB 3.28Å; E422-N489 WeakPolarHBondContact O-CB 3.39Å; E422-N489 PolarHBondContact O-ND2 3.31Å; E422-V490 HydrophobicContact CB-CG2 3.88Å; E422-K518 WeakPolarHBondContact OE2-CD 3.45Å; E422-R519 IonicContact OE1-CZ 2.67Å; E422-R519 IonicContact OE1-NE 2.74Å; E422-R519 PolarHBondContact OE1-NE 3.02Å; E422-R519 IonicContact OE1-NH2 3.5Å; E422-R519 PolarHBondContact OE1-NH2 3.42Å; E422-R519 WeakPolarHBondContact OE2-CG 3.17Å; E422-R519 IonicContact OE2-CZ 3.19Å; E422-R519 IonicContact OE2-NE 2.87Å; E422-R519 PolarHBondContact OE2-NE 2.77Å; E422-R519 IonicContact OE2-NH2 4Å
423	W	93.6	Very high	94	Very high	29 Å²	29	24.3 Å²	24.3	11%	0.11	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-62.7	154.4	-178.1	-70	16.2	0	0	0	111.6	A416 Y419 R420 L425 L445 L448 L467 V468	A416-W423 HydrophobicContact CB-CZ2 4.3Å; A416-W423 WeakPolarHBondContact O-CZ2 3.33Å; A416-W423 PolarHBondContact O-NE1 2.97Å; Y419-W423 PolarHBondContact O-NE1 3.44Å; R420-W423 HydrophobicContact CB-CD2 4.48Å; R420-W423 HydrophobicContact CB-CZ2 4.38Å; R420-W423 HydrophobicContact CG-CD2 4.18Å; R420-W423 HydrophobicContact CG-CE3 4.27Å; R420-W423 HydrophobicContact CG-CZ2 4.44Å; R420-W423 HydrophobicContact CG-CZ3 4.44Å; R420-W423 PolarHBondContact O-N 3.04Å; W423-L425 HydrophobicContact CD2-CB 3.79Å; W423-L425 HydrophobicContact CE3-CB 4.23Å; W423-L425 HydrophobicContact CG-CB 3.97Å; W423-L425 HydrophobicContact CH2-CD2 4.08Å; W423-L425 HydrophobicContact CZ2-CD2 3.77Å; W423-L445 HydrophobicContact CH2-CD1 4.08Å; W423-L448 HydrophobicContact CH2-CD1 4.03Å; W423-L448 HydrophobicContact CZ3-CD1 3.91Å; W423-L448 HydrophobicContact CZ3-CD2 3.79Å; W423-L448 HydrophobicContact CZ3-CG 4.47Å; W423-L467 HydrophobicContact CE3-CB 4.25Å; W423-V468 HydrophobicContact CE3-CG2 3.98Å; W423-V468 HydrophobicContact CH2-CG2 3.9Å; W423-V468 HydrophobicContact CZ3-CG2 3.35Å
424	P	93.6	Very high	93.6	Very high	34 Å²	34	25.8 Å²	25.8	22%	0.221	13%	0.13	C	C	.	.	P	Polyproline II helix	cis	-71.6	142	27.8	27.3	-36.6	0	0	0	115.6	L467 F488	P424-L467 WeakPolarHBondContact CA-O 3.28Å; P424-F488 HydrophobicContact CB-CD1 3.93Å; P424-F488 HydrophobicContact CB-CE1 4.17Å; P424-F488 HydrophobicContact CG-CD1 3.97Å; P424-F488 HydrophobicContact CG-CE1 4.39Å
425	L	96.6	Very high	93.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	134.6	172	171.5	61.3	0	0	0	110	A416 W423 V427 F441 L467 V468 N469 V490 I492	A416-L425 HydrophobicContact CB-CD1 4.18Å; A416-L425 HydrophobicContact CB-CD2 3.97Å; W423-L425 HydrophobicContact CD2-CB 3.79Å; W423-L425 HydrophobicContact CE3-CB 4.23Å; W423-L425 HydrophobicContact CG-CB 3.97Å; W423-L425 HydrophobicContact CH2-CD2 4.08Å; W423-L425 HydrophobicContact CZ2-CD2 3.77Å; L425-V427 HydrophobicContact CD1-CG2 4.38Å; L425-V427 HydrophobicContact CD2-CG2 4.25Å; L425-V427 HydrophobicContact CG-CG2 4.08Å; L425-F441 HydrophobicContact CD2-CE1 3.83Å; L425-F441 HydrophobicContact CD2-CZ 3.69Å; L425-L467 PolarHBondContact N-O 3.11Å; L425-V468 HydrophobicContact CD2-CG1 4.13Å; L425-V468 HydrophobicContact CD2-CG2 4.18Å; L425-V468 HydrophobicContact CG-CG1 4.47Å; L425-N469 PolarHBondContact O-N 3.01Å; L425-N469 PolarHBondContact O-ND2 2.83Å; L425-V490 HydrophobicContact CD1-CB 4.05Å; L425-V490 HydrophobicContact CD1-CG1 3.69Å; L425-V490 WeakPolarHBondContact CD1-O 3.49Å; L425-I492 HydrophobicContact CD1-CD1 4.26Å; L425-I492 HydrophobicContact CD1-CG1 4.19Å
426	L	97.1	Very high	92.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127	167.7	-178	66.7	0	0	0	110.1	V428 I463 N469 V471 F488 V490 L491 I492 L513	L426-V428 HydrophobicContact CD2-CG2 4.09Å; L426-V428 HydrophobicContact CG-CG2 4.05Å; L426-I463 HydrophobicContact CD1-CD1 4.47Å; L426-N469 WeakPolarHBondContact CA-O 3.37Å; L426-N469 HydrophobicContact CD1-CB 4.31Å; L426-V471 HydrophobicContact CD1-CG1 3.9Å; L426-F488 HydrophobicContact CB-CB 4.16Å; L426-F488 HydrophobicContact CB-CD1 3.74Å; L426-F488 HydrophobicContact CB-CD2 4.08Å; L426-F488 HydrophobicContact CB-CE1 4.04Å; L426-F488 HydrophobicContact CB-CE2 4.37Å; L426-F488 HydrophobicContact CB-CG 3.75Å; L426-F488 HydrophobicContact CB-CZ 4.34Å; L426-F488 HydrophobicContact CD1-CE1 4.37Å; L426-F488 HydrophobicContact CD1-CE2 4.3Å; L426-F488 HydrophobicContact CD1-CZ 4.06Å; L426-F488 HydrophobicContact CD2-CD2 3.87Å; L426-F488 HydrophobicContact CD2-CE2 3.94Å; L426-F488 HydrophobicContact CD2-CG 4.38Å; L426-F488 HydrophobicContact CD2-CZ 4.5Å; L426-F488 HydrophobicContact CG-CD2 4.46Å; L426-F488 HydrophobicContact CG-CE2 4.44Å; L426-V490 PolarHBondContact N-O 2.9Å; L426-L491 HydrophobicContact CB-CD1 4.4Å; L426-L491 HydrophobicContact CB-CG 4.36Å; L426-L491 HydrophobicContact CD2-CG 4.46Å; L426-L491 CarbonylContact O-C 3.59Å; L426-L491 WeakPolarHBondContact O-CA 3.47Å; L426-I492 PolarHBondContact O-N 2.94Å; L426-L513 HydrophobicContact CD2-CD1 4.35Å
427	V	97.9	Very high	92.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.7	171.5	-174	0	0	0	0	108.7	L425 W437 F441 V468 N469 I470 V471 I492	L425-V427 HydrophobicContact CD1-CG2 4.38Å; L425-V427 HydrophobicContact CD2-CG2 4.25Å; L425-V427 HydrophobicContact CG-CG2 4.08Å; V427-W437 HydrophobicContact CG1-CD2 3.97Å; V427-W437 HydrophobicContact CG1-CE3 4.06Å; V427-W437 HydrophobicContact CG1-CG 4.36Å; V427-W437 HydrophobicContact CG1-CZ3 4.4Å; V427-F441 HydrophobicContact CG2-CE2 3.86Å; V427-F441 HydrophobicContact CG2-CZ 3.89Å; V427-V468 HydrophobicContact CG2-CG1 4.45Å; V427-N469 PolarHBondContact N-O 2.82Å; V427-I470 HydrophobicContact CB-CG1 4.24Å; V427-I470 WeakPolarHBondContact O-CA 2.94Å; V427-V471 PolarHBondContact O-N 2.81Å; V427-I492 WeakPolarHBondContact CA-O 3.39Å; V427-I492 HydrophobicContact CB-CB 4.45Å; V427-I492 HydrophobicContact CG1-CB 4.16Å; V427-I492 HydrophobicContact CG1-CG2 4.14Å; V427-I492 HydrophobicContact CG2-CB 4.17Å; V427-I492 HydrophobicContact CG2-CD1 4.09Å
428	V	96.9	Very high	92.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.7	173.3	-167.7	0	0	0	0	108	L426 V471 Y473 L476 I492 M493 D494	L426-V428 HydrophobicContact CD2-CG2 4.09Å; L426-V428 HydrophobicContact CG-CG2 4.05Å; V428-V471 WeakPolarHBondContact CA-O 3.08Å; V428-V471 HydrophobicContact CB-CG1 4.45Å; V428-V471 HydrophobicContact CG1-CG1 4.36Å; V428-V471 HydrophobicContact CG2-CG1 3.9Å; V428-Y473 HydrophobicContact CB-CE1 4.23Å; V428-Y473 HydrophobicContact CG1-CD1 3.44Å; V428-Y473 VanDerWaalsContact CG1-CD1 3.44Å; V428-Y473 HydrophobicContact CG1-CD2 4.3Å; V428-Y473 HydrophobicContact CG1-CE1 3.56Å; V428-Y473 HydrophobicContact CG1-CE2 4.42Å; V428-Y473 HydrophobicContact CG1-CG 3.82Å; V428-L476 HydrophobicContact CG1-CD2 4.05Å; V428-L476 HydrophobicContact CG2-CD2 4.03Å; V428-I492 PolarHBondContact N-O 3.35Å; V428-M493 HydrophobicContact CB-CE 4.03Å; V428-M493 HydrophobicContact CB-SD 3.65Å; V428-M493 HydrophobicContact CG1-SD 4.25Å; V428-M493 HydrophobicContact CG2-CE 3.49Å; V428-M493 VanDerWaalsContact CG2-CE 3.49Å; V428-M493 HydrophobicContact CG2-SD 3.85Å; V428-D494 PolarHBondContact O-N 2.69Å
429	T	94.4	Very high	92.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	161.4	-168.5	-178.6	0	0	0	0	110.5	V433 R434 W437 I470 V471 S472 D494	T429-V433 WeakPolarHBondContact OG1-CG2 3.49Å; T429-R434 HydrophobicContact CG2-CB 4.38Å; T429-R434 HydrophobicContact CG2-CG 3.69Å; T429-W437 VanDerWaalsContact OG1-CD1 3.31Å; T429-W437 PolarHBondContact OG1-NE1 2.8Å; T429-I470 HydrophobicContact CG2-CG2 4.02Å; T429-V471 PolarHBondContact N-O 2.98Å; T429-V471 VanDerWaalsContact N-O 3.13Å; T429-S472 WeakPolarHBondContact O-CA 3.39Å; T429-S472 WeakPolarHBondContact O-CB 3.48Å; T429-D494 PolarHBondContact OG1-OD2 3.29Å
430	P	89.4	Confident	92.1	Very high	6 Å²	6	36.1 Å²	36.1	4%	0.039	19%	0.187	C	C	.	.			trans	-56.8	146.9	175.7	-26.1	34.7	0	0	0	113.1	S432 V433 E495 M737	P430-S432 PolarHBondContact O-N 3.04Å; P430-V433 HydrophobicContact CB-CG2 4Å; P430-V433 HydrophobicContact CG-CG2 4.23Å; P430-V433 WeakPolarHBondContact O-CG2 3.46Å; P430-V433 PolarHBondContact O-N 3.4Å; P430-V433 VanDerWaalsContact O-N 3.1Å; P430-E495 HydrophobicContact CG-CB 4.04Å; P430-E495 HydrophobicContact CG-CG 4.33Å; P430-M737 HydrophobicContact CB-CE 4.24Å; P430-M737 HydrophobicContact CB-SD 3.7Å; P430-M737 HydrophobicContact CG-CE 3.47Å; P430-M737 VanDerWaalsContact CG-CE 3.47Å; P430-M737 HydrophobicContact CG-SD 3.63Å
431	S	83.8	Confident	92.2	Very high	41 Å²	41	32.1 Å²	32.1	29%	0.287	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-21.4	-170.2	-69.1	0	0	0	0	115	R434 S472 D474	S431-R434 PolarHBondContact O-NE 3Å; S431-R434 PolarHBondContact O-NH2 3.21Å; S431-S472 WeakPolarHBondContact OG-CB 3.42Å; S431-S472 PolarHBondContact OG-OG 2.79Å; S431-D474 PolarHBondContact OG-OD2 3.33Å
432	S	79.5	Confident	92.2	Very high	38 Å²	38	31.5 Å²	31.5	27%	0.266	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-20.7	-179.4	50.5	0	0	0	0	116	P430 S709	P430-S432 PolarHBondContact O-N 3.04Å; S432-S709 WeakPolarHBondContact CA-OG 3.32Å
433	V	85.8	Confident	92.1	Very high	19 Å²	19	38.6 Å²	38.6	12%	0.115	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	2.8	-172	-75.2	0	0	0	0	114.4	T429 P430 F435 T436 W437	T429-V433 WeakPolarHBondContact OG1-CG2 3.49Å; P430-V433 HydrophobicContact CB-CG2 4Å; P430-V433 HydrophobicContact CG-CG2 4.23Å; P430-V433 WeakPolarHBondContact O-CG2 3.46Å; P430-V433 PolarHBondContact O-N 3.4Å; P430-V433 VanDerWaalsContact O-N 3.1Å; V433-F435 VanDerWaalsContact C-N 3.29Å; V433-F435 PolarHBondContact O-N 3.49Å; V433-T436 WeakPolarHBondContact O-CB 3.22Å; V433-T436 PolarHBondContact O-N 3.37Å; V433-T436 VanDerWaalsContact O-N 3.14Å; V433-W437 PolarHBondContact O-N 3.04Å
434	R	90.1	Very high	92.2	Very high	31 Å²	31	39.6 Å²	39.6	12%	0.117	19%	0.188	C	C	.	.	H	α-helix	trans	-51.5	-43.4	176.1	-71.4	175.7	-73.5	168.2	-1.6	113.6	T429 S431 W437 A438 V455 A456 I470	T429-R434 HydrophobicContact CG2-CB 4.38Å; T429-R434 HydrophobicContact CG2-CG 3.69Å; S431-R434 PolarHBondContact O-NE 3Å; S431-R434 PolarHBondContact O-NH2 3.21Å; R434-W437 PolarHBondContact O-N 2.91Å; R434-A438 PolarHBondContact O-N 2.74Å; R434-A438 VanDerWaalsContact O-N 3.16Å; R434-V455 HydrophobicContact CB-CG1 4.1Å; R434-A456 PolarHBondContact NH1-O 2.83Å; R434-I470 HydrophobicContact CB-CG2 4.01Å; R434-I470 HydrophobicContact CG-CG2 4.1Å
435	F	88.6	Confident	92.2	Very high	111 Å²	111	38 Å²	38	49%	0.487	18%	0.178	S	C	.	.	H	α-helix	trans	-71.9	-39.8	179.6	-64.1	-71.8	0	0	0	111.8	V433 W437 A438 E439 V455 V457	V433-F435 VanDerWaalsContact C-N 3.29Å; V433-F435 PolarHBondContact O-N 3.49Å; F435-W437 VanDerWaalsContact C-N 3.26Å; F435-W437 PolarHBondContact O-N 2.88Å; F435-A438 WeakPolarHBondContact O-CB 3.47Å; F435-A438 PolarHBondContact O-N 2.82Å; F435-E439 WeakPolarHBondContact O-CG 3.44Å; F435-E439 PolarHBondContact O-N 2.83Å; F435-V455 HydrophobicContact CD1-CG1 4.22Å; F435-V455 HydrophobicContact CE1-CG1 3.98Å; F435-V455 HydrophobicContact CZ-CG1 4.46Å; F435-V457 HydrophobicContact CZ-CG2 4.22Å
436	T	89.3	Confident	92	Very high	72 Å²	72	41.7 Å²	41.7	44%	0.442	20%	0.201	S	C	.	.	H	α-helix	trans	-58.6	-36.5	172.6	-41.6	0	0	0	0	112.1	V433 A440	V433-T436 WeakPolarHBondContact O-CB 3.22Å; V433-T436 PolarHBondContact O-N 3.37Å; V433-T436 VanDerWaalsContact O-N 3.14Å; T436-A440 VanDerWaalsContact O-CB 3.32Å; T436-A440 WeakPolarHBondContact O-CB 3.37Å; T436-A440 PolarHBondContact O-N 2.9Å
437	W	94.6	Very high	91.8	Very high	6 Å²	6	44.4 Å²	44.4	2%	0.023	22%	0.221	C	C	.	.	H	α-helix	trans	-65.6	-44	171.2	-89.3	96.9	0	0	0	112.4	T409 A412 I413 V427 T429 V433 R434 F435 E439 A440 F441 I470 I492 D494 L523	T409-W437 HydrophobicContact CG2-CD2 4.13Å; T409-W437 HydrophobicContact CG2-CE3 3.97Å; T409-W437 HydrophobicContact CG2-CH2 3.79Å; T409-W437 HydrophobicContact CG2-CZ2 3.91Å; T409-W437 HydrophobicContact CG2-CZ3 3.82Å; A412-W437 HydrophobicContact CB-CH2 3.98Å; I413-W437 HydrophobicContact CD1-CZ3 4.35Å; I413-W437 HydrophobicContact CG1-CE3 4.49Å; I413-W437 HydrophobicContact CG1-CZ3 3.92Å; V427-W437 HydrophobicContact CG1-CD2 3.97Å; V427-W437 HydrophobicContact CG1-CE3 4.06Å; V427-W437 HydrophobicContact CG1-CG 4.36Å; V427-W437 HydrophobicContact CG1-CZ3 4.4Å; T429-W437 VanDerWaalsContact OG1-CD1 3.31Å; T429-W437 PolarHBondContact OG1-NE1 2.8Å; V433-W437 PolarHBondContact O-N 3.04Å; R434-W437 PolarHBondContact O-N 2.91Å; F435-W437 VanDerWaalsContact C-N 3.26Å; F435-W437 PolarHBondContact O-N 2.88Å; W437-E439 VanDerWaalsContact C-N 3.34Å; W437-E439 PolarHBondContact O-N 3.28Å; W437-A440 WeakPolarHBondContact O-CB 3.22Å; W437-A440 PolarHBondContact O-N 2.93Å; W437-F441 HydrophobicContact CE3-CD2 4.46Å; W437-F441 AromaticContact CE3-CE2 3.73Å; W437-F441 HydrophobicContact CE3-CE2 3.73Å; W437-F441 HydrophobicContact CE3-CZ 4.23Å; W437-F441 HydrophobicContact CZ3-CE2 4.28Å; W437-F441 HydrophobicContact CZ3-CZ 4.32Å; W437-F441 WeakPolarHBondContact O-CD2 3.32Å; W437-F441 PolarHBondContact O-N 3.13Å; W437-I470 HydrophobicContact CB-CD1 4.09Å; W437-I470 HydrophobicContact CB-CG2 4.36Å; W437-I492 HydrophobicContact CH2-CD1 4.35Å; W437-I492 HydrophobicContact CH2-CG2 3.89Å; W437-I492 HydrophobicContact CZ2-CG2 4.3Å; W437-I492 HydrophobicContact CZ3-CD1 4.1Å; W437-I492 HydrophobicContact CZ3-CG2 4.5Å; W437-D494 HydrophobicContact CZ2-CB 3.77Å; W437-D494 PolarHBondContact NE1-OD2 2.93Å; W437-L523 HydrophobicContact CH2-CD1 3.73Å; W437-L523 HydrophobicContact CZ2-CD1 3.7Å
438	A	93.4	Very high	91.6	Very high	2 Å²	2	44.9 Å²	44.9	2%	0.017	22%	0.223	C	C	.	.	H	α-helix	trans	-62.2	-40.2	176.9	0	0	0	0	0	112.4	R434 F435 F441 R442 I453 V455 I470	R434-A438 PolarHBondContact O-N 2.74Å; R434-A438 VanDerWaalsContact O-N 3.16Å; F435-A438 WeakPolarHBondContact O-CB 3.47Å; F435-A438 PolarHBondContact O-N 2.82Å; A438-F441 PolarHBondContact O-N 2.83Å; A438-R442 WeakPolarHBondContact O-CG 3.08Å; A438-R442 PolarHBondContact O-N 3.38Å; A438-R442 VanDerWaalsContact O-N 3.1Å; A438-I453 HydrophobicContact CB-CG2 3.99Å; A438-V455 HydrophobicContact CB-CG2 3.68Å; A438-I470 HydrophobicContact CB-CD1 3.86Å
439	E	92.1	Very high	91.3	Very high	104 Å²	104	48 Å²	48	49%	0.486	25%	0.245	S	C	.	.	H	α-helix	trans	-65	-41.1	172.6	-69.9	170.1	168.1	0	0	112.1	F435 W437 F441 R442 R443	F435-E439 WeakPolarHBondContact O-CG 3.44Å; F435-E439 PolarHBondContact O-N 2.83Å; W437-E439 VanDerWaalsContact C-N 3.34Å; W437-E439 PolarHBondContact O-N 3.28Å; E439-F441 PolarHBondContact O-N 2.86Å; E439-R442 PolarHBondContact O-N 3.27Å; E439-R443 VanDerWaalsContact O-CB 3.31Å; E439-R443 WeakPolarHBondContact O-CB 3.17Å; E439-R443 PolarHBondContact O-N 2.91Å
440	A	94.3	Very high	91.1	Very high	14 Å²	14	51.4 Å²	51.4	12%	0.116	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-41.1	175.7	0	0	0	0	0	112	T409 I413 T436 W437 R443 W444	T409-A440 HydrophobicContact CG2-CB 4.1Å; I413-A440 HydrophobicContact CD1-CB 3.71Å; T436-A440 VanDerWaalsContact O-CB 3.32Å; T436-A440 WeakPolarHBondContact O-CB 3.37Å; T436-A440 PolarHBondContact O-N 2.9Å; W437-A440 WeakPolarHBondContact O-CB 3.22Å; W437-A440 PolarHBondContact O-N 2.93Å; A440-R443 PolarHBondContact O-N 2.96Å; A440-W444 WeakPolarHBondContact O-CB 3.37Å; A440-W444 PolarHBondContact O-N 2.73Å
441	F	96.3	Very high	91.2	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.1	-47.8	172.6	-79.2	-70.6	0	0	0	112	I413 L425 V427 W437 A438 E439 R443 W444 L445 L448 I453 V468 I470 I492	I413-F441 HydrophobicContact CB-CE1 4.43Å; I413-F441 HydrophobicContact CD1-CD1 4.42Å; I413-F441 HydrophobicContact CG1-CD1 4.19Å; I413-F441 HydrophobicContact CG1-CE1 3.84Å; I413-F441 HydrophobicContact CG1-CZ 4.07Å; I413-F441 HydrophobicContact CG2-CD1 4.13Å; I413-F441 HydrophobicContact CG2-CE1 4.11Å; L425-F441 HydrophobicContact CD2-CE1 3.83Å; L425-F441 HydrophobicContact CD2-CZ 3.69Å; V427-F441 HydrophobicContact CG2-CE2 3.86Å; V427-F441 HydrophobicContact CG2-CZ 3.89Å; W437-F441 HydrophobicContact CE3-CD2 4.46Å; W437-F441 AromaticContact CE3-CE2 3.73Å; W437-F441 HydrophobicContact CE3-CE2 3.73Å; W437-F441 HydrophobicContact CE3-CZ 4.23Å; W437-F441 HydrophobicContact CZ3-CE2 4.28Å; W437-F441 HydrophobicContact CZ3-CZ 4.32Å; W437-F441 WeakPolarHBondContact O-CD2 3.32Å; W437-F441 PolarHBondContact O-N 3.13Å; A438-F441 PolarHBondContact O-N 2.83Å; E439-F441 PolarHBondContact O-N 2.86Å; F441-R443 VanDerWaalsContact C-N 3.28Å; F441-R443 PolarHBondContact O-N 3.21Å; F441-W444 PolarHBondContact O-N 2.89Å; F441-L445 HydrophobicContact CD1-CD1 4.18Å; F441-L445 PolarHBondContact O-N 3.41Å; F441-L448 HydrophobicContact CD1-CD1 4.36Å; F441-I453 HydrophobicContact CB-CD1 3.77Å; F441-V468 HydrophobicContact CD1-CG1 4.44Å; F441-V468 HydrophobicContact CD1-CG2 4.42Å; F441-V468 HydrophobicContact CD2-CG1 3.86Å; F441-V468 HydrophobicContact CE1-CG1 4.24Å; F441-V468 HydrophobicContact CE1-CG2 4.45Å; F441-V468 HydrophobicContact CE2-CG1 3.64Å; F441-V468 HydrophobicContact CG-CG1 4.28Å; F441-V468 HydrophobicContact CZ-CG1 3.85Å; F441-I470 HydrophobicContact CD2-CD1 4.03Å; F441-I470 HydrophobicContact CE2-CD1 4.24Å; F441-I492 HydrophobicContact CZ-CD1 4.49Å
442	R	94.2	Very high	91.6	Very high	128 Å²	128	56.8 Å²	56.8	48%	0.483	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-35.5	177.7	-69.5	169.8	-177.9	166	-1.2	113.1	A438 E439 I453	A438-R442 WeakPolarHBondContact O-CG 3.08Å; A438-R442 PolarHBondContact O-N 3.38Å; A438-R442 VanDerWaalsContact O-N 3.1Å; E439-R442 PolarHBondContact O-N 3.27Å; R442-I453 HydrophobicContact CG-CD1 3.66Å
443	R	93.8	Very high	92.3	Very high	175 Å²	175	55.5 Å²	55.5	66%	0.66	28%	0.283	S	S	*	.	H	α-helix	trans	-74.4	-43.6	179.2	175.9	177.6	173.6	145.7	3.9	112.8	E439 A440 F441	E439-R443 VanDerWaalsContact O-CB 3.31Å; E439-R443 WeakPolarHBondContact O-CB 3.17Å; E439-R443 PolarHBondContact O-N 2.91Å; A440-R443 PolarHBondContact O-N 2.96Å; F441-R443 VanDerWaalsContact C-N 3.28Å; F441-R443 PolarHBondContact O-N 3.21Å
444	W	95.1	Very high	92.7	Very high	50 Å²	50	55.7 Å²	55.7	19%	0.189	28%	0.284	C	S	.	.	H	α-helix	trans	-97.7	-25.9	-169.2	-64.9	122.9	0	0	0	114	L376 S379 V410 I413 A440 F441 P446	L376-W444 WeakPolarHBondContact CB-O 3.29Å; L376-W444 HydrophobicContact CD1-CB 4.23Å; L376-W444 HydrophobicContact CD1-CG 4.44Å; L376-W444 HydrophobicContact CD2-CB 4.48Å; S379-W444 VanDerWaalsContact OG-CZ3 3.27Å; S379-W444 WeakPolarHBondContact OG-CZ3 3.31Å; V410-W444 HydrophobicContact CG2-CD2 4.03Å; V410-W444 HydrophobicContact CG2-CG 4.24Å; V410-W444 HydrophobicContact CG2-CZ2 4.37Å; I413-W444 HydrophobicContact CG2-CB 4.34Å; A440-W444 WeakPolarHBondContact O-CB 3.37Å; A440-W444 PolarHBondContact O-N 2.73Å; F441-W444 PolarHBondContact O-N 2.89Å; W444-P446 VanDerWaalsContact C-CD 3.41Å; W444-P446 WeakPolarHBondContact O-CD 3.39Å
445	L	94.2	Very high	92.8	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.005	29%	0.286	C	S	.	.			trans	-118.9	71.8	175.4	-64.8	-179.5	0	0	0	110.7	I372 D373 L376 I413 A417 W423 F441 S447 L448	I372-L445 HydrophobicContact CG2-CD2 4.22Å; D373-L445 HydrophobicContact CB-CD2 4.27Å; D373-L445 WeakPolarHBondContact OD2-CA 3.44Å; L376-L445 HydrophobicContact CD2-CD2 3.69Å; L376-L445 HydrophobicContact CD2-CG 4.36Å; I413-L445 HydrophobicContact CG2-CD1 3.7Å; I413-L445 HydrophobicContact CG2-CD2 4.44Å; I413-L445 HydrophobicContact CG2-CG 3.74Å; A417-L445 HydrophobicContact CB-CD1 4.04Å; A417-L445 HydrophobicContact CB-CD2 4Å; W423-L445 HydrophobicContact CH2-CD1 4.08Å; F441-L445 HydrophobicContact CD1-CD1 4.18Å; F441-L445 PolarHBondContact O-N 3.41Å; L445-S447 PolarHBondContact O-N 3.17Å; L445-S447 VanDerWaalsContact O-N 3.1Å; L445-L448 HydrophobicContact CB-CD1 3.82Å; L445-L448 HydrophobicContact CB-CG 4.11Å; L445-L448 HydrophobicContact CD1-CD1 3.8Å; L445-L448 HydrophobicContact CG-CD1 4.49Å; L445-L448 WeakPolarHBondContact O-CB 3.38Å; L445-L448 PolarHBondContact O-N 2.86Å
446	P	92.2	Very high	92.8	Very high	77 Å²	77	50.3 Å²	50.3	50%	0.5	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-16.6	177.3	26.6	-36.3	0	0	0	113.6	D373 W444 L448	D373-P446 HydrophobicContact CB-CG 4.31Å; D373-P446 WeakPolarHBondContact OD2-CD 3.38Å; W444-P446 VanDerWaalsContact C-CD 3.41Å; W444-P446 WeakPolarHBondContact O-CD 3.39Å; P446-L448 PolarHBondContact O-N 2.84Å
447	S	92.3	Very high	92.6	Very high	58 Å²	58	50.4 Å²	50.4	41%	0.406	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	5.9	170.3	66.8	0	0	0	0	114.5	D373 R420 L445	D373-S447 VanDerWaalsContact CG-OG 3.26Å; D373-S447 VanDerWaalsContact OD1-CB 3.32Å; D373-S447 WeakPolarHBondContact OD1-CB 3.32Å; D373-S447 PolarHBondContact OD1-OG 3.36Å; D373-S447 WeakPolarHBondContact OD2-CB 3.29Å; D373-S447 PolarHBondContact OD2-N 3.48Å; D373-S447 PolarHBondContact OD2-OG 3.04Å; R420-S447 PolarHBondContact NH1-OG 2.92Å; R420-S447 PolarHBondContact NH2-O 3.33Å; L445-S447 PolarHBondContact O-N 3.17Å; L445-S447 VanDerWaalsContact O-N 3.1Å
448	L	92.9	Very high	92.2	Very high	10 Å²	10	56.7 Å²	56.7	5%	0.052	29%	0.291	C	S	.	.	S	Bend	trans	-102	127.9	167.5	-69.5	172.9	0	0	0	110.4	W423 F441 L445 P446 V468	W423-L448 HydrophobicContact CH2-CD1 4.03Å; W423-L448 HydrophobicContact CZ3-CD1 3.91Å; W423-L448 HydrophobicContact CZ3-CD2 3.79Å; W423-L448 HydrophobicContact CZ3-CG 4.47Å; F441-L448 HydrophobicContact CD1-CD1 4.36Å; L445-L448 HydrophobicContact CB-CD1 3.82Å; L445-L448 HydrophobicContact CB-CG 4.11Å; L445-L448 HydrophobicContact CD1-CD1 3.8Å; L445-L448 HydrophobicContact CG-CD1 4.49Å; L445-L448 WeakPolarHBondContact O-CB 3.38Å; L445-L448 PolarHBondContact O-N 2.86Å; P446-L448 PolarHBondContact O-N 2.84Å; L448-V468 HydrophobicContact CD1-CG2 3.96Å
449	S	91.4	Very high	91.4	Very high	66 Å²	66	58.1 Å²	58.1	46%	0.462	30%	0.303	S	S	.	.			trans	-64.3	141.2	170.1	58.6	0	0	0	0	110.2	D451 S452	S449-D451 PolarHBondContact O-N 2.86Å; S449-D451 VanDerWaalsContact O-N 3.12Å; S449-S452 WeakPolarHBondContact O-CB 3.44Å; S449-S452 PolarHBondContact O-N 3.45Å; S449-S452 PolarHBondContact O-OG 2.72Å; S449-S452 WeakPolarHBondContact OG-CB 3.25Å
450	P	90.6	Very high	90.7	Very high	71 Å²	71	63.2 Å²	63.2	46%	0.461	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-55.4	-31.4	179	-28.6	36.5	0	0	0	114	S452 I453	P450-S452 VanDerWaalsContact C-N 3.3Å; P450-S452 PolarHBondContact O-N 3.01Å; P450-I453 PolarHBondContact O-N 2.82Å
451	D	90.7	Very high	90	Very high	148 Å²	148	65.2 Å²	65.2	79%	0.791	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-73.8	-18.7	179.2	-46.2	-65.7	0	0	0	113.3	S449 I453	S449-D451 PolarHBondContact O-N 2.86Å; S449-D451 VanDerWaalsContact O-N 3.12Å; D451-I453 PolarHBondContact O-N 2.87Å
452	S	92.3	Very high	89.2	Confident	11 Å²	11	70 Å²	70	8%	0.077	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-76	-5.5	174.1	74.2	0	0	0	0	113.5	S449 P450 G466 L467 V468	S449-S452 WeakPolarHBondContact O-CB 3.44Å; S449-S452 PolarHBondContact O-N 3.45Å; S449-S452 PolarHBondContact O-OG 2.72Å; S449-S452 WeakPolarHBondContact OG-CB 3.25Å; P450-S452 VanDerWaalsContact C-N 3.3Å; P450-S452 PolarHBondContact O-N 3.01Å; S452-G466 CarbonylContact O-C 3.6Å; S452-G466 WeakPolarHBondContact O-CA 3.46Å; S452-L467 PolarHBondContact O-N 3.34Å; S452-V468 PolarHBondContact O-N 3.25Å
453	I	94.3	Very high	88.6	Confident	11 Å²	11	64 Å²	64	6%	0.056	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	95.8	-178.5	-55.3	167.4	0	0	0	109.4	A438 F441 R442 P450 D451 V455 V468 I470	A438-I453 HydrophobicContact CB-CG2 3.99Å; F441-I453 HydrophobicContact CB-CD1 3.77Å; R442-I453 HydrophobicContact CG-CD1 3.66Å; P450-I453 PolarHBondContact O-N 2.82Å; D451-I453 PolarHBondContact O-N 2.87Å; I453-V455 HydrophobicContact CG2-CG2 4.45Å; I453-V468 HydrophobicContact CG1-CB 4.38Å; I453-I470 HydrophobicContact CG2-CD1 3.91Å
454	N	94	Very high	88	Confident	24 Å²	24	58.4 Å²	58.4	13%	0.128	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	130.6	175.9	174.9	29.5	0	0	0	110.8	N462 S465 V468 N469 I470	N454-N462 PolarHBondContact ND2-O 3.35Å; N454-S465 PolarHBondContact ND2-OG 2.99Å; N454-S465 PolarHBondContact OD1-OG 3Å; N454-V468 PolarHBondContact N-O 2.8Å; N454-N469 HydrophobicContact CB-CB 4.5Å; N454-N469 WeakPolarHBondContact CB-OD1 3.36Å; N454-N469 PolarHBondContact ND2-OD1 3.28Å; N454-N469 CarbonylContact O-C 3.59Å; N454-N469 WeakPolarHBondContact O-CA 3.07Å; N454-I470 PolarHBondContact O-N 2.81Å
455	V	92.8	Very high	87.3	Confident	28 Å²	28	59.9 Å²	59.9	17%	0.17	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	104	176.8	-172.7	0	0	0	0	109.3	R434 F435 A438 I453 V457 I470	R434-V455 HydrophobicContact CB-CG1 4.1Å; F435-V455 HydrophobicContact CD1-CG1 4.22Å; F435-V455 HydrophobicContact CE1-CG1 3.98Å; F435-V455 HydrophobicContact CZ-CG1 4.46Å; A438-V455 HydrophobicContact CB-CG2 3.68Å; I453-V455 HydrophobicContact CG2-CG2 4.45Å; V455-V457 PolarHBondContact O-N 3.26Å; V455-I470 HydrophobicContact CG2-CB 4.47Å; V455-I470 HydrophobicContact CG2-CD1 4.3Å
456	A	88.9	Confident	86.9	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.008	34%	0.336	C	S	.	.			trans	-73.3	122	-179	0	0	0	0	0	111.3	R434 I463 I470 V471 L475	R434-A456 PolarHBondContact NH1-O 2.83Å; A456-I463 HydrophobicContact CB-CG2 3.85Å; A456-I470 PolarHBondContact N-O 3.33Å; A456-V471 HydrophobicContact CB-CB 4.26Å; A456-V471 HydrophobicContact CB-CG2 4.08Å; A456-L475 VanDerWaalsContact O-CD1 3.3Å; A456-L475 WeakPolarHBondContact O-CD1 3.26Å
457	V	85.3	Confident	86.9	Confident	74 Å²	74	61 Å²	61	45%	0.448	33%	0.334	S	S	.	.			trans	-103.1	-33.3	178.1	-176.5	0	0	0	0	111	F435 V455 E461	F435-V457 HydrophobicContact CZ-CG2 4.22Å; V455-V457 PolarHBondContact O-N 3.26Å; V457-E461 WeakPolarHBondContact CA-OE2 3.49Å; V457-E461 PolarHBondContact N-OE2 2.99Å
458	K	84.6	Confident	87.1	Confident	137 Å²	137	58.2 Å²	58.2	60%	0.596	32%	0.315	S	S	*	.	S	Bend	trans	-127	147.9	-176.6	-53.4	171.2	-162.7	138.9	0	111.5	K460 E461	K458-K460 PolarHBondContact O-N 2.86Å; K458-E461 HydrophobicContact CB-CG 4.21Å; K458-E461 WeakPolarHBondContact CB-OE1 3.29Å; K458-E461 VanDerWaalsContact CD-OE1 3.22Å; K458-E461 WeakPolarHBondContact CD-OE1 3.27Å; K458-E461 VanDerWaalsContact CG-OE1 3.25Å; K458-E461 WeakPolarHBondContact CG-OE1 3.34Å; K458-E461 PolarHBondContact N-OE2 3.29Å; K458-E461 IonicContact NZ-OE1 3.25Å; K458-E461 WeakPolarHBondContact O-CB 3.26Å; K458-E461 PolarHBondContact O-N 3.14Å
459	A	78.1	Confident	87.3	Confident	32 Å²	32	57.8 Å²	57.8	26%	0.264	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-5	-177.5	0	0	0	0	0	115.4	L475 R478 M479	A459-L475 HydrophobicContact CB-CD2 4.21Å; A459-R478 HydrophobicContact CB-CB 4.14Å; A459-M479 HydrophobicContact CB-CG 4.1Å
460	K	76.1	Confident	87.5	Confident	211 Å²	211	54.7 Å²	54.7	92%	0.917	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-1.7	173.5	-65.5	-169.4	176.1	-172	0	113.6	K458	K458-K460 PolarHBondContact O-N 2.86Å
461	E	80.4	Confident	87.7	Confident	56 Å²	56	51.3 Å²	51.3	26%	0.262	27%	0.269	S	S	.	.	S	Bend	trans	-83.9	143.5	-179.6	-70.5	157.3	-171.4	0	0	110.5	V457 K458 I463 M479	V457-E461 WeakPolarHBondContact CA-OE2 3.49Å; V457-E461 PolarHBondContact N-OE2 2.99Å; K458-E461 HydrophobicContact CB-CG 4.21Å; K458-E461 WeakPolarHBondContact CB-OE1 3.29Å; K458-E461 VanDerWaalsContact CD-OE1 3.22Å; K458-E461 WeakPolarHBondContact CD-OE1 3.27Å; K458-E461 VanDerWaalsContact CG-OE1 3.25Å; K458-E461 WeakPolarHBondContact CG-OE1 3.34Å; K458-E461 PolarHBondContact N-OE2 3.29Å; K458-E461 IonicContact NZ-OE1 3.25Å; K458-E461 WeakPolarHBondContact O-CB 3.26Å; K458-E461 PolarHBondContact O-N 3.14Å; E461-I463 PolarHBondContact O-N 2.77Å; E461-M479 VanDerWaalsContact O-CE 3.26Å; E461-M479 WeakPolarHBondContact O-CE 3.39Å
462	N	79.3	Confident	87.8	Confident	101 Å²	101	44.3 Å²	44.3	54%	0.54	23%	0.232	S	C	.	.			trans	-75.7	108.1	-177.2	-178.3	3.7	0	0	0	110.7	N454 R464 S465	N454-N462 PolarHBondContact ND2-O 3.35Å; N462-R464 PolarHBondContact O-N 2.77Å; N462-R464 WeakPolarHBondContact OD1-CB 3.2Å; N462-R464 PolarHBondContact OD1-N 3.49Å; N462-S465 PolarHBondContact O-N 3.11Å; N462-S465 PolarHBondContact O-OG 3.26Å
463	I	81.2	Confident	87.7	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.015	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	13.2	175.4	60.8	165.4	0	0	0	114.6	L426 A456 E461 N469 V471 M479 H483 F488	L426-I463 HydrophobicContact CD1-CD1 4.47Å; A456-I463 HydrophobicContact CB-CG2 3.85Å; E461-I463 PolarHBondContact O-N 2.77Å; I463-N469 WeakPolarHBondContact O-CB 3.49Å; I463-N469 PolarHBondContact O-OD1 3.33Å; I463-V471 HydrophobicContact CG2-CB 4.26Å; I463-V471 HydrophobicContact CG2-CG2 4.15Å; I463-M479 HydrophobicContact CB-CE 4.38Å; I463-M479 HydrophobicContact CD1-CE 4.35Å; I463-M479 HydrophobicContact CD1-SD 4.25Å; I463-M479 HydrophobicContact CG1-CE 3.99Å; I463-M479 HydrophobicContact CG1-SD 4.43Å; I463-M479 HydrophobicContact CG2-CE 3.72Å; I463-M479 HydrophobicContact CG2-SD 3.68Å; I463-H483 WeakPolarHBondContact CD1-NE2 3.32Å; I463-F488 HydrophobicContact CD1-CE2 4.08Å; I463-F488 HydrophobicContact CD1-CZ 4.17Å; I463-F488 HydrophobicContact CG1-CZ 4.24Å; I463-F488 VanDerWaalsContact O-CZ 3.25Å; I463-F488 WeakPolarHBondContact O-CZ 3.44Å
464	R	80.9	Confident	87.4	Confident	56 Å²	56	45.3 Å²	45.3	21%	0.211	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124	17.8	174.9	-60.9	-170.1	-177.5	104.4	-14.9	114	N462 H483 A484 G485 P486 F488	N462-R464 PolarHBondContact O-N 2.77Å; N462-R464 WeakPolarHBondContact OD1-CB 3.2Å; N462-R464 PolarHBondContact OD1-N 3.49Å; R464-H483 PolarHBondContact NH1-O 3.07Å; R464-H483 PolarHBondContact NH2-O 3.2Å; R464-A484 PolarHBondContact NH1-O 3.03Å; R464-G485 PolarHBondContact NH2-O 3.31Å; R464-G485 VanDerWaalsContact NH2-O 3.11Å; R464-P486 VanDerWaalsContact CZ-O 3.29Å; R464-P486 PolarHBondContact NE-O 2.82Å; R464-P486 PolarHBondContact NH2-O 2.96Å; R464-F488 HydrophobicContact CG-CE1 4.08Å; R464-F488 HydrophobicContact CG-CE2 4.36Å; R464-F488 HydrophobicContact CG-CZ 3.62Å
465	S	81.8	Confident	87.2	Confident	82 Å²	82	45.1 Å²	45.1	57%	0.573	24%	0.235	S	C	*	.	S	Bend	trans	-78	-17.2	177.5	54.2	0	0	0	0	114.4	N454 N462 N469	N454-S465 PolarHBondContact ND2-OG 2.99Å; N454-S465 PolarHBondContact OD1-OG 3Å; N462-S465 PolarHBondContact O-N 3.11Å; N462-S465 PolarHBondContact O-OG 3.26Å; S465-N469 PolarHBondContact N-OD1 2.89Å
466	G	85.2	Confident	87.1	Confident	11 Å²	11	44.1 Å²	44.1	11%	0.113	23%	0.229	C	C	.	.	S	Bend	trans	-111.9	168.9	178.6	0	0	0	0	0	113.7	S452 N469	S452-G466 CarbonylContact O-C 3.6Å; S452-G466 WeakPolarHBondContact O-CA 3.46Å; G466-N469 PolarHBondContact N-OD1 3.08Å; G466-N469 PolarHBondContact O-ND2 3.33Å; G466-N469 PolarHBondContact O-OD1 2.88Å
467	L	92.7	Very high	87	Confident	90 Å²	90	46 Å²	46	47%	0.471	24%	0.241	S	C	.	.	S	Bend	trans	-72.7	-35.6	164.1	-66.3	177.6	0	0	0	110.7	W423 P424 L425 S452	W423-L467 HydrophobicContact CE3-CB 4.25Å; P424-L467 WeakPolarHBondContact CA-O 3.28Å; L425-L467 PolarHBondContact N-O 3.11Å; S452-L467 PolarHBondContact O-N 3.34Å
468	V	96.3	Very high	87.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.4	169.4	-177	0	0	0	0	108.1	W423 L425 V427 F441 L448 S452 I453 N454 I470	W423-V468 HydrophobicContact CE3-CG2 3.98Å; W423-V468 HydrophobicContact CH2-CG2 3.9Å; W423-V468 HydrophobicContact CZ3-CG2 3.35Å; L425-V468 HydrophobicContact CD2-CG1 4.13Å; L425-V468 HydrophobicContact CD2-CG2 4.18Å; L425-V468 HydrophobicContact CG-CG1 4.47Å; V427-V468 HydrophobicContact CG2-CG1 4.45Å; F441-V468 HydrophobicContact CD1-CG1 4.44Å; F441-V468 HydrophobicContact CD1-CG2 4.42Å; F441-V468 HydrophobicContact CD2-CG1 3.86Å; F441-V468 HydrophobicContact CE1-CG1 4.24Å; F441-V468 HydrophobicContact CE1-CG2 4.45Å; F441-V468 HydrophobicContact CE2-CG1 3.64Å; F441-V468 HydrophobicContact CG-CG1 4.28Å; F441-V468 HydrophobicContact CZ-CG1 3.85Å; L448-V468 HydrophobicContact CD1-CG2 3.96Å; S452-V468 PolarHBondContact O-N 3.25Å; I453-V468 HydrophobicContact CG1-CB 4.38Å; N454-V468 PolarHBondContact N-O 2.8Å; V468-I470 HydrophobicContact CG1-CD1 4.42Å; V468-I470 HydrophobicContact CG1-CG1 4.13Å
469	N	95.6	Very high	86.8	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	123.5	-178.8	-57.2	-90.4	0	0	0	109.4	L425 L426 V427 N454 I463 S465 G466 F488	L425-N469 PolarHBondContact O-N 3.01Å; L425-N469 PolarHBondContact O-ND2 2.83Å; L426-N469 WeakPolarHBondContact CA-O 3.37Å; L426-N469 HydrophobicContact CD1-CB 4.31Å; V427-N469 PolarHBondContact N-O 2.82Å; N454-N469 HydrophobicContact CB-CB 4.5Å; N454-N469 WeakPolarHBondContact CB-OD1 3.36Å; N454-N469 PolarHBondContact ND2-OD1 3.28Å; N454-N469 CarbonylContact O-C 3.59Å; N454-N469 WeakPolarHBondContact O-CA 3.07Å; I463-N469 WeakPolarHBondContact O-CB 3.49Å; I463-N469 PolarHBondContact O-OD1 3.33Å; S465-N469 PolarHBondContact N-OD1 2.89Å; G466-N469 PolarHBondContact N-OD1 3.08Å; G466-N469 PolarHBondContact O-ND2 3.33Å; G466-N469 PolarHBondContact O-OD1 2.88Å; N469-F488 HydrophobicContact CB-CE1 4.44Å
470	I	96	Very high	86.3	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.5	-172	-53.4	174.7	0	0	0	109	V427 T429 R434 W437 A438 F441 I453 N454 V455 A456 V468	V427-I470 HydrophobicContact CB-CG1 4.24Å; V427-I470 WeakPolarHBondContact O-CA 2.94Å; T429-I470 HydrophobicContact CG2-CG2 4.02Å; R434-I470 HydrophobicContact CB-CG2 4.01Å; R434-I470 HydrophobicContact CG-CG2 4.1Å; W437-I470 HydrophobicContact CB-CD1 4.09Å; W437-I470 HydrophobicContact CB-CG2 4.36Å; A438-I470 HydrophobicContact CB-CD1 3.86Å; F441-I470 HydrophobicContact CD2-CD1 4.03Å; F441-I470 HydrophobicContact CE2-CD1 4.24Å; I453-I470 HydrophobicContact CG2-CD1 3.91Å; N454-I470 PolarHBondContact O-N 2.81Å; V455-I470 HydrophobicContact CG2-CB 4.47Å; V455-I470 HydrophobicContact CG2-CD1 4.3Å; A456-I470 PolarHBondContact N-O 3.33Å; V468-I470 HydrophobicContact CG1-CD1 4.42Å; V468-I470 HydrophobicContact CG1-CG1 4.13Å
471	V	94.6	Very high	85.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	162.1	-177.1	69.4	0	0	0	0	110.2	L426 V427 V428 T429 A456 I463 L475 M479	L426-V471 HydrophobicContact CD1-CG1 3.9Å; V427-V471 PolarHBondContact O-N 2.81Å; V428-V471 WeakPolarHBondContact CA-O 3.08Å; V428-V471 HydrophobicContact CB-CG1 4.45Å; V428-V471 HydrophobicContact CG1-CG1 4.36Å; V428-V471 HydrophobicContact CG2-CG1 3.9Å; T429-V471 PolarHBondContact N-O 2.98Å; T429-V471 VanDerWaalsContact N-O 3.13Å; A456-V471 HydrophobicContact CB-CB 4.26Å; A456-V471 HydrophobicContact CB-CG2 4.08Å; I463-V471 HydrophobicContact CG2-CB 4.26Å; I463-V471 HydrophobicContact CG2-CG2 4.15Å; V471-L475 HydrophobicContact CG2-CB 3.74Å; V471-L475 HydrophobicContact CG2-CD1 4.37Å; V471-M479 HydrophobicContact CG2-SD 4.43Å
472	S	92.9	Very high	84.6	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.007	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	155.7	171	75.5	0	0	0	0	113.4	T429 S431 D474 L475 L476	T429-S472 WeakPolarHBondContact O-CA 3.39Å; T429-S472 WeakPolarHBondContact O-CB 3.48Å; S431-S472 WeakPolarHBondContact OG-CB 3.42Å; S431-S472 PolarHBondContact OG-OG 2.79Å; S472-D474 PolarHBondContact O-N 2.72Å; S472-L475 PolarHBondContact O-N 2.92Å; S472-L475 VanDerWaalsContact O-N 3.16Å; S472-L475 PolarHBondContact OG-N 2.7Å; S472-L476 WeakPolarHBondContact O-CB 3.38Å; S472-L476 PolarHBondContact O-N 3.14Å
473	Y	91.8	Very high	83.6	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-53.3	-38.5	176.7	-70.6	-69.8	0	0	0	113.1	V428 S477 M493 D494 F498 L499	V428-Y473 HydrophobicContact CB-CE1 4.23Å; V428-Y473 HydrophobicContact CG1-CD1 3.44Å; V428-Y473 VanDerWaalsContact CG1-CD1 3.44Å; V428-Y473 HydrophobicContact CG1-CD2 4.3Å; V428-Y473 HydrophobicContact CG1-CE1 3.56Å; V428-Y473 HydrophobicContact CG1-CE2 4.42Å; V428-Y473 HydrophobicContact CG1-CG 3.82Å; Y473-S477 WeakPolarHBondContact O-CB 3.48Å; Y473-S477 PolarHBondContact O-N 3.08Å; Y473-S477 VanDerWaalsContact O-N 3.08Å; Y473-M493 HydrophobicContact CE1-SD 3.76Å; Y473-D494 WeakPolarHBondContact CE2-O 3.37Å; Y473-D494 PolarHBondContact OH-O 2.83Å; Y473-F498 HydrophobicContact CD2-CB 3.78Å; Y473-F498 HydrophobicContact CD2-CD1 4.01Å; Y473-F498 AromaticContact CD2-CG 3.98Å; Y473-F498 HydrophobicContact CD2-CG 3.98Å; Y473-F498 HydrophobicContact CE1-CB 4.48Å; Y473-F498 HydrophobicContact CE2-CB 3.68Å; Y473-F498 HydrophobicContact CE2-CG 4.11Å; Y473-F498 HydrophobicContact CG-CB 4.23Å; Y473-L499 HydrophobicContact CD1-CD2 4.02Å; Y473-L499 HydrophobicContact CE1-CD1 4.33Å; Y473-L499 HydrophobicContact CE1-CD2 3.71Å; Y473-L499 HydrophobicContact CE1-CG 3.96Å
474	D	88.2	Confident	82.2	Confident	42 Å²	42	59.3 Å²	59.3	23%	0.225	31%	0.305	C	S	.	.	H	α-helix	trans	-69.9	-42.8	-179.7	-51.7	-55.7	0	0	0	111.3	S431 S472 S477 R478 R506	S431-D474 PolarHBondContact OG-OD2 3.33Å; S472-D474 PolarHBondContact O-N 2.72Å; D474-S477 PolarHBondContact O-N 3.37Å; D474-S477 PolarHBondContact O-OG 3.22Å; D474-R478 WeakPolarHBondContact O-CD 3.11Å; D474-R478 VanDerWaalsContact O-CG 3.3Å; D474-R478 WeakPolarHBondContact O-CG 3.44Å; D474-R478 PolarHBondContact O-N 2.67Å; D474-R506 IonicContact OD1-CZ 3.27Å; D474-R506 IonicContact OD1-NE 2.68Å; D474-R506 PolarHBondContact OD1-NE 2.85Å; D474-R506 IonicContact OD1-NH2 3.33Å; D474-R506 PolarHBondContact OD1-NH2 3.14Å
475	L	89	Confident	81.4	Confident	19 Å²	19	59.1 Å²	59.1	10%	0.099	32%	0.321	C	S	.	.	H	α-helix	trans	-62.8	-51	173.7	-73.6	177.7	0	0	0	110.8	A456 A459 V471 S472 S477 R478 M479	A456-L475 VanDerWaalsContact O-CD1 3.3Å; A456-L475 WeakPolarHBondContact O-CD1 3.26Å; A459-L475 HydrophobicContact CB-CD2 4.21Å; V471-L475 HydrophobicContact CG2-CB 3.74Å; V471-L475 HydrophobicContact CG2-CD1 4.37Å; S472-L475 PolarHBondContact O-N 2.92Å; S472-L475 VanDerWaalsContact O-N 3.16Å; S472-L475 PolarHBondContact OG-N 2.7Å; L475-S477 PolarHBondContact O-N 3.22Å; L475-S477 VanDerWaalsContact O-N 3.14Å; L475-R478 CarbonylContact O-C 3.57Å; L475-R478 WeakPolarHBondContact O-CA 3.25Å; L475-R478 WeakPolarHBondContact O-CB 3.45Å; L475-R478 PolarHBondContact O-N 3.2Å; L475-M479 WeakPolarHBondContact O-CG 3.45Å; L475-M479 PolarHBondContact O-N 3.01Å; L475-M479 VanDerWaalsContact O-N 3.12Å
476	L	90	Very high	80.8	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-54	-35.9	178.7	-175.8	68	0	0	0	112.5	V428 S472 R478 A509 A510 L513	V428-L476 HydrophobicContact CG1-CD2 4.05Å; V428-L476 HydrophobicContact CG2-CD2 4.03Å; S472-L476 WeakPolarHBondContact O-CB 3.38Å; S472-L476 PolarHBondContact O-N 3.14Å; L476-R478 VanDerWaalsContact C-N 3.28Å; L476-R478 PolarHBondContact O-N 3.27Å; L476-A509 HydrophobicContact CG-CB 4.28Å; L476-A510 HydrophobicContact CD2-CB 4.12Å; L476-L513 HydrophobicContact CD1-CD1 4.05Å
477	S	88.1	Confident	80.6	Confident	39 Å²	39	62.5 Å²	62.5	27%	0.273	34%	0.339	S	S	.	.	H	α-helix	trans	-72.3	-17.3	176.7	78.6	0	0	0	0	114.9	Y473 D474 L475	Y473-S477 WeakPolarHBondContact O-CB 3.48Å; Y473-S477 PolarHBondContact O-N 3.08Å; Y473-S477 VanDerWaalsContact O-N 3.08Å; D474-S477 PolarHBondContact O-N 3.37Å; D474-S477 PolarHBondContact O-OG 3.22Å; L475-S477 PolarHBondContact O-N 3.22Å; L475-S477 VanDerWaalsContact O-N 3.14Å
478	R	85.6	Confident	80.5	Confident	188 Å²	188	58.7 Å²	58.7	71%	0.709	32%	0.319	S	S	*	.	H	α-helix	trans	-105.7	-10.2	-177.1	-66.6	171.9	-176.9	-168.8	0.9	114	A459 D474 L475 L476	A459-R478 HydrophobicContact CB-CB 4.14Å; D474-R478 WeakPolarHBondContact O-CD 3.11Å; D474-R478 VanDerWaalsContact O-CG 3.3Å; D474-R478 WeakPolarHBondContact O-CG 3.44Å; D474-R478 PolarHBondContact O-N 2.67Å; L475-R478 CarbonylContact O-C 3.57Å; L475-R478 WeakPolarHBondContact O-CA 3.25Å; L475-R478 WeakPolarHBondContact O-CB 3.45Å; L475-R478 PolarHBondContact O-N 3.2Å; L476-R478 VanDerWaalsContact C-N 3.28Å; L476-R478 PolarHBondContact O-N 3.27Å
479	M	80.3	Confident	80.4	Confident	24 Å²	24	60.5 Å²	60.5	12%	0.118	33%	0.328	C	S	.	.	S	Bend	trans	-78.4	146.5	178.4	-65.8	-175.5	74.7	0	0	111.2	A459 E461 I463 V471 L475 K481 H483	A459-M479 HydrophobicContact CB-CG 4.1Å; E461-M479 VanDerWaalsContact O-CE 3.26Å; E461-M479 WeakPolarHBondContact O-CE 3.39Å; I463-M479 HydrophobicContact CB-CE 4.38Å; I463-M479 HydrophobicContact CD1-CE 4.35Å; I463-M479 HydrophobicContact CD1-SD 4.25Å; I463-M479 HydrophobicContact CG1-CE 3.99Å; I463-M479 HydrophobicContact CG1-SD 4.43Å; I463-M479 HydrophobicContact CG2-CE 3.72Å; I463-M479 HydrophobicContact CG2-SD 3.68Å; V471-M479 HydrophobicContact CG2-SD 4.43Å; L475-M479 WeakPolarHBondContact O-CG 3.45Å; L475-M479 PolarHBondContact O-N 3.01Å; L475-M479 VanDerWaalsContact O-N 3.12Å; M479-K481 PolarHBondContact O-N 2.84Å; M479-H483 VanDerWaalsContact CB-CE1 3.44Å; M479-H483 WeakPolarHBondContact CB-CE1 3.42Å
480	D	66.2	Low	80.5	Confident	134 Å²	134	60.5 Å²	60.5	72%	0.717	33%	0.328	S	S	*	.			trans	-59.7	132.9	-174.8	-77.9	-57.6	0	0	0	112.8	Q482 H483	D480-Q482 PolarHBondContact O-N 3.4Å; D480-H483 PolarHBondContact O-CE1 2.7Å; D480-H483 PolarHBondContact O-ND1 3.08Å
481	K	65.6	Low	80.6	Confident	209 Å²	209	60.5 Å²	60.5	91%	0.909	33%	0.328	S	S	*	.	S	Bend	trans	-60.1	-17.6	-177.3	-64.5	175.3	-175.5	169.5	0	113.7	M479 H483	M479-K481 PolarHBondContact O-N 2.84Å; K481-H483 VanDerWaalsContact C-N 3.33Å; K481-H483 PolarHBondContact O-N 3.12Å
482	Q	54.7	Low	80.8	Confident	182 Å²	182	60.5 Å²	60.5	85%	0.85	33%	0.328	S	S	*	.			trans	-88.5	59.2	177.7	-61.5	-177.3	0.1	0	0	111.8	D480 A484	D480-Q482 PolarHBondContact O-N 3.4Å; Q482-A484 PolarHBondContact O-N 2.77Å
483	H	58.3	Low	81	Confident	60 Å²	60	60.4 Å²	60.4	28%	0.278	33%	0.328	S	S	.	.			trans	-71.5	65.9	173.2	-80	74.4	0	0	0	111.8	I463 R464 M479 D480 K481 G485	I463-H483 WeakPolarHBondContact CD1-NE2 3.32Å; R464-H483 PolarHBondContact NH1-O 3.07Å; R464-H483 PolarHBondContact NH2-O 3.2Å; M479-H483 VanDerWaalsContact CB-CE1 3.44Å; M479-H483 WeakPolarHBondContact CB-CE1 3.42Å; D480-H483 PolarHBondContact O-CE1 2.7Å; D480-H483 PolarHBondContact O-ND1 3.08Å; K481-H483 VanDerWaalsContact C-N 3.33Å; K481-H483 PolarHBondContact O-N 3.12Å; H483-G485 PolarHBondContact O-N 3.2Å
484	A	52.6	Low	81.2	Confident	97 Å²	97	61.1 Å²	61.1	80%	0.802	33%	0.332	S	S	*	.			trans	-51	129.8	175.3	0	0	0	0	0	111	R464 Q482	R464-A484 PolarHBondContact NH1-O 3.03Å; Q482-A484 PolarHBondContact O-N 2.77Å
485	G	63.5	Low	81.4	Confident	53 Å²	53	60.2 Å²	60.2	55%	0.546	33%	0.326	S	S	.	.	S	Bend	trans	129.7	171.8	-171.9	0	0	0	0	0	112.9	R464 H483	R464-G485 PolarHBondContact NH2-O 3.31Å; R464-G485 VanDerWaalsContact NH2-O 3.11Å; H483-G485 PolarHBondContact O-N 3.2Å
486	P	69.4	Low	81.7	Confident	83 Å²	83	59.3 Å²	59.3	54%	0.539	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-65.1	156	-174.6	26.1	-34.7	0	0	0	113.1	R464	R464-P486 VanDerWaalsContact CZ-O 3.29Å; R464-P486 PolarHBondContact NE-O 2.82Å; R464-P486 PolarHBondContact NH2-O 2.96Å
487	P	81.3	Confident	81.8	Confident	81 Å²	81	59 Å²	59	53%	0.526	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-69.4	148.1	170.9	31.1	-34.8	0	0	0	110.7
488	F	90.6	Very high	81.9	Confident	10 Å²	10	59.8 Å²	59.8	4%	0.044	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-75.2	125	165.5	-59.5	-85.3	0	0	0	108.8	P424 L426 I463 R464 N469 L491	P424-F488 HydrophobicContact CB-CD1 3.93Å; P424-F488 HydrophobicContact CB-CE1 4.17Å; P424-F488 HydrophobicContact CG-CD1 3.97Å; P424-F488 HydrophobicContact CG-CE1 4.39Å; L426-F488 HydrophobicContact CB-CB 4.16Å; L426-F488 HydrophobicContact CB-CD1 3.74Å; L426-F488 HydrophobicContact CB-CD2 4.08Å; L426-F488 HydrophobicContact CB-CE1 4.04Å; L426-F488 HydrophobicContact CB-CE2 4.37Å; L426-F488 HydrophobicContact CB-CG 3.75Å; L426-F488 HydrophobicContact CB-CZ 4.34Å; L426-F488 HydrophobicContact CD1-CE1 4.37Å; L426-F488 HydrophobicContact CD1-CE2 4.3Å; L426-F488 HydrophobicContact CD1-CZ 4.06Å; L426-F488 HydrophobicContact CD2-CD2 3.87Å; L426-F488 HydrophobicContact CD2-CE2 3.94Å; L426-F488 HydrophobicContact CD2-CG 4.38Å; L426-F488 HydrophobicContact CD2-CZ 4.5Å; L426-F488 HydrophobicContact CG-CD2 4.46Å; L426-F488 HydrophobicContact CG-CE2 4.44Å; I463-F488 HydrophobicContact CD1-CE2 4.08Å; I463-F488 HydrophobicContact CD1-CZ 4.17Å; I463-F488 HydrophobicContact CG1-CZ 4.24Å; I463-F488 VanDerWaalsContact O-CZ 3.25Å; I463-F488 WeakPolarHBondContact O-CZ 3.44Å; R464-F488 HydrophobicContact CG-CE1 4.08Å; R464-F488 HydrophobicContact CG-CE2 4.36Å; R464-F488 HydrophobicContact CG-CZ 3.62Å; N469-F488 HydrophobicContact CB-CE1 4.44Å; F488-L491 HydrophobicContact CB-CD1 3.53Å
489	N	94.1	Very high	82.2	Confident	37 Å²	37	50.9 Å²	50.9	20%	0.198	29%	0.285	C	S	.	.	S	Bend	trans	-80.9	-29.6	176.9	-59	-70	0	0	0	112.2	E422 K518 R519	E422-N489 HydrophobicContact CB-CB 3.99Å; E422-N489 VanDerWaalsContact O-CB 3.28Å; E422-N489 WeakPolarHBondContact O-CB 3.39Å; E422-N489 PolarHBondContact O-ND2 3.31Å; N489-K518 HydrophobicContact CB-CB 4.27Å; N489-K518 HydrophobicContact CB-CD 4Å; N489-K518 HydrophobicContact CB-CG 4.09Å; N489-K518 PolarHBondContact O-N 3.21Å; N489-K518 VanDerWaalsContact OD1-CE 3.24Å; N489-K518 WeakPolarHBondContact OD1-CE 3.25Å; N489-R519 PolarHBondContact O-N 2.59Å
490	V	97.6	Very high	82.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	119.6	-174.8	-169.7	0	0	0	0	109.5	A416 E422 L425 L426 R519	A416-V490 HydrophobicContact CB-CG1 4.3Å; E422-V490 HydrophobicContact CB-CG2 3.88Å; L425-V490 HydrophobicContact CD1-CB 4.05Å; L425-V490 HydrophobicContact CD1-CG1 3.69Å; L425-V490 WeakPolarHBondContact CD1-O 3.49Å; L426-V490 PolarHBondContact N-O 2.9Å; V490-R519 HydrophobicContact CB-CB 4.39Å; V490-R519 HydrophobicContact CG1-CB 4.09Å; V490-R519 HydrophobicContact CG2-CB 4.26Å; V490-R519 HydrophobicContact CG2-CG 3.97Å
491	L	97.9	Very high	83.4	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	131.1	179.2	-86.5	59.9	0	0	0	110.9	L426 F488 M493 L513 L514 A517 R519 I521	L426-L491 HydrophobicContact CB-CD1 4.4Å; L426-L491 HydrophobicContact CB-CG 4.36Å; L426-L491 HydrophobicContact CD2-CG 4.46Å; L426-L491 CarbonylContact O-C 3.59Å; L426-L491 WeakPolarHBondContact O-CA 3.47Å; F488-L491 HydrophobicContact CB-CD1 3.53Å; L491-M493 HydrophobicContact CD2-CE 3.98Å; L491-L513 HydrophobicContact CD2-CB 3.96Å; L491-L514 HydrophobicContact CB-CD2 4.29Å; L491-L514 HydrophobicContact CD2-CD2 3.7Å; L491-L514 HydrophobicContact CD2-CG 4.01Å; L491-A517 HydrophobicContact CD1-CB 3.61Å; L491-A517 HydrophobicContact CD2-CB 4.06Å; L491-A517 HydrophobicContact CG-CB 4.29Å; L491-R519 PolarHBondContact N-O 2.83Å; L491-I521 PolarHBondContact O-N 3.22Å
492	I	98.6	Very high	84.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.8	160.4	-62.5	170.4	0	0	0	108.3	A412 A416 L425 L426 V427 V428 W437 F441 I521 L523	A412-I492 HydrophobicContact CB-CD1 4.23Å; A416-I492 HydrophobicContact CB-CD1 4.03Å; L425-I492 HydrophobicContact CD1-CD1 4.26Å; L425-I492 HydrophobicContact CD1-CG1 4.19Å; L426-I492 PolarHBondContact O-N 2.94Å; V427-I492 WeakPolarHBondContact CA-O 3.39Å; V427-I492 HydrophobicContact CB-CB 4.45Å; V427-I492 HydrophobicContact CG1-CB 4.16Å; V427-I492 HydrophobicContact CG1-CG2 4.14Å; V427-I492 HydrophobicContact CG2-CB 4.17Å; V427-I492 HydrophobicContact CG2-CD1 4.09Å; V428-I492 PolarHBondContact N-O 3.35Å; W437-I492 HydrophobicContact CH2-CD1 4.35Å; W437-I492 HydrophobicContact CH2-CG2 3.89Å; W437-I492 HydrophobicContact CZ2-CG2 4.3Å; W437-I492 HydrophobicContact CZ3-CD1 4.1Å; W437-I492 HydrophobicContact CZ3-CG2 4.5Å; F441-I492 HydrophobicContact CZ-CD1 4.49Å; I492-I521 WeakPolarHBondContact CA-O 3.48Å; I492-I521 HydrophobicContact CG1-CB 4.13Å; I492-I521 HydrophobicContact CG1-CD1 4.02Å; I492-I521 HydrophobicContact CG1-CG2 4.48Å; I492-L523 HydrophobicContact CG2-CD1 3.85Å; I492-L523 HydrophobicContact CG2-CG 4.27Å
493	M	97.8	Very high	85.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	98.8	171	-67.8	-79.6	160	0	0	108.2	V428 Y473 L491 L499 A510 L514 I521 L522 L523	V428-M493 HydrophobicContact CB-CE 4.03Å; V428-M493 HydrophobicContact CB-SD 3.65Å; V428-M493 HydrophobicContact CG1-SD 4.25Å; V428-M493 HydrophobicContact CG2-CE 3.49Å; V428-M493 VanDerWaalsContact CG2-CE 3.49Å; V428-M493 HydrophobicContact CG2-SD 3.85Å; Y473-M493 HydrophobicContact CE1-SD 3.76Å; L491-M493 HydrophobicContact CD2-CE 3.98Å; M493-L499 HydrophobicContact CG-CD1 4.32Å; M493-L499 HydrophobicContact SD-CD1 4.06Å; M493-A510 HydrophobicContact CE-CB 4.15Å; M493-A510 HydrophobicContact SD-CB 4.38Å; M493-L514 HydrophobicContact CE-CD1 4.03Å; M493-L514 HydrophobicContact CE-CD2 3.87Å; M493-L514 HydrophobicContact CE-CG 3.92Å; M493-L514 HydrophobicContact CG-CD1 4.16Å; M493-L514 HydrophobicContact CG-CD2 3.71Å; M493-L514 HydrophobicContact CG-CG 4.43Å; M493-L514 HydrophobicContact SD-CD1 4.25Å; M493-L514 HydrophobicContact SD-CD2 4.48Å; M493-I521 PolarHBondContact N-O 2.72Å; M493-L522 HydrophobicContact CB-CD2 3.59Å; M493-L522 HydrophobicContact CG-CD2 3.77Å; M493-L523 PolarHBondContact O-N 3.2Å
494	D	96.5	Very high	87.2	Confident	16 Å²	16	34.1 Å²	34.1	9%	0.086	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	130.9	-178.2	-179.6	47.4	0	0	0	111.5	V428 T429 W437 Y473 L523	V428-D494 PolarHBondContact O-N 2.69Å; T429-D494 PolarHBondContact OG1-OD2 3.29Å; W437-D494 HydrophobicContact CZ2-CB 3.77Å; W437-D494 PolarHBondContact NE1-OD2 2.93Å; Y473-D494 WeakPolarHBondContact CE2-O 3.37Å; Y473-D494 PolarHBondContact OH-O 2.83Å; D494-L523 HydrophobicContact CB-CD1 4.29Å
495	E	92.7	Very high	88.9	Confident	23 Å²	23	32.2 Å²	32.2	11%	0.107	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	54.5	-168.6	-60.3	-75.9	-149	0	0	112.6	P430 H497 F498 L523 S524 G525 M737	P430-E495 HydrophobicContact CG-CB 4.04Å; P430-E495 HydrophobicContact CG-CG 4.33Å; E495-H497 PolarHBondContact O-N 3.41Å; E495-H497 IonicContact OE2-CE1 2.92Å; E495-H497 PolarHBondContact OE2-CE1 3.45Å; E495-H497 IonicContact OE2-ND1 3.68Å; E495-F498 WeakPolarHBondContact O-CD2 3.33Å; E495-F498 PolarHBondContact O-N 2.89Å; E495-L523 CarbonylContact C-O 3.55Å; E495-L523 WeakPolarHBondContact CA-O 3.42Å; E495-L523 PolarHBondContact N-O 3.25Å; E495-S524 WeakPolarHBondContact OE2-CA 3.5Å; E495-G525 PolarHBondContact OE2-N 3.28Å; E495-G525 VanDerWaalsContact OE2-N 3.11Å; E495-M737 HydrophobicContact CB-CE 3.56Å; E495-M737 HydrophobicContact CG-CE 3.61Å
496	S	95.1	Very high	90.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-57.3	-10.3	-174.7	61.8	0	0	0	0	116	F498 L499 L523 Q538	S496-F498 PolarHBondContact O-N 2.83Å; S496-L499 WeakPolarHBondContact O-CB 3.32Å; S496-L499 PolarHBondContact O-N 3.06Å; S496-L523 PolarHBondContact N-O 3.5Å; S496-L523 PolarHBondContact OG-O 3.43Å; S496-Q538 PolarHBondContact OG-OE1 3.03Å
497	H	90.9	Very high	91.2	Very high	3 Å²	3	30 Å²	30	1%	0.014	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-61.6	-18.3	169.1	62.6	-100.4	0	0	0	112.7	E495 L499 K500 S524 T526 M529 Q761	E495-H497 PolarHBondContact O-N 3.41Å; E495-H497 IonicContact OE2-CE1 2.92Å; E495-H497 PolarHBondContact OE2-CE1 3.45Å; E495-H497 IonicContact OE2-ND1 3.68Å; H497-L499 PolarHBondContact O-N 3.39Å; H497-L499 VanDerWaalsContact O-N 3.11Å; H497-K500 WeakPolarHBondContact O-CB 3.46Å; H497-K500 WeakPolarHBondContact O-CG 3.38Å; H497-K500 PolarHBondContact O-N 3.25Å; H497-K500 VanDerWaalsContact O-N 3.1Å; H497-S524 PolarHBondContact ND1-OG 3.38Å; H497-T526 WeakPolarHBondContact CB-O 3.34Å; H497-M529 HydrophobicContact CB-CE 4.48Å; H497-M529 HydrophobicContact CB-CG 4.16Å; H497-M529 HydrophobicContact CB-SD 4.4Å; H497-M529 PolarHBondContact CD2-SD 3.29Å; H497-Q761 PolarHBondContact CE1-NE2 3.22Å; H497-Q761 PolarHBondContact NE2-NE2 2.94Å
498	F	90.5	Very high	91.6	Very high	54 Å²	54	32.7 Å²	32.7	24%	0.237	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-61.1	-12.5	167.4	-89	-110.6	0	0	0	114.2	Y473 E495 S496 M737	Y473-F498 HydrophobicContact CD2-CB 3.78Å; Y473-F498 HydrophobicContact CD2-CD1 4.01Å; Y473-F498 AromaticContact CD2-CG 3.98Å; Y473-F498 HydrophobicContact CD2-CG 3.98Å; Y473-F498 HydrophobicContact CE1-CB 4.48Å; Y473-F498 HydrophobicContact CE2-CB 3.68Å; Y473-F498 HydrophobicContact CE2-CG 4.11Å; Y473-F498 HydrophobicContact CG-CB 4.23Å; E495-F498 WeakPolarHBondContact O-CD2 3.33Å; E495-F498 PolarHBondContact O-N 2.89Å; S496-F498 PolarHBondContact O-N 2.83Å; F498-M737 HydrophobicContact CD2-CE 4.17Å; F498-M737 HydrophobicContact CE2-CE 3.42Å; F498-M737 VanDerWaalsContact CE2-CE 3.42Å; F498-M737 HydrophobicContact CE2-SD 3.46Å; F498-M737 WeakPolarHBondContact CE2-SD 3.19Å; F498-M737 HydrophobicContact CZ-CE 4.15Å; F498-M737 HydrophobicContact CZ-SD 3.53Å; F498-M737 VanDerWaalsContact CZ-SD 3.53Å
499	L	91.1	Very high	91.6	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-100.1	1.8	176.7	-56.7	178	0	0	0	113.6	Y473 M493 S496 H497 N501 A510 L514 T537	Y473-L499 HydrophobicContact CD1-CD2 4.02Å; Y473-L499 HydrophobicContact CE1-CD1 4.33Å; Y473-L499 HydrophobicContact CE1-CD2 3.71Å; Y473-L499 HydrophobicContact CE1-CG 3.96Å; M493-L499 HydrophobicContact CG-CD1 4.32Å; M493-L499 HydrophobicContact SD-CD1 4.06Å; S496-L499 WeakPolarHBondContact O-CB 3.32Å; S496-L499 PolarHBondContact O-N 3.06Å; H497-L499 PolarHBondContact O-N 3.39Å; H497-L499 VanDerWaalsContact O-N 3.11Å; L499-N501 PolarHBondContact O-N 3.26Å; L499-A510 HydrophobicContact CD1-CB 4.39Å; L499-A510 HydrophobicContact CD2-CB 3.69Å; L499-L514 HydrophobicContact CD1-CD1 3.78Å; L499-T537 VanDerWaalsContact O-CB 3.23Å; L499-T537 WeakPolarHBondContact O-CB 3.34Å; L499-T537 WeakPolarHBondContact O-CG2 3.48Å; L499-T537 PolarHBondContact O-OG1 3Å
500	K	87.9	Confident	91.5	Very high	34 Å²	34	31.8 Å²	31.8	15%	0.148	16%	0.158	C	C	.	.			trans	-43.8	-43.7	-174.1	61	-175.6	-172.1	74	0	114.8	H497 M529 E534 T537 E840 D843	H497-K500 WeakPolarHBondContact O-CB 3.46Å; H497-K500 WeakPolarHBondContact O-CG 3.38Å; H497-K500 PolarHBondContact O-N 3.25Å; H497-K500 VanDerWaalsContact O-N 3.1Å; K500-M529 HydrophobicContact CD-CE 3.71Å; K500-E534 HydrophobicContact CB-CB 3.91Å; K500-E534 HydrophobicContact CB-CG 4.26Å; K500-E534 HydrophobicContact CD-CG 4.49Å; K500-T537 VanDerWaalsContact O-CG2 3.25Å; K500-T537 WeakPolarHBondContact O-CG2 3.49Å; K500-T537 PolarHBondContact O-OG1 3.45Å; K500-E840 WeakPolarHBondContact CD-OE1 3.46Å; K500-E840 WeakPolarHBondContact CE-OE1 3.46Å; K500-E840 WeakPolarHBondContact CG-OE1 3.46Å; K500-E840 IonicContact NZ-OE1 3.86Å; K500-E840 PolarHBondContact NZ-OE1 3.38Å; K500-D843 VanDerWaalsContact NZ-CG 3.34Å; K500-D843 IonicContact NZ-OD1 3.8Å; K500-D843 PolarHBondContact NZ-OD1 3.38Å; K500-D843 VanDerWaalsContact NZ-OD1 3.15Å; K500-D843 IonicContact NZ-OD2 3.9Å; K500-D843 PolarHBondContact NZ-OD2 3.47Å
501	N	85.6	Confident	91.2	Very high	11 Å²	11	32.7 Å²	32.7	6%	0.059	16%	0.163	C	C	.	.			trans	-108.6	114.3	-169.5	176.7	-2.4	0	0	0	112.2	L499 K503 T504 C507 E840 D843	L499-N501 PolarHBondContact O-N 3.26Å; N501-K503 PolarHBondContact O-N 2.8Å; N501-K503 VanDerWaalsContact O-N 3.17Å; N501-K503 VanDerWaalsContact OD1-CB 3.3Å; N501-K503 WeakPolarHBondContact OD1-CB 3.35Å; N501-K503 PolarHBondContact OD1-N 3.19Å; N501-T504 HydrophobicContact CB-CG2 3.83Å; N501-T504 WeakPolarHBondContact O-CB 2.87Å; N501-T504 WeakPolarHBondContact O-CG2 3.44Å; N501-T504 PolarHBondContact O-N 2.79Å; N501-T504 PolarHBondContact O-OG1 2.85Å; N501-C507 VanDerWaalsContact O-CB 3.29Å; N501-C507 WeakPolarHBondContact O-CB 3.45Å; N501-E840 HydrophobicContact CB-CB 4.43Å; N501-E840 PolarHBondContact ND2-O 3.35Å; N501-D843 PolarHBondContact ND2-OD2 3.02Å
502	M	86.2	Confident	90.9	Very high	78 Å²	78	36.4 Å²	36.4	38%	0.384	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.9	179	-66.8	-170.1	78.6	0	0	114.7	T504 L511 Y536 T537 L540	M502-T504 VanDerWaalsContact C-N 3.29Å; M502-T504 PolarHBondContact O-N 3.05Å; M502-L511 HydrophobicContact CE-CD2 3.84Å; M502-Y536 HydrophobicContact SD-CD1 3.97Å; M502-Y536 HydrophobicContact SD-CE1 3.64Å; M502-T537 HydrophobicContact CB-CG2 4.47Å; M502-T537 HydrophobicContact CG-CG2 3.35Å; M502-T537 HydrophobicContact SD-CG2 4.47Å; M502-L540 HydrophobicContact CE-CD2 4.09Å
503	K	84.8	Confident	90.6	Very high	104 Å²	104	39.2 Å²	39.2	45%	0.452	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-22.4	-179.5	-60.8	176.1	177.4	176.9	0	112	N501 K508 E841	N501-K503 PolarHBondContact O-N 2.8Å; N501-K503 VanDerWaalsContact O-N 3.17Å; N501-K503 VanDerWaalsContact OD1-CB 3.3Å; N501-K503 WeakPolarHBondContact OD1-CB 3.35Å; N501-K503 PolarHBondContact OD1-N 3.19Å; K503-K508 WeakPolarHBondContact O-CE 3.35Å; K503-K508 PolarHBondContact O-NZ 2.78Å; K503-E841 IonicContact NZ-OE1 3.58Å; K503-E841 PolarHBondContact NZ-OE1 3.39Å
504	T	86.8	Confident	90.4	Very high	29 Å²	29	39.2 Å²	39.2	18%	0.178	20%	0.202	C	C	.	.	S	Bend	trans	-68.3	150.5	-175.4	65.1	0	0	0	0	113.5	N501 M502 R506 C507 K508	N501-T504 HydrophobicContact CB-CG2 3.83Å; N501-T504 WeakPolarHBondContact O-CB 2.87Å; N501-T504 WeakPolarHBondContact O-CG2 3.44Å; N501-T504 PolarHBondContact O-N 2.79Å; N501-T504 PolarHBondContact O-OG1 2.85Å; M502-T504 VanDerWaalsContact C-N 3.29Å; M502-T504 PolarHBondContact O-N 3.05Å; T504-R506 VanDerWaalsContact C-N 3.28Å; T504-R506 PolarHBondContact O-N 2.86Å; T504-C507 PolarHBondContact O-N 2.96Å; T504-C507 VanDerWaalsContact OG1-CB 3.32Å; T504-C507 WeakPolarHBondContact OG1-CB 3.45Å; T504-C507 PolarHBondContact OG1-N 2.94Å; T504-C507 VanDerWaalsContact OG1-N 3.13Å; T504-K508 WeakPolarHBondContact O-CB 3.32Å; T504-K508 WeakPolarHBondContact O-CD 3.36Å; T504-K508 VanDerWaalsContact O-CG 3.28Å; T504-K508 WeakPolarHBondContact O-CG 3.4Å; T504-K508 PolarHBondContact O-N 3.16Å
505	A	87.6	Confident	90.1	Very high	57 Å²	57	43.2 Å²	43.2	47%	0.471	22%	0.219	S	C	.	.	H	α-helix	trans	-61	-37.5	173.3	0	0	0	0	0	112.3	K508 A509	A505-K508 PolarHBondContact O-N 3.22Å; A505-A509 WeakPolarHBondContact O-CB 3.44Å; A505-A509 PolarHBondContact O-N 2.76Å
506	R	90	Very high	90	Very high	88 Å²	88	45.4 Å²	45.4	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-58	-53.4	175.9	-61.7	176.8	-176	132.2	0	111.5	D474 T504 A509 A510	D474-R506 IonicContact OD1-CZ 3.27Å; D474-R506 IonicContact OD1-NE 2.68Å; D474-R506 PolarHBondContact OD1-NE 2.85Å; D474-R506 IonicContact OD1-NH2 3.33Å; D474-R506 PolarHBondContact OD1-NH2 3.14Å; T504-R506 VanDerWaalsContact C-N 3.28Å; T504-R506 PolarHBondContact O-N 2.86Å; R506-A509 PolarHBondContact O-N 3.12Å; R506-A510 WeakPolarHBondContact O-CB 3.44Å; R506-A510 PolarHBondContact O-N 2.75Å
507	C	90.9	Very high	90	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-38.4	178.7	-171.4	0	0	0	0	112.4	N501 T504 A509 A510 L511	N501-C507 VanDerWaalsContact O-CB 3.29Å; N501-C507 WeakPolarHBondContact O-CB 3.45Å; T504-C507 PolarHBondContact O-N 2.96Å; T504-C507 VanDerWaalsContact OG1-CB 3.32Å; T504-C507 WeakPolarHBondContact OG1-CB 3.45Å; T504-C507 PolarHBondContact OG1-N 2.94Å; T504-C507 VanDerWaalsContact OG1-N 3.13Å; C507-A509 VanDerWaalsContact C-N 3.27Å; C507-A509 PolarHBondContact O-N 2.93Å; C507-A510 PolarHBondContact O-N 2.83Å; C507-L511 WeakPolarHBondContact O-CB 3.44Å; C507-L511 PolarHBondContact O-N 2.98Å
508	K	90.1	Very high	90.2	Very high	137 Å²	137	50.7 Å²	50.7	60%	0.596	26%	0.264	S	S	*	.	H	α-helix	trans	-61.9	-31.9	176.6	-75.7	167.1	174.9	164.6	0	113.1	K503 T504 A505 P512	K503-K508 WeakPolarHBondContact O-CE 3.35Å; K503-K508 PolarHBondContact O-NZ 2.78Å; T504-K508 WeakPolarHBondContact O-CB 3.32Å; T504-K508 WeakPolarHBondContact O-CD 3.36Å; T504-K508 VanDerWaalsContact O-CG 3.28Å; T504-K508 WeakPolarHBondContact O-CG 3.4Å; T504-K508 PolarHBondContact O-N 3.16Å; A505-K508 PolarHBondContact O-N 3.22Å; K508-P512 WeakPolarHBondContact O-CD 3.41Å
509	A	90.3	Very high	90.6	Very high	28 Å²	28	50.1 Å²	50.1	23%	0.231	26%	0.261	C	S	.	.	H	α-helix	trans	-81.7	-41.7	175.6	0	0	0	0	0	113.2	L476 A505 R506 C507	L476-A509 HydrophobicContact CG-CB 4.28Å; A505-A509 WeakPolarHBondContact O-CB 3.44Å; A505-A509 PolarHBondContact O-N 2.76Å; R506-A509 PolarHBondContact O-N 3.12Å; C507-A509 VanDerWaalsContact C-N 3.27Å; C507-A509 PolarHBondContact O-N 2.93Å
510	A	92.9	Very high	90.9	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-78	-38.7	-175.6	0	0	0	0	0	114.2	L476 M493 L499 R506 C507 L513 L514	L476-A510 HydrophobicContact CD2-CB 4.12Å; M493-A510 HydrophobicContact CE-CB 4.15Å; M493-A510 HydrophobicContact SD-CB 4.38Å; L499-A510 HydrophobicContact CD1-CB 4.39Å; L499-A510 HydrophobicContact CD2-CB 3.69Å; R506-A510 WeakPolarHBondContact O-CB 3.44Å; R506-A510 PolarHBondContact O-N 2.75Å; C507-A510 PolarHBondContact O-N 2.83Å; A510-L513 WeakPolarHBondContact O-CB 3.37Å; A510-L513 PolarHBondContact O-N 3.19Å; A510-L513 VanDerWaalsContact O-N 3.12Å; A510-L514 HydrophobicContact CB-CD1 4.13Å; A510-L514 WeakPolarHBondContact O-CG 3.48Å; A510-L514 PolarHBondContact O-N 3.21Å
511	L	91.9	Very high	91.4	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.105	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-37.8	-171.4	-174.3	64.6	0	0	0	114.6	M502 C507 L513 L514 K515 L540 S541	M502-L511 HydrophobicContact CE-CD2 3.84Å; C507-L511 WeakPolarHBondContact O-CB 3.44Å; C507-L511 PolarHBondContact O-N 2.98Å; L511-L513 VanDerWaalsContact C-N 3.35Å; L511-L514 PolarHBondContact O-N 3.04Å; L511-K515 HydrophobicContact CD1-CG 4.45Å; L511-K515 HydrophobicContact CG-CD 4.43Å; L511-K515 WeakPolarHBondContact O-CG 3.46Å; L511-K515 PolarHBondContact O-N 2.9Å; L511-K515 VanDerWaalsContact O-N 3.12Å; L511-L540 HydrophobicContact CD1-CD2 4.28Å; L511-L540 HydrophobicContact CD1-CG 4.4Å; L511-L540 HydrophobicContact CD2-CD2 4.01Å; L511-S541 WeakPolarHBondContact CD1-OG 3.11Å
512	P	90.8	Very high	92	Very high	78 Å²	78	47.9 Å²	47.9	51%	0.506	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-40.9	173	-23.9	35.2	0	0	0	112.8	K508 K515 A516	K508-P512 WeakPolarHBondContact O-CD 3.41Å; P512-K515 PolarHBondContact O-N 2.72Å; P512-A516 WeakPolarHBondContact O-CB 3.5Å; P512-A516 PolarHBondContact O-N 2.86Å; P512-A516 VanDerWaalsContact O-N 3.13Å
513	L	92.1	Very high	92.5	Very high	59 Å²	59	44.2 Å²	44.2	31%	0.309	23%	0.232	S	C	.	.	H	α-helix	trans	-66.3	-43.7	179	-56.4	175.4	0	0	0	110.9	L426 L476 L491 A510 L511 K515 A516 A517	L426-L513 HydrophobicContact CD2-CD1 4.35Å; L476-L513 HydrophobicContact CD1-CD1 4.05Å; L491-L513 HydrophobicContact CD2-CB 3.96Å; A510-L513 WeakPolarHBondContact O-CB 3.37Å; A510-L513 PolarHBondContact O-N 3.19Å; A510-L513 VanDerWaalsContact O-N 3.12Å; L511-L513 VanDerWaalsContact C-N 3.35Å; L513-K515 VanDerWaalsContact C-N 3.29Å; L513-K515 PolarHBondContact O-N 2.72Å; L513-A516 PolarHBondContact O-N 2.97Å; L513-A516 VanDerWaalsContact O-N 3.15Å; L513-A517 WeakPolarHBondContact O-CB 3.34Å; L513-A517 PolarHBondContact O-N 2.82Å
514	L	94.1	Very high	93	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.9	-32.1	178.5	-70.9	162.3	0	0	0	113.3	R397 L491 M493 L499 A510 L511 V520 L522	R397-L514 PolarHBondContact NH2-O 2.68Å; L491-L514 HydrophobicContact CB-CD2 4.29Å; L491-L514 HydrophobicContact CD2-CD2 3.7Å; L491-L514 HydrophobicContact CD2-CG 4.01Å; M493-L514 HydrophobicContact CE-CD1 4.03Å; M493-L514 HydrophobicContact CE-CD2 3.87Å; M493-L514 HydrophobicContact CE-CG 3.92Å; M493-L514 HydrophobicContact CG-CD1 4.16Å; M493-L514 HydrophobicContact CG-CD2 3.71Å; M493-L514 HydrophobicContact CG-CG 4.43Å; M493-L514 HydrophobicContact SD-CD1 4.25Å; M493-L514 HydrophobicContact SD-CD2 4.48Å; L499-L514 HydrophobicContact CD1-CD1 3.78Å; A510-L514 HydrophobicContact CB-CD1 4.13Å; A510-L514 WeakPolarHBondContact O-CG 3.48Å; A510-L514 PolarHBondContact O-N 3.21Å; L511-L514 PolarHBondContact O-N 3.04Å; L514-V520 HydrophobicContact CD2-CB 4.38Å; L514-V520 HydrophobicContact CD2-CG1 3.56Å; L514-V520 HydrophobicContact CD2-CG2 3.92Å; L514-V520 WeakPolarHBondContact O-CG2 3.5Å; L514-L522 HydrophobicContact CD2-CD2 4.11Å
515	K	90.6	Very high	93.1	Very high	101 Å²	101	38 Å²	38	44%	0.439	20%	0.203	S	C	.	.	H	α-helix	trans	-77.4	-26.5	174.2	-72.6	-177.3	175.8	-169.3	0	113.6	L511 P512 L513 P544	L511-K515 HydrophobicContact CD1-CG 4.45Å; L511-K515 HydrophobicContact CG-CD 4.43Å; L511-K515 WeakPolarHBondContact O-CG 3.46Å; L511-K515 PolarHBondContact O-N 2.9Å; L511-K515 VanDerWaalsContact O-N 3.12Å; P512-K515 PolarHBondContact O-N 2.72Å; L513-K515 VanDerWaalsContact C-N 3.29Å; L513-K515 PolarHBondContact O-N 2.72Å; K515-P544 HydrophobicContact CG-CG 4.47Å
516	A	90.8	Very high	93.2	Very high	69 Å²	69	35.4 Å²	35.4	57%	0.57	18%	0.182	S	C	*	.	H	α-helix	trans	-89.7	-27.1	179.4	0	0	0	0	0	113.8	P512 L513	P512-A516 WeakPolarHBondContact O-CB 3.5Å; P512-A516 PolarHBondContact O-N 2.86Å; P512-A516 VanDerWaalsContact O-N 3.13Å; L513-A516 PolarHBondContact O-N 2.97Å; L513-A516 VanDerWaalsContact O-N 3.15Å
517	A	94.2	Very high	93.2	Very high	5 Å²	5	31.2 Å²	31.2	4%	0.041	17%	0.166	C	C	.	.			trans	-62.1	152	177	0	0	0	0	0	112.4	R397 L491 L513 V520	R397-A517 PolarHBondContact NH1-O 2.87Å; L491-A517 HydrophobicContact CD1-CB 3.61Å; L491-A517 HydrophobicContact CD2-CB 4.06Å; L491-A517 HydrophobicContact CG-CB 4.29Å; L513-A517 WeakPolarHBondContact O-CB 3.34Å; L513-A517 PolarHBondContact O-N 2.82Å; A517-V520 HydrophobicContact CB-CG2 3.97Å
518	K	95.6	Very high	93.2	Very high	108 Å²	108	31.2 Å²	31.2	47%	0.47	17%	0.166	S	C	.	.	S	Bend	trans	-77.8	-51	171.6	-62.7	-178.5	-176.5	172.2	0	111	R397 E422 N489	R397-K518 WeakPolarHBondContact CD-O 3.3Å; R397-K518 WeakPolarHBondContact CG-O 3.43Å; R397-K518 PolarHBondContact NH1-O 2.68Å; E422-K518 WeakPolarHBondContact OE2-CD 3.45Å; N489-K518 HydrophobicContact CB-CB 4.27Å; N489-K518 HydrophobicContact CB-CD 4Å; N489-K518 HydrophobicContact CB-CG 4.09Å; N489-K518 PolarHBondContact O-N 3.21Å; N489-K518 VanDerWaalsContact OD1-CE 3.24Å; N489-K518 WeakPolarHBondContact OD1-CE 3.25Å
519	R	97.4	Very high	92.8	Very high	43 Å²	43	25.4 Å²	25.4	16%	0.162	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.7	-177.5	-39.7	-60.9	171.1	168.6	5.5	109.4	Q395 G396 Y419 E422 N489 V490 L491	Q395-R519 WeakPolarHBondContact O-CD 3.23Å; Q395-R519 PolarHBondContact O-NH1 3.45Å; G396-R519 CarbonylContact O-C 3.58Å; G396-R519 WeakPolarHBondContact O-CA 3.39Å; Y419-R519 HydrophobicContact CD1-CG 4.39Å; Y419-R519 HydrophobicContact CD2-CG 4.01Å; Y419-R519 HydrophobicContact CG-CG 3.94Å; E422-R519 IonicContact OE1-CZ 2.67Å; E422-R519 IonicContact OE1-NE 2.74Å; E422-R519 PolarHBondContact OE1-NE 3.02Å; E422-R519 IonicContact OE1-NH2 3.5Å; E422-R519 PolarHBondContact OE1-NH2 3.42Å; E422-R519 WeakPolarHBondContact OE2-CG 3.17Å; E422-R519 IonicContact OE2-CZ 3.19Å; E422-R519 IonicContact OE2-NE 2.87Å; E422-R519 PolarHBondContact OE2-NE 2.77Å; E422-R519 IonicContact OE2-NH2 4Å; N489-R519 PolarHBondContact O-N 2.59Å; V490-R519 HydrophobicContact CB-CB 4.39Å; V490-R519 HydrophobicContact CG1-CB 4.09Å; V490-R519 HydrophobicContact CG2-CB 4.26Å; V490-R519 HydrophobicContact CG2-CG 3.97Å; L491-R519 PolarHBondContact N-O 2.83Å
520	V	98.1	Very high	92.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	109.7	-178.2	169.2	0	0	0	0	109	G396 R397 L398 L514 A517 L522 V542	G396-V520 CarbonylContact O-C 3.57Å; G396-V520 PolarHBondContact O-N 3.1Å; R397-V520 CarbonylContact C-O 3.56Å; R397-V520 VanDerWaalsContact CA-O 3.32Å; R397-V520 WeakPolarHBondContact CA-O 3.25Å; L398-V520 PolarHBondContact N-O 2.95Å; L514-V520 HydrophobicContact CD2-CB 4.38Å; L514-V520 HydrophobicContact CD2-CG1 3.56Å; L514-V520 HydrophobicContact CD2-CG2 3.92Å; L514-V520 WeakPolarHBondContact O-CG2 3.5Å; A517-V520 HydrophobicContact CB-CG2 3.97Å; V520-L522 HydrophobicContact CG1-CD2 3.68Å; V520-L522 HydrophobicContact CG1-CG 4Å; V520-V542 HydrophobicContact CG1-CG2 4.31Å
521	I	98.5	Very high	92.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	94.4	-177.8	-54.2	164.6	0	0	0	106.9	L398 A412 I415 A416 L491 I492 M493 L523	L398-I521 HydrophobicContact CD2-CB 4.46Å; L398-I521 HydrophobicContact CD2-CG1 4.18Å; L398-I521 HydrophobicContact CD2-CG2 4.28Å; A412-I521 HydrophobicContact CB-CG2 4.27Å; I415-I521 HydrophobicContact CB-CD1 4.03Å; I415-I521 HydrophobicContact CG2-CD1 3.58Å; I415-I521 HydrophobicContact CG2-CG1 3.98Å; A416-I521 HydrophobicContact CB-CD1 4.16Å; L491-I521 PolarHBondContact O-N 3.22Å; I492-I521 WeakPolarHBondContact CA-O 3.48Å; I492-I521 HydrophobicContact CG1-CB 4.13Å; I492-I521 HydrophobicContact CG1-CD1 4.02Å; I492-I521 HydrophobicContact CG1-CG2 4.48Å; M493-I521 PolarHBondContact N-O 2.72Å; I521-L523 HydrophobicContact CG2-CD2 3.75Å
522	L	98.4	Very high	92.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	136.2	172.6	-52	-171.9	0	0	0	109.3	L398 L399 L400 M493 L514 V520 Q538 V542	L398-L522 PolarHBondContact O-N 3.36Å; L399-L522 CarbonylContact C-O 3.59Å; L399-L522 WeakPolarHBondContact CA-O 3.42Å; L399-L522 HydrophobicContact CB-CB 4.35Å; L399-L522 HydrophobicContact CD1-CB 3.61Å; L399-L522 HydrophobicContact CD1-CD1 4.44Å; L400-L522 PolarHBondContact N-O 2.8Å; M493-L522 HydrophobicContact CB-CD2 3.59Å; M493-L522 HydrophobicContact CG-CD2 3.77Å; L514-L522 HydrophobicContact CD2-CD2 4.11Å; V520-L522 HydrophobicContact CG1-CD2 3.68Å; V520-L522 HydrophobicContact CG1-CG 4Å; L522-Q538 HydrophobicContact CD1-CB 3.67Å; L522-Q538 HydrophobicContact CD1-CG 4.04Å; L522-V542 HydrophobicContact CD1-CG2 3.58Å; L522-V542 HydrophobicContact CG-CG2 3.79Å
523	L	97.6	Very high	92.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.8	176	-43	175.3	0	0	0	108.8	L400 K408 A412 W437 I492 M493 D494 E495 S496 I521	L400-L523 HydrophobicContact CB-CD2 3.84Å; L400-L523 HydrophobicContact CD2-CD2 4.06Å; L400-L523 HydrophobicContact CG-CD2 4.5Å; K408-L523 HydrophobicContact CD-CB 4.4Å; A412-L523 HydrophobicContact CB-CD1 3.7Å; A412-L523 HydrophobicContact CB-CD2 3.84Å; A412-L523 HydrophobicContact CB-CG 4.37Å; W437-L523 HydrophobicContact CH2-CD1 3.73Å; W437-L523 HydrophobicContact CZ2-CD1 3.7Å; I492-L523 HydrophobicContact CG2-CD1 3.85Å; I492-L523 HydrophobicContact CG2-CG 4.27Å; M493-L523 PolarHBondContact O-N 3.2Å; D494-L523 HydrophobicContact CB-CD1 4.29Å; E495-L523 CarbonylContact C-O 3.55Å; E495-L523 WeakPolarHBondContact CA-O 3.42Å; E495-L523 PolarHBondContact N-O 3.25Å; S496-L523 PolarHBondContact N-O 3.5Å; S496-L523 PolarHBondContact OG-O 3.43Å; I521-L523 HydrophobicContact CG2-CD2 3.75Å
524	S	93.9	Very high	92.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.098	C	C	.	.			trans	-152.9	143.2	168.4	-171.9	0	0	0	0	111.2	L400 A401 K408 E495 H497 T526	L400-S524 PolarHBondContact O-N 2.87Å; A401-S524 CarbonylContact C-O 3.53Å; A401-S524 WeakPolarHBondContact CA-O 3.41Å; K408-S524 VanDerWaalsContact CE-C 3.48Å; K408-S524 WeakPolarHBondContact CE-O 3.3Å; K408-S524 PolarHBondContact NZ-O 3.43Å; E495-S524 WeakPolarHBondContact OE2-CA 3.5Å; H497-S524 PolarHBondContact ND1-OG 3.38Å; S524-T526 VanDerWaalsContact C-N 3.34Å; S524-T526 PolarHBondContact OG-N 2.83Å; S524-T526 PolarHBondContact OG-O 3.25Å
525	G	89.8	Confident	92.3	Very high	2 Å²	2	18.8 Å²	18.8	2%	0.021	10%	0.098	C	C	.	.	S	Bend	trans	-71.6	-30.3	165.9	0	0	0	0	0	113.4	E495 R592	E495-G525 PolarHBondContact OE2-N 3.28Å; E495-G525 VanDerWaalsContact OE2-N 3.11Å; G525-R592 PolarHBondContact O-NH1 3.08Å
526	T	88.9	Confident	92.5	Very high	4 Å²	4	14.5 Å²	14.5	3%	0.025	8%	0.079	C	C	.	.			trans	-141.3	85.5	-176	56.1	0	0	0	0	107.5	H497 S524 A528 I760 Q761	H497-T526 WeakPolarHBondContact CB-O 3.34Å; S524-T526 VanDerWaalsContact C-N 3.34Å; S524-T526 PolarHBondContact OG-N 2.83Å; S524-T526 PolarHBondContact OG-O 3.25Å; T526-A528 VanDerWaalsContact C-N 3.33Å; T526-A528 CarbonylContact C-O 3.59Å; T526-A528 PolarHBondContact O-N 3.01Å; T526-I760 HydrophobicContact CG2-CG2 4.2Å; T526-Q761 HydrophobicContact CG2-CG 4.21Å; T526-Q761 PolarHBondContact OG1-NE2 2.6Å
527	P	90.1	Very high	92.7	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.053	C	C	.	.	S	Bend	trans	-66.7	-35.1	-172.8	25.9	-33.8	0	0	0	112.2	L399 A401 L535 Q538 M590 L806	L399-P527 HydrophobicContact CD1-CB 4.4Å; L399-P527 HydrophobicContact CD2-CB 3.88Å; A401-P527 HydrophobicContact CB-CG 4.01Å; P527-L535 HydrophobicContact CB-CD2 3.87Å; P527-L535 HydrophobicContact CG-CD2 4.29Å; P527-Q538 PolarHBondContact O-NE2 3.25Å; P527-M590 HydrophobicContact CG-SD 4.43Å; P527-L806 HydrophobicContact CG-CD1 4.03Å; P527-L806 HydrophobicContact CG-CD2 3.62Å; P527-L806 HydrophobicContact CG-CG 4.38Å
528	A	90.4	Very high	92.7	Very high	2 Å²	2	11 Å²	11	2%	0.017	5%	0.051	C	C	.	.			trans	-99.8	143.9	152.8	0	0	0	0	0	108.6	T526 L535 L801 L806	T526-A528 VanDerWaalsContact C-N 3.33Å; T526-A528 CarbonylContact C-O 3.59Å; T526-A528 PolarHBondContact O-N 3.01Å; A528-L535 HydrophobicContact CB-CD1 4.35Å; A528-L535 HydrophobicContact CB-CD2 3.92Å; A528-L535 HydrophobicContact CB-CG 3.97Å; A528-L801 HydrophobicContact CB-CD2 3.65Å; A528-L806 HydrophobicContact CB-CD1 3.7Å
529	M	82.3	Confident	92.7	Very high	15 Å²	15	6 Å²	6	7%	0.074	3%	0.029	C	C	.	.	S	Bend	trans	-104.2	-27.4	173	-62.5	-164.1	-72.7	0	0	112.4	H497 K500 E534 N755 P756 G757	H497-M529 HydrophobicContact CB-CE 4.48Å; H497-M529 HydrophobicContact CB-CG 4.16Å; H497-M529 HydrophobicContact CB-SD 4.4Å; H497-M529 PolarHBondContact CD2-SD 3.29Å; K500-M529 HydrophobicContact CD-CE 3.71Å; M529-E534 WeakPolarHBondContact CA-OE2 3.47Å; M529-E534 WeakPolarHBondContact CB-OE2 3.42Å; M529-E534 PolarHBondContact N-OE2 3.22Å; M529-N755 WeakPolarHBondContact CB-OD1 3.49Å; M529-N755 PolarHBondContact O-OD1 3.49Å; M529-P756 WeakPolarHBondContact O-CG 3.4Å; M529-G757 PolarHBondContact O-N 2.88Å
530	S	84.8	Confident	92.6	Very high	11 Å²	11	4.3 Å²	4.3	8%	0.077	2%	0.023	C	C	.	.	S	Bend	trans	-144.2	-30.7	174.5	78	0	0	0	0	117.5	E534	S530-E534 VanDerWaalsContact CA-OE1 3.31Å; S530-E534 WeakPolarHBondContact CA-OE1 3.44Å; S530-E534 WeakPolarHBondContact CB-OE1 3.34Å; S530-E534 PolarHBondContact N-OE1 3.42Å; S530-E534 PolarHBondContact N-OE2 3.39Å; S530-E534 VanDerWaalsContact N-OE2 3.15Å; S530-E534 PolarHBondContact OG-OE1 2.97Å
531	R	88.2	Confident	92.4	Very high	18 Å²	18	4.3 Å²	4.3	7%	0.068	2%	0.023	C	C	.	.			trans	-143.1	156.3	-171.1	-64.4	175.9	-149.5	-114.4	17.2	112.6	C533 E534 S573 Q835 F838	R531-C533 VanDerWaalsContact C-N 3.29Å; R531-C533 VanDerWaalsContact CB-SG 3.56Å; R531-C533 PolarHBondContact O-N 3.13Å; R531-E534 PolarHBondContact N-OE1 3.06Å; R531-E534 WeakPolarHBondContact O-CB 3.45Å; R531-E534 PolarHBondContact O-N 2.91Å; R531-S573 WeakPolarHBondContact CD-O 3.16Å; R531-S573 PolarHBondContact NH1-O 2.53Å; R531-Q835 PolarHBondContact NH2-O 3.4Å; R531-F838 PolarHBondContact NH2-O 3.18Å; R531-F838 VanDerWaalsContact NH2-O 3.16Å
532	P	92.1	Very high	92.2	Very high	1 Å²	1	4.6 Å²	4.6	1%	0.006	3%	0.025	C	C	.	.	G	3₁₀ helix	trans	-65.1	-26.5	-179.9	24.7	-34	0	0	0	114.1	E534 L535 F553 Y557 L578 L581	P532-E534 PolarHBondContact O-N 3.08Å; P532-L535 WeakPolarHBondContact O-CB 3.43Å; P532-L535 PolarHBondContact O-N 2.93Å; P532-L535 VanDerWaalsContact O-N 3.14Å; P532-F553 WeakPolarHBondContact O-CE1 3.28Å; P532-Y557 VanDerWaalsContact CG-O 3.24Å; P532-Y557 WeakPolarHBondContact CG-O 3.44Å; P532-L578 HydrophobicContact CB-CD2 4.2Å; P532-L578 HydrophobicContact CG-CD2 4.17Å; P532-L581 HydrophobicContact CB-CD2 3.9Å
533	C	91.9	Very high	92	Very high	11 Å²	11	7.5 Å²	7.5	7%	0.074	4%	0.038	C	C	.	.	G	3₁₀ helix	trans	-58.1	-32.4	178.2	52.4	0	0	0	0	113.5	R531 L535 Y536 F550	R531-C533 VanDerWaalsContact C-N 3.29Å; R531-C533 VanDerWaalsContact CB-SG 3.56Å; R531-C533 PolarHBondContact O-N 3.13Å; C533-L535 PolarHBondContact O-N 3.02Å; C533-L535 VanDerWaalsContact O-N 3.15Å; C533-Y536 WeakPolarHBondContact O-CB 3.45Å; C533-Y536 PolarHBondContact O-N 2.68Å; C533-Y536 VanDerWaalsContact O-N 3.14Å; C533-F550 HydrophobicContact CB-CE2 4.3Å; C533-F550 HydrophobicContact CB-CZ 4.23Å
534	E	91.7	Very high	91.6	Very high	3 Å²	3	9.9 Å²	9.9	1%	0.014	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	-62.8	-19.3	179	-58.8	173.5	-147.3	0	0	113.6	K500 M529 S530 R531 P532 Q538	K500-E534 HydrophobicContact CB-CB 3.91Å; K500-E534 HydrophobicContact CB-CG 4.26Å; K500-E534 HydrophobicContact CD-CG 4.49Å; M529-E534 WeakPolarHBondContact CA-OE2 3.47Å; M529-E534 WeakPolarHBondContact CB-OE2 3.42Å; M529-E534 PolarHBondContact N-OE2 3.22Å; S530-E534 VanDerWaalsContact CA-OE1 3.31Å; S530-E534 WeakPolarHBondContact CA-OE1 3.44Å; S530-E534 WeakPolarHBondContact CB-OE1 3.34Å; S530-E534 PolarHBondContact N-OE1 3.42Å; S530-E534 PolarHBondContact N-OE2 3.39Å; S530-E534 VanDerWaalsContact N-OE2 3.15Å; S530-E534 PolarHBondContact OG-OE1 2.97Å; R531-E534 PolarHBondContact N-OE1 3.06Å; R531-E534 WeakPolarHBondContact O-CB 3.45Å; R531-E534 PolarHBondContact O-N 2.91Å; P532-E534 PolarHBondContact O-N 3.08Å; E534-Q538 PolarHBondContact O-NE2 3.49Å; E534-Q538 VanDerWaalsContact O-NE2 3.12Å
535	L	94.2	Very high	91.4	Very high	2 Å²	2	13.8 Å²	13.8	1%	0.01	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-80.2	-24.1	179	-62.4	168	0	0	0	112.4	P527 A528 P532 C533 T537 Q538 I539 L581 L585 V804 L806	P527-L535 HydrophobicContact CB-CD2 3.87Å; P527-L535 HydrophobicContact CG-CD2 4.29Å; A528-L535 HydrophobicContact CB-CD1 4.35Å; A528-L535 HydrophobicContact CB-CD2 3.92Å; A528-L535 HydrophobicContact CB-CG 3.97Å; P532-L535 WeakPolarHBondContact O-CB 3.43Å; P532-L535 PolarHBondContact O-N 2.93Å; P532-L535 VanDerWaalsContact O-N 3.14Å; C533-L535 PolarHBondContact O-N 3.02Å; C533-L535 VanDerWaalsContact O-N 3.15Å; L535-T537 VanDerWaalsContact C-N 3.31Å; L535-T537 PolarHBondContact O-N 3.44Å; L535-Q538 PolarHBondContact O-N 3.25Å; L535-I539 HydrophobicContact CB-CD1 3.99Å; L535-I539 WeakPolarHBondContact O-CG1 3.49Å; L535-I539 PolarHBondContact O-N 2.95Å; L535-L581 HydrophobicContact CD1-CD2 4.17Å; L535-L585 HydrophobicContact CD1-CD1 4.04Å; L535-V804 HydrophobicContact CD1-CG1 4.02Å; L535-L806 HydrophobicContact CD1-CD1 4.34Å; L535-L806 HydrophobicContact CD2-CD1 4.3Å
536	Y	94.8	Very high	91.5	Very high	10 Å²	10	14 Å²	14	4%	0.039	8%	0.081	C	C	.	.	H	α-helix	trans	-57.6	-41	-169.5	174.7	-101.6	0	0	0	113.1	M502 C533 Q538 I539 L540 F547 R549 F550 F553	M502-Y536 HydrophobicContact SD-CD1 3.97Å; M502-Y536 HydrophobicContact SD-CE1 3.64Å; C533-Y536 WeakPolarHBondContact O-CB 3.45Å; C533-Y536 PolarHBondContact O-N 2.68Å; C533-Y536 VanDerWaalsContact O-N 3.14Å; Y536-Q538 VanDerWaalsContact C-N 3.32Å; Y536-Q538 PolarHBondContact O-N 2.92Å; Y536-I539 PolarHBondContact O-N 3.35Å; Y536-L540 HydrophobicContact CE1-CB 4.45Å; Y536-L540 HydrophobicContact CE1-CD2 3.75Å; Y536-L540 WeakPolarHBondContact O-CB 3.39Å; Y536-L540 PolarHBondContact O-N 3.25Å; Y536-F547 HydrophobicContact CD2-CB 4.41Å; Y536-F547 HydrophobicContact CE2-CB 3.9Å; Y536-F547 PolarHBondContact OH-O 3.18Å; Y536-R549 VanDerWaalsContact OH-C 3.28Å; Y536-F550 HydrophobicContact CD1-CB 4.18Å; Y536-F550 AromaticContact CD1-CD2 3.6Å; Y536-F550 HydrophobicContact CD1-CD2 3.6Å; Y536-F550 HydrophobicContact CD1-CE2 4.46Å; Y536-F550 HydrophobicContact CD1-CG 4.29Å; Y536-F550 HydrophobicContact CD2-CD2 4.03Å; Y536-F550 HydrophobicContact CE1-CB 3.76Å; Y536-F550 HydrophobicContact CE1-CD2 4.08Å; Y536-F550 HydrophobicContact CE1-CG 4.35Å; Y536-F550 HydrophobicContact CE2-CB 4.3Å; Y536-F550 HydrophobicContact CE2-CD2 4.47Å; Y536-F550 AromaticContact CG-CD2 3.57Å; Y536-F550 HydrophobicContact CG-CD2 3.57Å; Y536-F550 HydrophobicContact CG-CE2 4.27Å; Y536-F550 PolarHBondContact OH-N 2.93Å; Y536-F550 VanDerWaalsContact OH-N 3.1Å; Y536-F553 HydrophobicContact CD2-CB 3.84Å; Y536-F553 HydrophobicContact CD2-CD1 4.06Å; Y536-F553 HydrophobicContact CD2-CD2 4.46Å; Y536-F553 AromaticContact CD2-CG 3.86Å; Y536-F553 HydrophobicContact CD2-CG 3.86Å; Y536-F553 HydrophobicContact CE2-CB 4.23Å; Y536-F553 HydrophobicContact CG-CD1 4.41Å
537	T	93.4	Very high	91.6	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.006	8%	0.082	C	C	.	.	H	α-helix	trans	-67.9	-32.8	-179.8	57.7	0	0	0	0	112.9	L499 K500 M502 L535 S541	L499-T537 VanDerWaalsContact O-CB 3.23Å; L499-T537 WeakPolarHBondContact O-CB 3.34Å; L499-T537 WeakPolarHBondContact O-CG2 3.48Å; L499-T537 PolarHBondContact O-OG1 3Å; K500-T537 VanDerWaalsContact O-CG2 3.25Å; K500-T537 WeakPolarHBondContact O-CG2 3.49Å; K500-T537 PolarHBondContact O-OG1 3.45Å; M502-T537 HydrophobicContact CB-CG2 4.47Å; M502-T537 HydrophobicContact CG-CG2 3.35Å; M502-T537 HydrophobicContact SD-CG2 4.47Å; L535-T537 VanDerWaalsContact C-N 3.31Å; L535-T537 PolarHBondContact O-N 3.44Å; T537-S541 VanDerWaalsContact O-CB 3.32Å; T537-S541 WeakPolarHBondContact O-CB 3.05Å; T537-S541 PolarHBondContact O-N 3.24Å; T537-S541 PolarHBondContact O-OG 3.17Å
538	Q	95.6	Very high	91.4	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-74.4	-44	177.9	-64.8	169	91	0	0	109.9	S496 L522 P527 E534 L535 Y536 L540 S541 V542	S496-Q538 PolarHBondContact OG-OE1 3.03Å; L522-Q538 HydrophobicContact CD1-CB 3.67Å; L522-Q538 HydrophobicContact CD1-CG 4.04Å; P527-Q538 PolarHBondContact O-NE2 3.25Å; E534-Q538 PolarHBondContact O-NE2 3.49Å; E534-Q538 VanDerWaalsContact O-NE2 3.12Å; L535-Q538 PolarHBondContact O-N 3.25Å; Y536-Q538 VanDerWaalsContact C-N 3.32Å; Y536-Q538 PolarHBondContact O-N 2.92Å; Q538-L540 PolarHBondContact O-N 3.33Å; Q538-S541 PolarHBondContact O-N 3.41Å; Q538-V542 WeakPolarHBondContact O-CG2 3.46Å; Q538-V542 PolarHBondContact O-N 2.86Å
539	I	95.4	Very high	91.4	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.015	14%	0.138	C	C	.	.	H	α-helix	trans	-57.6	-50.2	171.4	-61.4	163.1	0	0	0	110.8	L535 Y536 S541 V542 K543 L546 F547 F553 L585 L589	L535-I539 HydrophobicContact CB-CD1 3.99Å; L535-I539 WeakPolarHBondContact O-CG1 3.49Å; L535-I539 PolarHBondContact O-N 2.95Å; Y536-I539 PolarHBondContact O-N 3.35Å; I539-S541 PolarHBondContact O-N 2.77Å; I539-V542 PolarHBondContact O-N 3.19Å; I539-K543 CarbonylContact O-C 3.55Å; I539-K543 PolarHBondContact O-N 2.88Å; I539-L546 HydrophobicContact CG2-CB 4.4Å; I539-L546 HydrophobicContact CG2-CD2 3.92Å; I539-F547 HydrophobicContact CG2-CD2 3.99Å; I539-F553 HydrophobicContact CD1-CD2 4.29Å; I539-F553 HydrophobicContact CD1-CE2 3.51Å; I539-F553 HydrophobicContact CD1-CZ 3.93Å; I539-L585 HydrophobicContact CD1-CD2 3.83Å; I539-L585 HydrophobicContact CG1-CD2 3.7Å; I539-L589 HydrophobicContact CB-CD2 4.34Å; I539-L589 HydrophobicContact CG1-CD2 4.29Å; I539-L589 HydrophobicContact CG2-CD2 3.94Å
540	L	94.6	Very high	91.8	Very high	6 Å²	6	28.5 Å²	28.5	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-63.8	-25.8	179.5	-177.4	68.3	0	0	0	113.1	M502 L511 Y536 Q538 P544	M502-L540 HydrophobicContact CE-CD2 4.09Å; L511-L540 HydrophobicContact CD1-CD2 4.28Å; L511-L540 HydrophobicContact CD1-CG 4.4Å; L511-L540 HydrophobicContact CD2-CD2 4.01Å; Y536-L540 HydrophobicContact CE1-CB 4.45Å; Y536-L540 HydrophobicContact CE1-CD2 3.75Å; Y536-L540 WeakPolarHBondContact O-CB 3.39Å; Y536-L540 PolarHBondContact O-N 3.25Å; Q538-L540 PolarHBondContact O-N 3.33Å; L540-P544 WeakPolarHBondContact O-CA 3.24Å; L540-P544 WeakPolarHBondContact O-CG 3.28Å
541	S	93.9	Very high	92.1	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-79.4	-41.7	175.5	-63.4	0	0	0	0	111.9	R397 L511 T537 Q538 I539	R397-S541 PolarHBondContact NH2-O 3.38Å; L511-S541 WeakPolarHBondContact CD1-OG 3.11Å; T537-S541 VanDerWaalsContact O-CB 3.32Å; T537-S541 WeakPolarHBondContact O-CB 3.05Å; T537-S541 PolarHBondContact O-N 3.24Å; T537-S541 PolarHBondContact O-OG 3.17Å; Q538-S541 PolarHBondContact O-N 3.41Å; I539-S541 PolarHBondContact O-N 2.77Å
542	V	95.4	Very high	92.2	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.03	18%	0.176	C	C	.	.	H	α-helix	trans	-77.9	-51.4	-179.6	-178.8	0	0	0	0	111.6	R397 V520 L522 Q538 I539 L589	R397-V542 VanDerWaalsContact C-CG1 3.4Å; R397-V542 HydrophobicContact CB-CG1 4Å; R397-V542 PolarHBondContact NE-O 3.09Å; R397-V542 WeakPolarHBondContact O-CG1 3.39Å; V520-V542 HydrophobicContact CG1-CG2 4.31Å; L522-V542 HydrophobicContact CD1-CG2 3.58Å; L522-V542 HydrophobicContact CG-CG2 3.79Å; Q538-V542 WeakPolarHBondContact O-CG2 3.46Å; Q538-V542 PolarHBondContact O-N 2.86Å; I539-V542 PolarHBondContact O-N 3.19Å; V542-L589 HydrophobicContact CB-CB 4.31Å; V542-L589 HydrophobicContact CG1-CB 3.73Å
543	K	93.1	Very high	92.3	Very high	62 Å²	62	34.8 Å²	34.8	27%	0.27	18%	0.176	S	C	.	.			trans	-131.1	77	-173.5	-165.6	173.8	178.4	176.8	0	110.7	I539 S545 L546 C588 L589	I539-K543 CarbonylContact O-C 3.55Å; I539-K543 PolarHBondContact O-N 2.88Å; K543-S545 PolarHBondContact O-N 3.01Å; K543-L546 HydrophobicContact CB-CB 4.32Å; K543-L546 HydrophobicContact CD-CB 4.17Å; K543-L546 HydrophobicContact CD-CD1 4.21Å; K543-L546 HydrophobicContact CD-CD2 4.39Å; K543-L546 HydrophobicContact CG-CB 4.06Å; K543-L546 WeakPolarHBondContact O-CB 3.36Å; K543-L546 PolarHBondContact O-N 3.45Å; K543-C588 HydrophobicContact CD-CB 4Å; K543-C588 PolarHBondContact NZ-SG 2.96Å; K543-L589 HydrophobicContact CB-CD2 4.36Å
544	P	89.8	Confident	92.3	Very high	50 Å²	50	34.3 Å²	34.3	33%	0.325	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.2	-170.5	-22.8	30.4	0	0	0	115.9	K515 L540	K515-P544 HydrophobicContact CG-CG 4.47Å; L540-P544 WeakPolarHBondContact O-CA 3.24Å; L540-P544 WeakPolarHBondContact O-CG 3.28Å
545	S	89.7	Confident	92.3	Very high	81 Å²	81	37.2 Å²	37.2	57%	0.566	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-12	178.9	51.6	0	0	0	0	114.6	K543	K543-S545 PolarHBondContact O-N 3.01Å
546	L	90.6	Very high	92.3	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.042	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-44.7	-174.8	-165.8	69.2	0	0	0	112.1	A345 I539 K543 L584 C588 L589	A345-L546 HydrophobicContact CB-CD1 3.69Å; A345-L546 HydrophobicContact CB-CG 3.95Å; I539-L546 HydrophobicContact CG2-CB 4.4Å; I539-L546 HydrophobicContact CG2-CD2 3.92Å; K543-L546 HydrophobicContact CB-CB 4.32Å; K543-L546 HydrophobicContact CD-CB 4.17Å; K543-L546 HydrophobicContact CD-CD1 4.21Å; K543-L546 HydrophobicContact CD-CD2 4.39Å; K543-L546 HydrophobicContact CG-CB 4.06Å; K543-L546 WeakPolarHBondContact O-CB 3.36Å; K543-L546 PolarHBondContact O-N 3.45Å; L546-L584 HydrophobicContact CD1-CD1 4.45Å; L546-L584 HydrophobicContact CD2-CG 4.43Å; L546-C588 HydrophobicContact CD2-CB 3.96Å; L546-L589 HydrophobicContact CD2-CD2 4.17Å
547	F	91	Very high	92.3	Very high	11 Å²	11	37.2 Å²	37.2	5%	0.048	19%	0.19	C	C	.	.			trans	-135.9	90.9	171.9	-63.8	-77.2	0	0	0	108.8	A345 Y536 I539 R549 F553 Y557 L584	A345-F547 HydrophobicContact CB-CE1 3.88Å; A345-F547 HydrophobicContact CB-CE2 4.19Å; A345-F547 HydrophobicContact CB-CZ 3.64Å; Y536-F547 HydrophobicContact CD2-CB 4.41Å; Y536-F547 HydrophobicContact CE2-CB 3.9Å; Y536-F547 PolarHBondContact OH-O 3.18Å; I539-F547 HydrophobicContact CG2-CD2 3.99Å; F547-R549 PolarHBondContact O-N 2.9Å; F547-F553 HydrophobicContact CB-CB 4.24Å; F547-F553 HydrophobicContact CD1-CB 4.03Å; F547-F553 HydrophobicContact CD1-CD2 4.25Å; F547-F553 AromaticContact CD2-CD2 3.8Å; F547-F553 HydrophobicContact CD2-CD2 3.8Å; F547-F553 HydrophobicContact CE1-CD2 4.33Å; F547-F553 AromaticContact CE2-CD2 3.88Å; F547-F553 HydrophobicContact CE2-CD2 3.88Å; F547-F553 HydrophobicContact CE2-CE2 4.37Å; F547-F553 HydrophobicContact CG-CB 4.08Å; F547-F553 AromaticContact CG-CD2 3.99Å; F547-F553 HydrophobicContact CG-CD2 3.99Å; F547-F553 HydrophobicContact CZ-CD2 4.15Å; F547-Y557 AromaticContact CE1-CE2 3.84Å; F547-Y557 HydrophobicContact CE1-CE2 3.84Å; F547-Y557 HydrophobicContact CE2-CE2 4.45Å; F547-Y557 HydrophobicContact CZ-CD2 4.45Å; F547-Y557 AromaticContact CZ-CE2 3.53Å; F547-Y557 HydrophobicContact CZ-CE2 3.53Å; F547-L584 HydrophobicContact CE2-CD2 3.72Å; F547-L584 HydrophobicContact CZ-CD2 3.49Å; F547-L584 VanDerWaalsContact CZ-CD2 3.49Å
548	P	86.5	Confident	92.3	Very high	86 Å²	86	37.2 Å²	37.2	56%	0.558	19%	0.19	S	C	*	.	S	Bend	trans	-66.6	-22.2	-178	-23	35.3	0	0	0	113.7
549	R	89.6	Confident	92.1	Very high	165 Å²	165	39.7 Å²	39.7	62%	0.623	20%	0.203	S	C	*	.	S	Bend	trans	-128.5	139	179.6	-57.5	-168.5	-176.8	128.7	-15.3	111.6	Y536 F547 H551 E552	Y536-R549 VanDerWaalsContact OH-C 3.28Å; F547-R549 PolarHBondContact O-N 2.9Å; R549-H551 VanDerWaalsContact C-N 3.34Å; R549-H551 PolarHBondContact O-N 3.27Å; R549-E552 HydrophobicContact CB-CG 4.27Å; R549-E552 VanDerWaalsContact CD-OE1 3.3Å; R549-E552 WeakPolarHBondContact CD-OE1 3.25Å; R549-E552 IonicContact CZ-OE1 3.82Å; R549-E552 IonicContact NE-OE1 2.72Å; R549-E552 IonicContact NH1-OE1 3.22Å; R549-E552 PolarHBondContact NH1-OE1 2.93Å; R549-E552 PolarHBondContact O-N 3.26Å
550	F	91.1	Very high	91.9	Very high	63 Å²	63	40.3 Å²	40.3	28%	0.276	21%	0.209	S	C	.	.	H	α-helix	trans	-63.2	-37.5	178.3	176.9	-115.5	0	0	0	112.8	C533 Y536 E552 F553 G554 Y572	C533-F550 HydrophobicContact CB-CE2 4.3Å; C533-F550 HydrophobicContact CB-CZ 4.23Å; Y536-F550 HydrophobicContact CD1-CB 4.18Å; Y536-F550 AromaticContact CD1-CD2 3.6Å; Y536-F550 HydrophobicContact CD1-CD2 3.6Å; Y536-F550 HydrophobicContact CD1-CE2 4.46Å; Y536-F550 HydrophobicContact CD1-CG 4.29Å; Y536-F550 HydrophobicContact CD2-CD2 4.03Å; Y536-F550 HydrophobicContact CE1-CB 3.76Å; Y536-F550 HydrophobicContact CE1-CD2 4.08Å; Y536-F550 HydrophobicContact CE1-CG 4.35Å; Y536-F550 HydrophobicContact CE2-CB 4.3Å; Y536-F550 HydrophobicContact CE2-CD2 4.47Å; Y536-F550 AromaticContact CG-CD2 3.57Å; Y536-F550 HydrophobicContact CG-CD2 3.57Å; Y536-F550 HydrophobicContact CG-CE2 4.27Å; Y536-F550 PolarHBondContact OH-N 2.93Å; Y536-F550 VanDerWaalsContact OH-N 3.1Å; F550-E552 VanDerWaalsContact C-N 3.32Å; F550-E552 PolarHBondContact O-N 2.9Å; F550-F553 HydrophobicContact CE2-CD1 4.43Å; F550-F553 PolarHBondContact O-N 3.2Å; F550-G554 PolarHBondContact O-N 3.41Å; F550-Y572 HydrophobicContact CD1-CE2 4.36Å; F550-Y572 AromaticContact CE1-CD1 3.98Å; F550-Y572 HydrophobicContact CE1-CD1 3.98Å; F550-Y572 AromaticContact CE1-CD2 3.6Å; F550-Y572 HydrophobicContact CE1-CD2 3.6Å; F550-Y572 HydrophobicContact CE1-CE1 4.18Å; F550-Y572 AromaticContact CE1-CE2 3.81Å; F550-Y572 HydrophobicContact CE1-CE2 3.81Å; F550-Y572 AromaticContact CE1-CG 3.67Å; F550-Y572 HydrophobicContact CE1-CG 3.67Å; F550-Y572 HydrophobicContact CZ-CD1 4.25Å; F550-Y572 HydrophobicContact CZ-CD2 4.26Å; F550-Y572 AromaticContact CZ-CG 3.93Å; F550-Y572 HydrophobicContact CZ-CG 3.93Å
551	H	90.9	Very high	91.5	Very high	78 Å²	78	47.5 Å²	47.5	36%	0.361	24%	0.236	S	C	.	.	H	α-helix	trans	-60.7	-38.8	-178.7	-176.7	62.4	0	0	0	112.7	R549 G554 V555 W570 Y572	R549-H551 VanDerWaalsContact C-N 3.34Å; R549-H551 PolarHBondContact O-N 3.27Å; H551-G554 PolarHBondContact O-N 3.1Å; H551-V555 VanDerWaalsContact CE1-CG2 3.49Å; H551-V555 WeakPolarHBondContact CE1-CG2 3.44Å; H551-V555 WeakPolarHBondContact O-CG2 3.48Å; H551-V555 PolarHBondContact O-N 3.3Å; H551-W570 AromaticContact CE1-CD2 3.95Å; H551-W570 AromaticContact CE1-CE2 3.68Å; H551-W570 AromaticContact CE1-CZ2 3.83Å; H551-Y572 AromaticContact ND1-CE1 3.98Å; H551-Y572 AromaticContact ND1-CZ 3.87Å; H551-Y572 PolarHBondContact ND1-OH 2.79Å
552	E	90.6	Very high	90.9	Very high	84 Å²	84	53.2 Å²	53.2	39%	0.393	26%	0.262	S	S	.	.	H	α-helix	trans	-64.6	-42.1	178.3	-66.4	161.1	-160.5	0	0	111.3	R549 F550 R556	R549-E552 HydrophobicContact CB-CG 4.27Å; R549-E552 VanDerWaalsContact CD-OE1 3.3Å; R549-E552 WeakPolarHBondContact CD-OE1 3.25Å; R549-E552 IonicContact CZ-OE1 3.82Å; R549-E552 IonicContact NE-OE1 2.72Å; R549-E552 IonicContact NH1-OE1 3.22Å; R549-E552 PolarHBondContact NH1-OE1 2.93Å; R549-E552 PolarHBondContact O-N 3.26Å; F550-E552 VanDerWaalsContact C-N 3.32Å; F550-E552 PolarHBondContact O-N 2.9Å; E552-R556 WeakPolarHBondContact O-CB 3.44Å; E552-R556 PolarHBondContact O-N 3Å
553	F	94.1	Very high	89.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-67.8	-41.8	172.4	178.9	-92.6	0	0	0	112.3	P532 Y536 I539 F547 F550 R556 Y557 L581	P532-F553 WeakPolarHBondContact O-CE1 3.28Å; Y536-F553 HydrophobicContact CD2-CB 3.84Å; Y536-F553 HydrophobicContact CD2-CD1 4.06Å; Y536-F553 HydrophobicContact CD2-CD2 4.46Å; Y536-F553 AromaticContact CD2-CG 3.86Å; Y536-F553 HydrophobicContact CD2-CG 3.86Å; Y536-F553 HydrophobicContact CE2-CB 4.23Å; Y536-F553 HydrophobicContact CG-CD1 4.41Å; I539-F553 HydrophobicContact CD1-CD2 4.29Å; I539-F553 HydrophobicContact CD1-CE2 3.51Å; I539-F553 HydrophobicContact CD1-CZ 3.93Å; F547-F553 HydrophobicContact CB-CB 4.24Å; F547-F553 HydrophobicContact CD1-CB 4.03Å; F547-F553 HydrophobicContact CD1-CD2 4.25Å; F547-F553 AromaticContact CD2-CD2 3.8Å; F547-F553 HydrophobicContact CD2-CD2 3.8Å; F547-F553 HydrophobicContact CE1-CD2 4.33Å; F547-F553 AromaticContact CE2-CD2 3.88Å; F547-F553 HydrophobicContact CE2-CD2 3.88Å; F547-F553 HydrophobicContact CE2-CE2 4.37Å; F547-F553 HydrophobicContact CG-CB 4.08Å; F547-F553 AromaticContact CG-CD2 3.99Å; F547-F553 HydrophobicContact CG-CD2 3.99Å; F547-F553 HydrophobicContact CZ-CD2 4.15Å; F550-F553 HydrophobicContact CE2-CD1 4.43Å; F550-F553 PolarHBondContact O-N 3.2Å; F553-R556 PolarHBondContact O-N 2.79Å; F553-Y557 AromaticContact CD2-CD2 3.65Å; F553-Y557 HydrophobicContact CD2-CD2 3.65Å; F553-Y557 HydrophobicContact CD2-CE2 4.19Å; F553-Y557 AromaticContact CE2-CD2 3.77Å; F553-Y557 HydrophobicContact CE2-CD2 3.77Å; F553-Y557 HydrophobicContact CE2-CE2 4.44Å; F553-Y557 HydrophobicContact CE2-CG 4.44Å; F553-Y557 HydrophobicContact CG-CD2 4.24Å; F553-Y557 HydrophobicContact CZ-CD2 4.45Å; F553-Y557 WeakPolarHBondContact O-CD2 3.38Å; F553-Y557 PolarHBondContact O-N 3.12Å; F553-L581 HydrophobicContact CE2-CD1 3.73Å; F553-L581 HydrophobicContact CZ-CD1 4.16Å; F553-L581 HydrophobicContact CZ-CD2 4.38Å
554	G	92.9	Very high	88.2	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66	-45.4	-176.4	0	0	0	0	0	113.2	F550 H551 C558 D559 A560	F550-G554 PolarHBondContact O-N 3.41Å; H551-G554 PolarHBondContact O-N 3.1Å; G554-C558 CarbonylContact O-C 3.57Å; G554-C558 VanDerWaalsContact O-CA 3.31Å; G554-C558 WeakPolarHBondContact O-CA 3.4Å; G554-C558 VanDerWaalsContact O-CB 3.29Å; G554-C558 WeakPolarHBondContact O-CB 3.48Å; G554-C558 PolarHBondContact O-N 2.76Å; G554-D559 PolarHBondContact O-N 3.14Å; G554-A560 PolarHBondContact O-N 3.19Å
555	V	91.5	Very high	86.5	Confident	64 Å²	64	67.1 Å²	67.1	39%	0.388	32%	0.323	S	S	.	.	H	α-helix	trans	-60.9	-47.1	174.3	171.4	0	0	0	0	110.4	H551 A560	H551-V555 VanDerWaalsContact CE1-CG2 3.49Å; H551-V555 WeakPolarHBondContact CE1-CG2 3.44Å; H551-V555 WeakPolarHBondContact O-CG2 3.48Å; H551-V555 PolarHBondContact O-N 3.3Å; V555-A560 HydrophobicContact CB-CB 4.38Å; V555-A560 HydrophobicContact CG2-CB 3.88Å
556	R	94	Very high	84.9	Confident	13 Å²	13	67.8 Å²	67.8	5%	0.049	32%	0.316	C	S	.	.	H	α-helix	trans	-71.6	-39.1	-174.1	-171.8	64.6	-177.4	-174.4	5.2	113.8	C280 E340 P343 E552 F553 S576 N577 E580	C280-R556 PolarHBondContact O-NH1 2.81Å; C280-R556 PolarHBondContact O-NH2 3.07Å; E340-R556 IonicContact OE1-CZ 3.34Å; E340-R556 IonicContact OE1-NH1 3.51Å; E340-R556 PolarHBondContact OE1-NH1 3.24Å; P343-R556 HydrophobicContact CG-CG 3.99Å; P343-R556 VanDerWaalsContact CG-NE 3.28Å; E552-R556 WeakPolarHBondContact O-CB 3.44Å; E552-R556 PolarHBondContact O-N 3Å; F553-R556 PolarHBondContact O-N 2.79Å; R556-S576 VanDerWaalsContact C-OG 3.27Å; R556-S576 PolarHBondContact O-OG 3.41Å; R556-N577 PolarHBondContact O-ND2 2.93Å; R556-E580 IonicContact CZ-OE1 3.27Å; R556-E580 VanDerWaalsContact CZ-OE1 3.25Å; R556-E580 IonicContact CZ-OE2 3.63Å; R556-E580 IonicContact NE-OE1 2.74Å; R556-E580 PolarHBondContact NE-OE1 2.95Å; R556-E580 IonicContact NH2-OE1 3.32Å; R556-E580 PolarHBondContact NH2-OE1 3.11Å; R556-E580 IonicContact NH2-OE2 2.87Å; R556-E580 PolarHBondContact NH2-OE2 3.01Å
557	Y	95.3	Very high	82.9	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-123.2	-11.8	-169.2	-54.7	-69.1	0	0	0	116.6	P532 F547 F553 S576 N577 E580 L581	P532-Y557 VanDerWaalsContact CG-O 3.24Å; P532-Y557 WeakPolarHBondContact CG-O 3.44Å; F547-Y557 AromaticContact CE1-CE2 3.84Å; F547-Y557 HydrophobicContact CE1-CE2 3.84Å; F547-Y557 HydrophobicContact CE2-CE2 4.45Å; F547-Y557 HydrophobicContact CZ-CD2 4.45Å; F547-Y557 AromaticContact CZ-CE2 3.53Å; F547-Y557 HydrophobicContact CZ-CE2 3.53Å; F553-Y557 AromaticContact CD2-CD2 3.65Å; F553-Y557 HydrophobicContact CD2-CD2 3.65Å; F553-Y557 HydrophobicContact CD2-CE2 4.19Å; F553-Y557 AromaticContact CE2-CD2 3.77Å; F553-Y557 HydrophobicContact CE2-CD2 3.77Å; F553-Y557 HydrophobicContact CE2-CE2 4.44Å; F553-Y557 HydrophobicContact CE2-CG 4.44Å; F553-Y557 HydrophobicContact CG-CD2 4.24Å; F553-Y557 HydrophobicContact CZ-CD2 4.45Å; F553-Y557 WeakPolarHBondContact O-CD2 3.38Å; F553-Y557 PolarHBondContact O-N 3.12Å; Y557-S576 WeakPolarHBondContact CA-O 3.48Å; Y557-S576 WeakPolarHBondContact CA-OG 3.47Å; Y557-S576 PolarHBondContact N-OG 3.31Å; Y557-S576 PolarHBondContact O-N 2.92Å; Y557-N577 HydrophobicContact CD1-CB 3.89Å; Y557-N577 HydrophobicContact CE1-CB 4.04Å; Y557-E580 HydrophobicContact CE1-CB 4.31Å; Y557-E580 HydrophobicContact CE1-CG 3.96Å; Y557-E580 WeakPolarHBondContact CE1-OE1 3.41Å; Y557-E580 PolarHBondContact OH-OE1 3.17Å; Y557-E580 VanDerWaalsContact OH-OE1 3.05Å; Y557-L581 HydrophobicContact CD1-CB 3.68Å; Y557-L581 HydrophobicContact CD1-CD1 4.38Å; Y557-L581 HydrophobicContact CD1-CG 4.4Å; Y557-L581 HydrophobicContact CD2-CD1 4.32Å; Y557-L581 HydrophobicContact CE1-CB 3.91Å; Y557-L581 HydrophobicContact CG-CB 4.28Å; Y557-L581 HydrophobicContact CG-CD1 4.23Å; Y557-L581 HydrophobicContact CG-CD2 4.38Å
558	C	93.1	Very high	81.3	Confident	0 Å²	0	84 Å²	84	0%	0	39%	0.392	C	S	.	.	S	Bend	trans	-114.3	15.3	-177.4	-49.4	0	0	0	0	112.6	G554 A560 G574 S576	G554-C558 CarbonylContact O-C 3.57Å; G554-C558 VanDerWaalsContact O-CA 3.31Å; G554-C558 WeakPolarHBondContact O-CA 3.4Å; G554-C558 VanDerWaalsContact O-CB 3.29Å; G554-C558 WeakPolarHBondContact O-CB 3.48Å; G554-C558 PolarHBondContact O-N 2.76Å; C558-A560 PolarHBondContact O-N 2.9Å; C558-G574 VanDerWaalsContact C-C 3.49Å; C558-G574 CarbonylContact O-C 3.59Å; C558-G574 WeakPolarHBondContact O-CA 3.43Å; C558-G574 PolarHBondContact O-N 2.91Å; C558-S576 PolarHBondContact N-OG 3.47Å
559	D	91.9	Very high	80.8	Confident	54 Å²	54	81.1 Å²	81.1	29%	0.289	38%	0.378	S	S	.	.			trans	44.3	62.6	-176.7	-179.9	15.9	0	0	0	111.4	G554 R561 S576	G554-D559 PolarHBondContact O-N 3.14Å; D559-R561 PolarHBondContact O-N 2.7Å; D559-R561 IonicContact OD1-NE 2.72Å; D559-R561 PolarHBondContact OD1-NE 2.89Å; D559-R561 IonicContact OD1-NH2 3.75Å; D559-R561 IonicContact OD2-CZ 3.58Å; D559-R561 IonicContact OD2-NE 3.57Å; D559-R561 PolarHBondContact OD2-NE 3.43Å; D559-R561 IonicContact OD2-NH2 3.92Å; D559-R561 PolarHBondContact OD2-NH2 3.15Å; D559-S576 PolarHBondContact N-OG 3.39Å
560	A	89.6	Confident	80.5	Confident	16 Å²	16	78.5 Å²	78.5	13%	0.132	37%	0.368	C	S	.	.			trans	-69.3	117.4	-171.7	0	0	0	0	0	111.5	G554 V555 C558 W570 D571 Y572	G554-A560 PolarHBondContact O-N 3.19Å; V555-A560 HydrophobicContact CB-CB 4.38Å; V555-A560 HydrophobicContact CG2-CB 3.88Å; C558-A560 PolarHBondContact O-N 2.9Å; A560-W570 HydrophobicContact CB-CE3 3.98Å; A560-W570 HydrophobicContact CB-CZ3 4.39Å; A560-W570 WeakPolarHBondContact O-CZ3 3.3Å; A560-D571 CarbonylContact C-O 3.52Å; A560-D571 VanDerWaalsContact CA-O 3.24Å; A560-D571 WeakPolarHBondContact CA-O 3.48Å; A560-Y572 HydrophobicContact CB-CD1 3.52Å; A560-Y572 HydrophobicContact CB-CE1 3.54Å
561	R	86.6	Confident	80.2	Confident	157 Å²	157	78.1 Å²	78.1	59%	0.592	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.9	-177.7	-66.6	169.4	-172.8	-164.3	4.1	110.3	D559 W570 D571	D559-R561 PolarHBondContact O-N 2.7Å; D559-R561 IonicContact OD1-NE 2.72Å; D559-R561 PolarHBondContact OD1-NE 2.89Å; D559-R561 IonicContact OD1-NH2 3.75Å; D559-R561 IonicContact OD2-CZ 3.58Å; D559-R561 IonicContact OD2-NE 3.57Å; D559-R561 PolarHBondContact OD2-NE 3.43Å; D559-R561 IonicContact OD2-NH2 3.92Å; D559-R561 PolarHBondContact OD2-NH2 3.15Å; R561-W570 WeakPolarHBondContact O-CA 3.32Å; R561-D571 PolarHBondContact N-O 3.21Å; R561-D571 PolarHBondContact O-N 3.03Å
562	Q	81.9	Confident	80	Confident	121 Å²	121	76.5 Å²	76.5	57%	0.565	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	135.8	170.1	-169.5	171.3	-2.4	0	0	109.3	Q564 W570	Q562-Q564 PolarHBondContact O-N 3.1Å; Q562-W570 HydrophobicContact CB-CZ3 4.49Å
563	H	72.9	Confident	79.7	Confident	49 Å²	49	73.7 Å²	73.7	23%	0.227	35%	0.349	C	S	.	.			trans	-64.7	106	-177.2	-85.6	69.3	0	0	0	111.3	Q565 K566 G569 D571	H563-Q565 PolarHBondContact O-N 2.96Å; H563-Q565 VanDerWaalsContact O-N 3.08Å; H563-K566 HydrophobicContact CB-CB 3.82Å; H563-K566 HydrophobicContact CB-CD 4.3Å; H563-K566 HydrophobicContact CB-CG 4.18Å; H563-K566 PolarHBondContact NE2-NZ 3.45Å; H563-K566 VanDerWaalsContact NE2-NZ 3.12Å; H563-K566 PolarHBondContact O-N 2.99Å; H563-G569 PolarHBondContact N-O 2.93Å; H563-G569 PolarHBondContact ND1-O 3.26Å; H563-D571 PolarHBondContact ND1-N 3.47Å
564	Q	57.7	Low	79.4	Confident	204 Å²	204	74.7 Å²	74.7	95%	0.953	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.8	176.7	-65.4	179.7	-9.9	0	0	113.7	Q562	Q562-Q564 PolarHBondContact O-N 3.1Å
565	Q	55.2	Low	79.3	Confident	155 Å²	155	76.8 Å²	76.8	72%	0.724	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	2.4	179.3	-68.6	178.5	-26.3	0	0	114.5	H563	H563-Q565 PolarHBondContact O-N 2.96Å; H563-Q565 VanDerWaalsContact O-N 3.08Å
566	K	54.9	Low	79.4	Confident	95 Å²	95	75 Å²	75	41%	0.413	37%	0.365	S	S	.	.	S	Bend	trans	-132.9	139.5	178.6	-63.4	179.2	-175.9	158.1	0	111.1	H563 W568	H563-K566 HydrophobicContact CB-CB 3.82Å; H563-K566 HydrophobicContact CB-CD 4.3Å; H563-K566 HydrophobicContact CB-CG 4.18Å; H563-K566 PolarHBondContact NE2-NZ 3.45Å; H563-K566 VanDerWaalsContact NE2-NZ 3.12Å; H563-K566 PolarHBondContact O-N 2.99Å; K566-W568 WeakPolarHBondContact CB-O 3.38Å; K566-W568 PolarHBondContact O-N 3.31Å; K566-W568 VanDerWaalsContact O-N 3.09Å
567	T	49.8	Very low	79.4	Confident	137 Å²	137	76 Å²	76	84%	0.84	37%	0.371	S	S	*	.	S	Bend	trans	-58.4	-25.2	175.3	-33.1	0	0	0	0	113.3
568	W	57.8	Low	79.3	Confident	223 Å²	223	76.4 Å²	76.4	85%	0.845	37%	0.373	S	S	*	.	S	Bend	trans	-145.4	146.8	176.2	-93.9	80.4	0	0	0	111.2	K566	K566-W568 WeakPolarHBondContact CB-O 3.38Å; K566-W568 PolarHBondContact O-N 3.31Å; K566-W568 VanDerWaalsContact O-N 3.09Å
569	G	75.4	Confident	79.3	Confident	25 Å²	25	78.4 Å²	78.4	26%	0.258	39%	0.394	S	S	.	.			trans	127.6	146.8	172.1	0	0	0	0	0	114	H563	H563-G569 PolarHBondContact N-O 2.93Å; H563-G569 PolarHBondContact ND1-O 3.26Å
570	W	83.3	Confident	79.5	Confident	110 Å²	110	75.9 Å²	75.9	42%	0.417	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.9	175.9	-70.9	88.3	0	0	0	109.4	H551 A560 R561 Q562 Y572	H551-W570 AromaticContact CE1-CD2 3.95Å; H551-W570 AromaticContact CE1-CE2 3.68Å; H551-W570 AromaticContact CE1-CZ2 3.83Å; A560-W570 HydrophobicContact CB-CE3 3.98Å; A560-W570 HydrophobicContact CB-CZ3 4.39Å; A560-W570 WeakPolarHBondContact O-CZ3 3.3Å; R561-W570 WeakPolarHBondContact O-CA 3.32Å; Q562-W570 HydrophobicContact CB-CZ3 4.49Å; W570-Y572 HydrophobicContact CB-CD2 4.19Å; W570-Y572 HydrophobicContact CB-CE1 4.35Å; W570-Y572 HydrophobicContact CB-CE2 3.42Å; W570-Y572 VanDerWaalsContact CB-CE2 3.42Å; W570-Y572 HydrophobicContact CG-CE2 4.46Å
571	D	84.1	Confident	79.8	Confident	55 Å²	55	75.2 Å²	75.2	29%	0.294	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	142.2	162	-173.3	17.4	0	0	0	109.2	A560 R561 H563 S573	A560-D571 CarbonylContact C-O 3.52Å; A560-D571 VanDerWaalsContact CA-O 3.24Å; A560-D571 WeakPolarHBondContact CA-O 3.48Å; R561-D571 PolarHBondContact N-O 3.21Å; R561-D571 PolarHBondContact O-N 3.03Å; H563-D571 PolarHBondContact ND1-N 3.47Å; D571-S573 WeakPolarHBondContact OD1-CB 3.48Å; D571-S573 PolarHBondContact OD1-N 3.42Å; D571-S573 PolarHBondContact OD1-OG 2.84Å; D571-S573 PolarHBondContact OD2-OG 2.86Å
572	Y	88.1	Confident	80.2	Confident	45 Å²	45	71.2 Å²	71.2	18%	0.176	36%	0.361	C	S	.	.			trans	-131.5	24.9	177.4	-58.1	-85.9	0	0	0	110.6	F550 H551 A560 W570 G574	F550-Y572 HydrophobicContact CD1-CE2 4.36Å; F550-Y572 AromaticContact CE1-CD1 3.98Å; F550-Y572 HydrophobicContact CE1-CD1 3.98Å; F550-Y572 AromaticContact CE1-CD2 3.6Å; F550-Y572 HydrophobicContact CE1-CD2 3.6Å; F550-Y572 HydrophobicContact CE1-CE1 4.18Å; F550-Y572 AromaticContact CE1-CE2 3.81Å; F550-Y572 HydrophobicContact CE1-CE2 3.81Å; F550-Y572 AromaticContact CE1-CG 3.67Å; F550-Y572 HydrophobicContact CE1-CG 3.67Å; F550-Y572 HydrophobicContact CZ-CD1 4.25Å; F550-Y572 HydrophobicContact CZ-CD2 4.26Å; F550-Y572 AromaticContact CZ-CG 3.93Å; F550-Y572 HydrophobicContact CZ-CG 3.93Å; H551-Y572 AromaticContact ND1-CE1 3.98Å; H551-Y572 AromaticContact ND1-CZ 3.87Å; H551-Y572 PolarHBondContact ND1-OH 2.79Å; A560-Y572 HydrophobicContact CB-CD1 3.52Å; A560-Y572 HydrophobicContact CB-CE1 3.54Å; W570-Y572 HydrophobicContact CB-CD2 4.19Å; W570-Y572 HydrophobicContact CB-CE1 4.35Å; W570-Y572 HydrophobicContact CB-CE2 3.42Å; W570-Y572 VanDerWaalsContact CB-CE2 3.42Å; W570-Y572 HydrophobicContact CG-CE2 4.46Å; Y572-G574 VanDerWaalsContact C-N 3.35Å
573	S	82.9	Confident	80.7	Confident	24 Å²	24	66.7 Å²	66.7	17%	0.168	34%	0.341	C	S	.	.			trans	-85.8	-6.6	-175.4	82.9	0	0	0	0	113.8	R531 D571	R531-S573 WeakPolarHBondContact CD-O 3.16Å; R531-S573 PolarHBondContact NH1-O 2.53Å; D571-S573 WeakPolarHBondContact OD1-CB 3.48Å; D571-S573 PolarHBondContact OD1-N 3.42Å; D571-S573 PolarHBondContact OD1-OG 2.84Å; D571-S573 PolarHBondContact OD2-OG 2.86Å
574	G	88.3	Confident	81.8	Confident	21 Å²	21	64.4 Å²	64.4	22%	0.216	33%	0.33	C	S	.	.	S	Bend	trans	-85.7	-161.6	177.1	0	0	0	0	0	114	C558 Y572	C558-G574 VanDerWaalsContact C-C 3.49Å; C558-G574 CarbonylContact O-C 3.59Å; C558-G574 WeakPolarHBondContact O-CA 3.43Å; C558-G574 PolarHBondContact O-N 2.91Å; Y572-G574 VanDerWaalsContact C-N 3.35Å
575	S	91.6	Very high	83.5	Confident	45 Å²	45	54.8 Å²	54.8	32%	0.315	29%	0.285	S	S	.	.			trans	-159.4	130.8	-174	57.2	0	0	0	0	111.7
576	S	93.6	Very high	85.3	Confident	27 Å²	27	50 Å²	50	19%	0.189	26%	0.263	C	S	.	.			trans	-145.1	158.3	-178.3	52.3	0	0	0	0	111.3	R556 Y557 C558 D559 L578	R556-S576 VanDerWaalsContact C-OG 3.27Å; R556-S576 PolarHBondContact O-OG 3.41Å; Y557-S576 WeakPolarHBondContact CA-O 3.48Å; Y557-S576 WeakPolarHBondContact CA-OG 3.47Å; Y557-S576 PolarHBondContact N-OG 3.31Å; Y557-S576 PolarHBondContact O-N 2.92Å; C558-S576 PolarHBondContact N-OG 3.47Å; D559-S576 PolarHBondContact N-OG 3.39Å; S576-L578 WeakPolarHBondContact O-CD2 3.23Å; S576-L578 PolarHBondContact O-N 3.11Å
577	N	93.9	Very high	87	Confident	32 Å²	32	48.1 Å²	48.1	17%	0.171	26%	0.256	C	S	.	.			trans	50.5	35.5	171.1	-62.2	-38.2	0	0	0	115	I281 R556 Y557 G579 E580 L581	I281-N577 WeakPolarHBondContact CD1-OD1 3.36Å; R556-N577 PolarHBondContact O-ND2 2.93Å; Y557-N577 HydrophobicContact CD1-CB 3.89Å; Y557-N577 HydrophobicContact CE1-CB 4.04Å; N577-G579 VanDerWaalsContact C-N 3.34Å; N577-G579 PolarHBondContact O-N 3.27Å; N577-E580 HydrophobicContact CB-CB 4.46Å; N577-E580 WeakPolarHBondContact O-CB 3.44Å; N577-E580 PolarHBondContact O-N 2.86Å; N577-E580 VanDerWaalsContact O-N 3.13Å; N577-L581 PolarHBondContact O-N 2.84Å
578	L	93.8	Very high	89	Confident	9 Å²	9	42.1 Å²	42.1	5%	0.047	22%	0.219	C	C	.	.	H	α-helix	trans	-66.6	-30.7	-167.8	-58.9	-178.8	0	0	0	114	P532 S576 L581 K582 V800 E803 V804	P532-L578 HydrophobicContact CB-CD2 4.2Å; P532-L578 HydrophobicContact CG-CD2 4.17Å; S576-L578 WeakPolarHBondContact O-CD2 3.23Å; S576-L578 PolarHBondContact O-N 3.11Å; L578-L581 PolarHBondContact O-N 3.04Å; L578-K582 PolarHBondContact O-N 2.92Å; L578-V800 HydrophobicContact CD1-CB 4.34Å; L578-V800 HydrophobicContact CD1-CG1 3.91Å; L578-V800 HydrophobicContact CD1-CG2 4.45Å; L578-E803 HydrophobicContact CB-CB 3.9Å; L578-E803 HydrophobicContact CD1-CB 3.82Å; L578-V804 HydrophobicContact CB-CG2 3.9Å; L578-V804 HydrophobicContact CD1-CG2 4.23Å; L578-V804 HydrophobicContact CD2-CG2 3.7Å; L578-V804 HydrophobicContact CG-CG2 4.15Å
579	G	93.1	Very high	90.7	Very high	42 Å²	42	31.5 Å²	31.5	43%	0.433	18%	0.179	S	C	.	.	H	α-helix	trans	-66.4	-39.9	172.6	0	0	0	0	0	113.3	N577 K582 L583	N577-G579 VanDerWaalsContact C-N 3.34Å; N577-G579 PolarHBondContact O-N 3.27Å; G579-K582 PolarHBondContact O-N 2.98Å; G579-L583 WeakPolarHBondContact O-CG 3.33Å; G579-L583 PolarHBondContact O-N 2.89Å; G579-L583 VanDerWaalsContact O-N 3.12Å
580	E	95.1	Very high	91.6	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.009	17%	0.168	C	C	.	.	H	α-helix	trans	-64.2	-43.8	171.9	170.8	176.1	96.4	0	0	110.6	I281 L282 V346 R556 Y557 N577 K582 L583 L584	I281-E580 HydrophobicContact CG2-CB 4.22Å; L282-E580 HydrophobicContact CB-CB 4.11Å; L282-E580 HydrophobicContact CB-CG 3.85Å; L282-E580 PolarHBondContact N-OE2 2.85Å; V346-E580 HydrophobicContact CG2-CG 3.92Å; R556-E580 IonicContact CZ-OE1 3.27Å; R556-E580 VanDerWaalsContact CZ-OE1 3.25Å; R556-E580 IonicContact CZ-OE2 3.63Å; R556-E580 IonicContact NE-OE1 2.74Å; R556-E580 PolarHBondContact NE-OE1 2.95Å; R556-E580 IonicContact NH2-OE1 3.32Å; R556-E580 PolarHBondContact NH2-OE1 3.11Å; R556-E580 IonicContact NH2-OE2 2.87Å; R556-E580 PolarHBondContact NH2-OE2 3.01Å; Y557-E580 HydrophobicContact CE1-CB 4.31Å; Y557-E580 HydrophobicContact CE1-CG 3.96Å; Y557-E580 WeakPolarHBondContact CE1-OE1 3.41Å; Y557-E580 PolarHBondContact OH-OE1 3.17Å; Y557-E580 VanDerWaalsContact OH-OE1 3.05Å; N577-E580 HydrophobicContact CB-CB 4.46Å; N577-E580 WeakPolarHBondContact O-CB 3.44Å; N577-E580 PolarHBondContact O-N 2.86Å; N577-E580 VanDerWaalsContact O-N 3.13Å; E580-K582 PolarHBondContact O-N 3Å; E580-L583 PolarHBondContact O-N 3.2Å; E580-L584 VanDerWaalsContact O-CB 3.28Å; E580-L584 WeakPolarHBondContact O-CB 3.22Å; E580-L584 PolarHBondContact O-N 2.69Å
581	L	95.8	Very high	92.2	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-58.8	-46.2	176.5	-179.7	59	0	0	0	111.7	P532 L535 F553 Y557 N577 L578 L584 L585 V804	P532-L581 HydrophobicContact CB-CD2 3.9Å; L535-L581 HydrophobicContact CD1-CD2 4.17Å; F553-L581 HydrophobicContact CE2-CD1 3.73Å; F553-L581 HydrophobicContact CZ-CD1 4.16Å; F553-L581 HydrophobicContact CZ-CD2 4.38Å; Y557-L581 HydrophobicContact CD1-CB 3.68Å; Y557-L581 HydrophobicContact CD1-CD1 4.38Å; Y557-L581 HydrophobicContact CD1-CG 4.4Å; Y557-L581 HydrophobicContact CD2-CD1 4.32Å; Y557-L581 HydrophobicContact CE1-CB 3.91Å; Y557-L581 HydrophobicContact CG-CB 4.28Å; Y557-L581 HydrophobicContact CG-CD1 4.23Å; Y557-L581 HydrophobicContact CG-CD2 4.38Å; N577-L581 PolarHBondContact O-N 2.84Å; L578-L581 PolarHBondContact O-N 3.04Å; L581-L584 PolarHBondContact O-N 3.44Å; L581-L585 HydrophobicContact CD1-CD1 3.98Å; L581-L585 HydrophobicContact CD1-CG 4.08Å; L581-L585 HydrophobicContact CG-CD1 3.87Å; L581-L585 HydrophobicContact CG-CG 4.42Å; L581-L585 WeakPolarHBondContact O-CB 3.4Å; L581-L585 WeakPolarHBondContact O-CG 3.16Å; L581-L585 PolarHBondContact O-N 3.03Å; L581-V804 HydrophobicContact CD2-CG1 4.23Å; L581-V804 HydrophobicContact CD2-CG2 4.26Å; L581-V804 HydrophobicContact CG-CG1 4.41Å
582	K	94.4	Very high	92.5	Very high	74 Å²	74	26 Å²	26	32%	0.322	15%	0.148	S	C	.	.	H	α-helix	trans	-55.9	-54.6	176.1	177.5	178.2	174.1	175.6	0	111.4	L578 G579 E580 L584 L585 E586 V804	L578-K582 PolarHBondContact O-N 2.92Å; G579-K582 PolarHBondContact O-N 2.98Å; E580-K582 PolarHBondContact O-N 3Å; K582-L584 VanDerWaalsContact C-N 3.31Å; K582-L584 PolarHBondContact O-N 2.88Å; K582-L585 PolarHBondContact O-N 3.07Å; K582-E586 WeakPolarHBondContact CE-OE1 3.08Å; K582-E586 IonicContact NZ-OE1 3.23Å; K582-E586 WeakPolarHBondContact O-CG 3.42Å; K582-E586 PolarHBondContact O-N 3.34Å; K582-V804 WeakPolarHBondContact CG-O 3.42Å
583	L	93.9	Very high	92.6	Very high	25 Å²	25	24.9 Å²	24.9	13%	0.131	14%	0.144	C	C	.	.	H	α-helix	trans	-57.7	-44	179.6	-70.7	167.4	0	0	0	111.7	L282 R285 F350 G579 E580 E587	L282-L583 HydrophobicContact CD2-CB 3.92Å; L282-L583 HydrophobicContact CD2-CD1 3.88Å; L282-L583 HydrophobicContact CG-CD1 4.06Å; R285-L583 HydrophobicContact CG-CD2 4.05Å; F350-L583 HydrophobicContact CZ-CB 4.18Å; G579-L583 WeakPolarHBondContact O-CG 3.33Å; G579-L583 PolarHBondContact O-N 2.89Å; G579-L583 VanDerWaalsContact O-N 3.12Å; E580-L583 PolarHBondContact O-N 3.2Å; L583-E587 WeakPolarHBondContact O-CB 3.48Å; L583-E587 PolarHBondContact O-N 2.71Å
584	L	94.6	Very high	92.8	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-65.6	-38.7	179.8	-176.9	63.8	0	0	0	112.5	A345 V346 A349 L546 F547 E580 L581 K582 C588	A345-L584 HydrophobicContact CB-CD1 4.39Å; A345-L584 HydrophobicContact CB-CD2 3.98Å; V346-L584 HydrophobicContact CG2-CD1 4.3Å; V346-L584 HydrophobicContact CG2-CD2 4.3Å; A349-L584 HydrophobicContact CB-CD1 3.52Å; L546-L584 HydrophobicContact CD1-CD1 4.45Å; L546-L584 HydrophobicContact CD2-CG 4.43Å; F547-L584 HydrophobicContact CE2-CD2 3.72Å; F547-L584 HydrophobicContact CZ-CD2 3.49Å; F547-L584 VanDerWaalsContact CZ-CD2 3.49Å; E580-L584 VanDerWaalsContact O-CB 3.28Å; E580-L584 WeakPolarHBondContact O-CB 3.22Å; E580-L584 PolarHBondContact O-N 2.69Å; L581-L584 PolarHBondContact O-N 3.44Å; K582-L584 VanDerWaalsContact C-N 3.31Å; K582-L584 PolarHBondContact O-N 2.88Å; L584-C588 WeakPolarHBondContact O-CB 3.34Å; L584-C588 PolarHBondContact O-N 3.47Å; L584-C588 PolarHBondContact O-SG 3.15Å; L584-C588 VanDerWaalsContact O-SG 3.35Å
585	L	94.7	Very high	92.5	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-65.9	-51.4	176.5	-74.6	167.8	0	0	0	111.4	L535 I539 L581 K582 E587 C588 L589 M590 V804	L535-L585 HydrophobicContact CD1-CD1 4.04Å; I539-L585 HydrophobicContact CD1-CD2 3.83Å; I539-L585 HydrophobicContact CG1-CD2 3.7Å; L581-L585 HydrophobicContact CD1-CD1 3.98Å; L581-L585 HydrophobicContact CD1-CG 4.08Å; L581-L585 HydrophobicContact CG-CD1 3.87Å; L581-L585 HydrophobicContact CG-CG 4.42Å; L581-L585 WeakPolarHBondContact O-CB 3.4Å; L581-L585 WeakPolarHBondContact O-CG 3.16Å; L581-L585 PolarHBondContact O-N 3.03Å; K582-L585 PolarHBondContact O-N 3.07Å; L585-E587 VanDerWaalsContact C-N 3.31Å; L585-E587 PolarHBondContact O-N 2.83Å; L585-C588 PolarHBondContact O-N 3.03Å; L585-L589 HydrophobicContact CD2-CD1 4.07Å; L585-L589 HydrophobicContact CD2-CD2 4.43Å; L585-L589 HydrophobicContact CD2-CG 4.38Å; L585-L589 PolarHBondContact O-N 3.37Å; L585-M590 HydrophobicContact CB-CB 4.04Å; L585-M590 HydrophobicContact CB-CE 3.86Å; L585-M590 HydrophobicContact CB-SD 4.33Å; L585-M590 HydrophobicContact CD1-CE 4.24Å; L585-M590 HydrophobicContact CD1-SD 4.42Å; L585-M590 WeakPolarHBondContact O-CB 3.28Å; L585-M590 PolarHBondContact O-N 3.43Å; L585-V804 HydrophobicContact CD1-CG1 4.11Å
586	E	92.6	Very high	91.9	Very high	55 Å²	55	25.9 Å²	25.9	26%	0.257	14%	0.144	S	C	.	.	H	α-helix	trans	-54.8	-45.9	177.3	-72.4	175.7	-170.7	0	0	111.9	R285 K582 M590	R285-E586 IonicContact CZ-OE2 3.71Å; R285-E586 IonicContact NH2-OE2 3.03Å; R285-E586 PolarHBondContact NH2-OE2 2.82Å; K582-E586 WeakPolarHBondContact CE-OE1 3.08Å; K582-E586 IonicContact NZ-OE1 3.23Å; K582-E586 WeakPolarHBondContact O-CG 3.42Å; K582-E586 PolarHBondContact O-N 3.34Å; E586-M590 WeakPolarHBondContact CA-O 3.45Å
587	E	90.7	Very high	91.3	Very high	55 Å²	55	29.5 Å²	29.5	26%	0.257	16%	0.162	S	C	.	.	H	α-helix	trans	-71.3	-41.5	-179.2	-170.4	51.3	-124.2	0	0	112.2	R285 A349 F350 K394 L583 L585	R285-E587 IonicContact CZ-OE2 3.19Å; R285-E587 IonicContact NH1-OE2 2.73Å; R285-E587 PolarHBondContact NH1-OE2 2.94Å; A349-E587 HydrophobicContact CB-CG 4.35Å; F350-E587 HydrophobicContact CD1-CG 4.32Å; F350-E587 HydrophobicContact CE1-CB 3.89Å; F350-E587 HydrophobicContact CE1-CG 3.82Å; F350-E587 HydrophobicContact CE2-CB 4.31Å; F350-E587 HydrophobicContact CZ-CB 3.61Å; F350-E587 HydrophobicContact CZ-CG 3.97Å; K394-E587 PolarHBondContact NZ-O 3.18Å; K394-E587 IonicContact NZ-OE1 2.73Å; L583-E587 WeakPolarHBondContact O-CB 3.48Å; L583-E587 PolarHBondContact O-N 2.71Å; L585-E587 VanDerWaalsContact C-N 3.31Å; L585-E587 PolarHBondContact O-N 2.83Å
588	C	90.9	Very high	90.6	Very high	11 Å²	11	30 Å²	30	7%	0.074	17%	0.165	C	C	.	.	H	α-helix	trans	-80.7	-42.7	-172.3	-75.7	0	0	0	0	115.2	A349 K543 L546 L584 L585	A349-C588 VanDerWaalsContact CB-SG 3.58Å; K543-C588 HydrophobicContact CD-CB 4Å; K543-C588 PolarHBondContact NZ-SG 2.96Å; L546-C588 HydrophobicContact CD2-CB 3.96Å; L584-C588 WeakPolarHBondContact O-CB 3.34Å; L584-C588 PolarHBondContact O-N 3.47Å; L584-C588 PolarHBondContact O-SG 3.15Å; L584-C588 VanDerWaalsContact O-SG 3.35Å; L585-C588 PolarHBondContact O-N 3.03Å
589	L	93.8	Very high	89.7	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-160.9	-19.5	-158.6	63.9	95.9	0	0	0	117.1	L398 L399 I539 V542 K543 L546 L585	L398-L589 CarbonylContact C-O 3.5Å; L398-L589 WeakPolarHBondContact CA-O 3.36Å; L399-L589 HydrophobicContact CB-CD1 3.93Å; L399-L589 HydrophobicContact CD2-CD1 4.3Å; L399-L589 PolarHBondContact N-O 3.12Å; I539-L589 HydrophobicContact CB-CD2 4.34Å; I539-L589 HydrophobicContact CG1-CD2 4.29Å; I539-L589 HydrophobicContact CG2-CD2 3.94Å; V542-L589 HydrophobicContact CB-CB 4.31Å; V542-L589 HydrophobicContact CG1-CB 3.73Å; K543-L589 HydrophobicContact CB-CD2 4.36Å; L546-L589 HydrophobicContact CD2-CD2 4.17Å; L585-L589 HydrophobicContact CD2-CD1 4.07Å; L585-L589 HydrophobicContact CD2-CD2 4.43Å; L585-L589 HydrophobicContact CD2-CG 4.38Å; L585-L589 PolarHBondContact O-N 3.37Å
590	M	95.1	Very high	88.4	Confident	4 Å²	4	34.8 Å²	34.8	2%	0.02	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.4	-169.3	-170.5	174	74.1	0	0	111.6	L399 A401 P527 L585 E586 R592 L806	L399-M590 HydrophobicContact CD2-CG 4.09Å; L399-M590 HydrophobicContact CD2-SD 4.1Å; L399-M590 HydrophobicContact CG-CG 4.24Å; L399-M590 WeakPolarHBondContact O-CA 3.38Å; A401-M590 HydrophobicContact CB-CG 3.67Å; A401-M590 HydrophobicContact CB-SD 3.88Å; P527-M590 HydrophobicContact CG-SD 4.43Å; L585-M590 HydrophobicContact CB-CB 4.04Å; L585-M590 HydrophobicContact CB-CE 3.86Å; L585-M590 HydrophobicContact CB-SD 4.33Å; L585-M590 HydrophobicContact CD1-CE 4.24Å; L585-M590 HydrophobicContact CD1-SD 4.42Å; L585-M590 WeakPolarHBondContact O-CB 3.28Å; L585-M590 PolarHBondContact O-N 3.43Å; E586-M590 WeakPolarHBondContact CA-O 3.45Å; M590-R592 HydrophobicContact CE-CB 4.26Å; M590-L806 HydrophobicContact CE-CD2 3.99Å; M590-L806 HydrophobicContact SD-CD2 4.03Å
591	L	94.4	Very high	86.9	Confident	29 Å²	29	43.4 Å²	43.4	15%	0.152	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	119.1	164.9	-178.3	61.1	0	0	0	109.1	G387 F390 L399 L400 A401 D402	G387-L591 VanDerWaalsContact CA-CD2 3.47Å; F390-L591 HydrophobicContact CB-CD2 4.15Å; F390-L591 HydrophobicContact CD1-CB 3.87Å; F390-L591 HydrophobicContact CD1-CD2 4.23Å; F390-L591 HydrophobicContact CE1-CB 3.86Å; F390-L591 HydrophobicContact CG-CB 4.48Å; F390-L591 HydrophobicContact CG-CD2 4.28Å; F390-L591 HydrophobicContact CZ-CB 4.44Å; L399-L591 PolarHBondContact O-N 3.46Å; L400-L591 HydrophobicContact CD1-CB 4.22Å; L400-L591 HydrophobicContact CD1-CD2 3.95Å; L400-L591 HydrophobicContact CD1-CG 4.29Å; A401-L591 WeakPolarHBondContact CA-O 3.36Å; A401-L591 WeakPolarHBondContact CB-O 3.31Å; A401-L591 PolarHBondContact N-O 3.44Å; D402-L591 PolarHBondContact N-O 3.43Å
592	R	92.3	Very high	85.5	Confident	40 Å²	40	44.8 Å²	44.8	15%	0.151	24%	0.238	C	C	.	.			trans	-129.7	122.1	179.6	176.4	61.8	-179.8	-140.4	-2.1	109.9	A401 D403 G525 M590 L806	A401-R592 HydrophobicContact CB-CB 4.16Å; A401-R592 WeakPolarHBondContact O-CD 3.5Å; A401-R592 PolarHBondContact O-NE 2.99Å; A401-R592 PolarHBondContact O-NH1 2.72Å; D403-R592 IonicContact OD1-CZ 3.15Å; D403-R592 IonicContact OD1-NE 2.85Å; D403-R592 PolarHBondContact OD1-NE 3.37Å; D403-R592 IonicContact OD1-NH1 2.7Å; D403-R592 IonicContact OD1-NH2 2.68Å; D403-R592 PolarHBondContact OD1-NH2 3.13Å; G525-R592 PolarHBondContact O-NH1 3.08Å; M590-R592 HydrophobicContact CE-CB 4.26Å; R592-L806 PolarHBondContact NH2-O 2.84Å
593	R	90.1	Very high	84.4	Confident	22 Å²	22	42.2 Å²	42.2	8%	0.083	23%	0.229	C	C	.	.			trans	-127.6	142.1	166.3	-67	161.3	-68.2	-160.3	9.8	110.2	F383 E386 D402 D403 V598	F383-R593 VanDerWaalsContact O-CZ 3.31Å; F383-R593 PolarHBondContact O-NH1 3.16Å; F383-R593 PolarHBondContact O-NH2 3.26Å; E386-R593 IonicContact OE2-NH1 2.74Å; E386-R593 PolarHBondContact OE2-NH1 3.48Å; D402-R593 IonicContact OD1-CZ 2.68Å; D402-R593 PolarHBondContact OD1-N 3.16Å; D402-R593 VanDerWaalsContact OD1-N 3.16Å; D402-R593 IonicContact OD1-NE 2.69Å; D402-R593 PolarHBondContact OD1-NE 2.84Å; D402-R593 IonicContact OD1-NH2 3.27Å; D402-R593 PolarHBondContact OD1-NH2 3.01Å; D402-R593 IonicContact OD2-CZ 2.81Å; D402-R593 IonicContact OD2-NE 3.39Å; D402-R593 IonicContact OD2-NH2 3.15Å; D402-R593 PolarHBondContact OD2-NH2 2.68Å; D403-R593 PolarHBondContact N-O 3.29Å; R593-V598 HydrophobicContact CB-CG1 4.32Å
594	L	85.6	Confident	83.7	Confident	33 Å²	33	43.8 Å²	43.8	17%	0.173	24%	0.242	C	C	.	.			trans	-89.6	157	177.1	-54	172.3	0	0	0	109.9	D403 S596 D597 V598 E808	D403-L594 WeakPolarHBondContact OD2-CA 3.47Å; L594-S596 PolarHBondContact O-N 3.42Å; L594-D597 WeakPolarHBondContact CB-OD2 3.46Å; L594-D597 PolarHBondContact N-OD2 3.22Å; L594-D597 WeakPolarHBondContact O-CB 3.45Å; L594-D597 PolarHBondContact O-N 3.02Å; L594-V598 PolarHBondContact O-N 3.43Å; L594-E808 HydrophobicContact CB-CG 4.37Å; L594-E808 HydrophobicContact CD1-CG 4.26Å; L594-E808 HydrophobicContact CD2-CG 4.22Å
595	K	82.9	Confident	83.2	Confident	4 Å²	4	45 Å²	45	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-57.5	-38.7	172.9	-74.2	160.5	-179.4	172.8	0	112.2	D403 M404 L406 D597 V598 L599 L602 D764 H767	D403-K595 HydrophobicContact CB-CD 4.46Å; D403-K595 HydrophobicContact CB-CG 3.92Å; D403-K595 PolarHBondContact OD2-N 3.33Å; M404-K595 WeakPolarHBondContact O-CE 3.35Å; M404-K595 PolarHBondContact O-NZ 2.97Å; L406-K595 HydrophobicContact CD2-CG 4.13Å; K595-D597 PolarHBondContact O-N 3.41Å; K595-V598 PolarHBondContact O-N 3.06Å; K595-L599 CarbonylContact O-C 3.58Å; K595-L599 WeakPolarHBondContact O-CA 3.38Å; K595-L599 PolarHBondContact O-N 3.01Å; K595-L602 HydrophobicContact CB-CD1 4.05Å; K595-L602 HydrophobicContact CD-CD1 4.07Å; K595-L602 HydrophobicContact CG-CD1 3.98Å; K595-D764 IonicContact NZ-OD1 3.95Å; K595-D764 PolarHBondContact NZ-OD1 3.43Å; K595-D764 IonicContact NZ-OD2 2.71Å; K595-D764 PolarHBondContact NZ-OD2 2.95Å; K595-H767 WeakPolarHBondContact CD-CE1 3.34Å; K595-H767 WeakPolarHBondContact CD-ND1 3.28Å; K595-H767 PolarHBondContact NZ-ND1 3.5Å; K595-H767 VanDerWaalsContact NZ-ND1 3.16Å; K595-H767 PolarHBondContact NZ-O 2.76Å
596	S	79.1	Confident	82.7	Confident	74 Å²	74	50 Å²	50	52%	0.517	27%	0.271	S	S	.	.	H	α-helix	trans	-62.2	-24.1	175.4	32.6	0	0	0	0	113.7	L594 E808	L594-S596 PolarHBondContact O-N 3.42Å; S596-E808 WeakPolarHBondContact CB-OE1 3.36Å; S596-E808 PolarHBondContact OG-OE1 3.01Å
597	D	80.3	Confident	82.5	Confident	104 Å²	104	49.5 Å²	49.5	56%	0.556	27%	0.266	S	S	*	.	H	α-helix	trans	-79.2	-36.6	177.4	-54.9	-31.8	0	0	0	112.5	L594 K595	L594-D597 WeakPolarHBondContact CB-OD2 3.46Å; L594-D597 PolarHBondContact N-OD2 3.22Å; L594-D597 WeakPolarHBondContact O-CB 3.45Å; L594-D597 PolarHBondContact O-N 3.02Å; K595-D597 PolarHBondContact O-N 3.41Å
598	V	80.4	Confident	82.4	Confident	41 Å²	41	52.6 Å²	52.6	25%	0.248	28%	0.279	C	S	.	.	H	α-helix	trans	-121.8	-11.4	-167.4	-63.8	0	0	0	0	115.9	F383 L406 R593 L594 K595	F383-V598 HydrophobicContact CB-CG1 3.92Å; F383-V598 HydrophobicContact CD1-CB 3.81Å; F383-V598 HydrophobicContact CD1-CG1 4.06Å; F383-V598 HydrophobicContact CD1-CG2 4.26Å; F383-V598 HydrophobicContact CD2-CG1 4.29Å; F383-V598 HydrophobicContact CD2-CG2 4.47Å; F383-V598 HydrophobicContact CE1-CB 4.04Å; F383-V598 HydrophobicContact CE1-CG2 4.07Å; F383-V598 HydrophobicContact CE2-CG2 4.3Å; F383-V598 HydrophobicContact CG-CB 4.08Å; F383-V598 HydrophobicContact CG-CG1 3.84Å; F383-V598 HydrophobicContact CG-CG2 4.46Å; F383-V598 HydrophobicContact CZ-CG2 4.09Å; L406-V598 HydrophobicContact CD1-CG2 3.66Å; L406-V598 HydrophobicContact CD2-CG2 3.68Å; L406-V598 HydrophobicContact CG-CG2 4.32Å; R593-V598 HydrophobicContact CB-CG1 4.32Å; L594-V598 PolarHBondContact O-N 3.43Å; K595-V598 PolarHBondContact O-N 3.06Å
599	L	73.4	Confident	82.3	Confident	34 Å²	34	53.9 Å²	53.9	18%	0.178	29%	0.286	C	S	.	.			trans	-131.6	68.5	-178.5	-68.8	178	0	0	0	111.1	L406 K595 Q601 L602 I769	L406-L599 HydrophobicContact CD2-CD1 3.48Å; L406-L599 VanDerWaalsContact CD2-CD1 3.48Å; L406-L599 HydrophobicContact CD2-CG 4.04Å; K595-L599 CarbonylContact O-C 3.58Å; K595-L599 WeakPolarHBondContact O-CA 3.38Å; K595-L599 PolarHBondContact O-N 3.01Å; L599-Q601 PolarHBondContact O-N 2.7Å; L599-L602 HydrophobicContact CB-CB 4.48Å; L599-L602 HydrophobicContact CB-CD1 3.9Å; L599-L602 HydrophobicContact CB-CG 4.02Å; L599-L602 HydrophobicContact CD1-CD1 3.61Å; L599-L602 HydrophobicContact CD1-CG 4.19Å; L599-L602 HydrophobicContact CG-CD1 4.43Å; L599-L602 PolarHBondContact O-N 3.43Å; L599-I769 HydrophobicContact CD1-CD1 4.06Å; L599-I769 HydrophobicContact CD1-CG1 3.81Å
600	S	66.8	Low	82.3	Confident	118 Å²	118	54.8 Å²	54.8	83%	0.825	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-12.4	175.4	57.5	0	0	0	0	115.1
601	Q	63.9	Low	82.1	Confident	183 Å²	183	58 Å²	58	86%	0.855	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-12.8	175.3	-62.4	-178.9	2.6	0	0	113.9	L599	L599-Q601 PolarHBondContact O-N 2.7Å
602	L	66.2	Low	81.9	Confident	30 Å²	30	57.2 Å²	57.2	16%	0.157	31%	0.308	C	S	.	.	S	Bend	trans	-70.9	130.3	177.4	-83.6	176.9	0	0	0	110.4	K595 L599 R768	K595-L602 HydrophobicContact CB-CD1 4.05Å; K595-L602 HydrophobicContact CD-CD1 4.07Å; K595-L602 HydrophobicContact CG-CD1 3.98Å; L599-L602 HydrophobicContact CB-CB 4.48Å; L599-L602 HydrophobicContact CB-CD1 3.9Å; L599-L602 HydrophobicContact CB-CG 4.02Å; L599-L602 HydrophobicContact CD1-CD1 3.61Å; L599-L602 HydrophobicContact CD1-CG 4.19Å; L599-L602 HydrophobicContact CG-CD1 4.43Å; L599-L602 PolarHBondContact O-N 3.43Å; L602-R768 WeakPolarHBondContact CD2-O 3.49Å
603	P	70	Confident	81.7	Confident	21 Å²	21	58.6 Å²	58.6	14%	0.136	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-58.9	158	174.8	-25.4	34.7	0	0	0	113.3	H767 Q771 T772 S773	P603-H767 PolarHBondContact O-NE2 2.87Å; P603-Q771 HydrophobicContact CG-CG 4.49Å; P603-T772 WeakPolarHBondContact CG-O 3.09Å; P603-S773 WeakPolarHBondContact CB-O 3.33Å; P603-S773 WeakPolarHBondContact CG-O 3.44Å
604	S	79.3	Confident	81.5	Confident	58 Å²	58	58.8 Å²	58.8	41%	0.406	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-68	139	-179	69.7	0	0	0	0	111.8	N774 V775	S604-N774 PolarHBondContact N-OD1 3.04Å; S604-N774 WeakPolarHBondContact O-CA 3.26Å; S604-N774 PolarHBondContact OG-OD1 2.95Å; S604-V775 PolarHBondContact O-N 3.11Å
605	K	84.3	Confident	80.9	Confident	26 Å²	26	64.4 Å²	64.4	11%	0.113	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	119.2	169	179.5	165.4	54.2	167.6	0	108.7	E763 D764 H767 V775 I777	K605-E763 HydrophobicContact CD-CB 4.2Å; K605-E763 WeakPolarHBondContact CE-OE2 3.4Å; K605-E763 IonicContact NZ-OE2 3.28Å; K605-E763 PolarHBondContact NZ-OE2 3.13Å; K605-D764 IonicContact NZ-OD1 2.68Å; K605-D764 PolarHBondContact NZ-OD1 3.24Å; K605-H767 HydrophobicContact CD-CB 4.16Å; K605-V775 CarbonylContact C-O 3.36Å; K605-V775 WeakPolarHBondContact CA-O 3.14Å; K605-I777 HydrophobicContact CD-CD1 4.15Å; K605-I777 HydrophobicContact CD-CG1 3.95Å; K605-I777 HydrophobicContact CG-CD1 4.28Å; K605-I777 HydrophobicContact CG-CG1 3.73Å
606	Q	84.1	Confident	80.2	Confident	108 Å²	108	66.7 Å²	66.7	51%	0.505	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.9	-179.5	-59.1	-164.9	27.5	0	0	110.1	V775 I777	Q606-V775 PolarHBondContact N-O 2.74Å; Q606-I777 WeakPolarHBondContact O-CB 3.33Å; Q606-I777 PolarHBondContact O-N 2.98Å
607	R	88.2	Confident	80.2	Confident	45 Å²	45	64 Å²	64	17%	0.17	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	130.1	178.3	-71.6	-175.2	-174	101.8	-4.2	110.2	E763 I777 Y779 N810 L811	R607-E763 IonicContact CZ-OE1 3.58Å; R607-E763 IonicContact CZ-OE2 2.67Å; R607-E763 IonicContact NE-OE1 2.64Å; R607-E763 PolarHBondContact NE-OE1 3.1Å; R607-E763 IonicContact NE-OE2 2.64Å; R607-E763 PolarHBondContact NE-OE2 3.1Å; R607-E763 IonicContact NH2-OE1 3.66Å; R607-E763 PolarHBondContact NH2-OE1 2.86Å; R607-E763 IonicContact NH2-OE2 2.6Å; R607-E763 PolarHBondContact NH2-OE2 3.04Å; R607-I777 HydrophobicContact CG-CB 4.14Å; R607-I777 HydrophobicContact CG-CG1 4.38Å; R607-Y779 HydrophobicContact CB-CE2 4.1Å; R607-Y779 VanDerWaalsContact CD-OH 3.28Å; R607-Y779 WeakPolarHBondContact CD-OH 3.32Å; R607-Y779 HydrophobicContact CG-CE2 4.13Å; R607-Y779 PolarHBondContact NE-OH 2.92Å; R607-N810 PolarHBondContact NH1-O 3.43Å; R607-L811 HydrophobicContact CB-CD2 4.12Å
608	K	89	Confident	80.3	Confident	119 Å²	119	62.3 Å²	62.3	52%	0.517	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132	-179.7	-177.9	178	-179.9	-179.7	0	110.7	V610 I777 H778 Y779	K608-V610 HydrophobicContact CD-CG2 4.29Å; K608-V610 HydrophobicContact CG-CG2 4.21Å; K608-I777 PolarHBondContact N-O 2.72Å; K608-H778 WeakPolarHBondContact O-CA 3.48Å; K608-Y779 PolarHBondContact O-N 2.78Å
609	V	90.3	Very high	80.5	Confident	38 Å²	38	63.2 Å²	63.2	23%	0.23	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	131.6	166.1	-176.8	0	0	0	0	108.2	V781 W791	V609-V781 HydrophobicContact CG1-CB 4.44Å; V609-V781 HydrophobicContact CG1-CG1 4.17Å; V609-V781 HydrophobicContact CG1-CG2 3.38Å; V609-W791 HydrophobicContact CG2-CD2 4.37Å; V609-W791 HydrophobicContact CG2-CH2 3.86Å; V609-W791 HydrophobicContact CG2-CZ2 3.26Å
610	V	91.9	Very high	81.1	Confident	20 Å²	20	71.4 Å²	71.4	12%	0.121	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	104.6	176.8	-179.5	0	0	0	0	107.4	K608 V612 Y664 H778 Y779 L780 V781	K608-V610 HydrophobicContact CD-CG2 4.29Å; K608-V610 HydrophobicContact CG-CG2 4.21Å; V610-V612 HydrophobicContact CG1-CG1 4.23Å; V610-V612 PolarHBondContact O-N 2.94Å; V610-Y664 HydrophobicContact CG1-CD2 4.26Å; V610-Y664 HydrophobicContact CG1-CE2 3.79Å; V610-H778 HydrophobicContact CG2-CB 4.12Å; V610-Y779 PolarHBondContact N-O 3.2Å; V610-L780 HydrophobicContact CB-CD2 3.73Å; V610-L780 HydrophobicContact CG1-CD2 3.94Å; V610-L780 HydrophobicContact CG2-CD2 4.31Å; V610-L780 WeakPolarHBondContact O-CA 3.44Å; V610-V781 PolarHBondContact O-N 3.21Å
611	T	91.8	Very high	82.1	Confident	71 Å²	71	67 Å²	67	44%	0.436	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	121.6	175.4	-55.8	0	0	0	0	109.3	V781 K783 F820	T611-V781 CarbonylContact C-O 3.58Å; T611-V781 VanDerWaalsContact CA-O 3.29Å; T611-V781 WeakPolarHBondContact CA-O 3.2Å; T611-K783 HydrophobicContact CG2-CG 4.28Å; T611-F820 HydrophobicContact CG2-CZ 4.09Å; T611-F820 WeakPolarHBondContact OG1-CE2 3.38Å
612	V	90.7	Very high	83.1	Confident	13 Å²	13	62.4 Å²	62.4	8%	0.079	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	143	-180	-61.2	0	0	0	0	111.1	V610 A660 L780 V781 A782	V610-V612 HydrophobicContact CG1-CG1 4.23Å; V610-V612 PolarHBondContact O-N 2.94Å; V612-A660 HydrophobicContact CB-CB 3.81Å; V612-A660 HydrophobicContact CG2-CB 4.14Å; V612-L780 HydrophobicContact CG1-CB 4.27Å; V612-L780 HydrophobicContact CG1-CD2 4.37Å; V612-V781 PolarHBondContact N-O 3.5Å; V612-A782 HydrophobicContact CG2-CB 4.12Å
613	T	87.7	Confident	84.1	Confident	69 Å²	69	63.8 Å²	63.8	42%	0.423	36%	0.356	S	S	.	.			trans	-94.7	115	-173.6	44.3	0	0	0	0	112	E615	T613-E615 PolarHBondContact O-N 2.89Å; T613-E615 VanDerWaalsContact O-N 3.13Å
614	I	85.3	Confident	85	Confident	25 Å²	25	64 Å²	64	13%	0.128	36%	0.36	C	S	.	.			trans	-83.7	32.1	176.1	58.8	165	0	0	0	113.3	V617 K622 L625 A656 K657 A782 K783 T785	I614-V617 HydrophobicContact CB-CG2 3.82Å; I614-V617 HydrophobicContact CG2-CG2 4.41Å; I614-V617 WeakPolarHBondContact O-CB 3.45Å; I614-V617 WeakPolarHBondContact O-CG2 3.28Å; I614-V617 PolarHBondContact O-N 2.98Å; I614-K622 WeakPolarHBondContact O-CE 3.43Å; I614-L625 HydrophobicContact CD1-CD1 4.25Å; I614-A656 WeakPolarHBondContact CG2-O 3.41Å; I614-K657 HydrophobicContact CG2-CG 4.44Å; I614-A782 HydrophobicContact CG2-CB 3.74Å; I614-K783 WeakPolarHBondContact CD1-O 3.3Å; I614-T785 HydrophobicContact CD1-CG2 3.79Å
615	E	72.8	Confident	85.4	Confident	152 Å²	152	61.6 Å²	61.6	71%	0.71	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-34.9	-172.1	-71.6	176.1	-170.1	0	0	112.8	T613 V617 K622	T613-E615 PolarHBondContact O-N 2.89Å; T613-E615 VanDerWaalsContact O-N 3.13Å; E615-V617 PolarHBondContact O-N 3.35Å; E615-K622 PolarHBondContact O-NZ 3.32Å
616	G	68.1	Low	85.5	Confident	52 Å²	52	62.8 Å²	62.8	54%	0.536	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-10.7	175	0	0	0	0	0	115.1
617	V	79	Confident	85.7	Confident	17 Å²	17	60 Å²	60	10%	0.103	35%	0.349	C	S	.	.	S	Bend	trans	-64.7	139.5	-176.3	176.4	0	0	0	0	111.8	I614 E615 M621 K622 A656	I614-V617 HydrophobicContact CB-CG2 3.82Å; I614-V617 HydrophobicContact CG2-CG2 4.41Å; I614-V617 WeakPolarHBondContact O-CB 3.45Å; I614-V617 WeakPolarHBondContact O-CG2 3.28Å; I614-V617 PolarHBondContact O-N 2.98Å; E615-V617 PolarHBondContact O-N 3.35Å; V617-M621 HydrophobicContact CG1-CB 3.54Å; V617-M621 HydrophobicContact CG1-CG 3.43Å; V617-M621 VanDerWaalsContact CG1-CG 3.43Å; V617-K622 HydrophobicContact CB-CG 4.45Å; V617-K622 HydrophobicContact CG1-CG 4.22Å; V617-K622 WeakPolarHBondContact O-CE 3.38Å; V617-K622 PolarHBondContact O-NZ 3.15Å; V617-A656 HydrophobicContact CG1-CB 4.26Å; V617-A656 HydrophobicContact CG2-CB 4.26Å; V617-A656 WeakPolarHBondContact CG2-O 3.19Å
618	S	83.1	Confident	85.6	Confident	69 Å²	69	58 Å²	58	48%	0.483	34%	0.342	S	S	.	.			trans	-58.5	149.1	-177.5	76.8	0	0	0	0	112.9	R620 M621 K622	S618-R620 PolarHBondContact O-N 3.06Å; S618-M621 PolarHBondContact O-N 3.12Å; S618-M621 VanDerWaalsContact O-N 3.1Å; S618-M621 PolarHBondContact OG-N 3.23Å; S618-K622 PolarHBondContact O-N 3.4Å
619	G	83.8	Confident	85.5	Confident	59 Å²	59	53.6 Å²	53.6	61%	0.608	33%	0.328	S	S	*	.	H	α-helix	trans	-57.5	-32.4	176.6	0	0	0	0	0	113.2	A623	G619-A623 WeakPolarHBondContact O-CB 3.48Å; G619-A623 PolarHBondContact O-N 3.14Å
620	R	86.4	Confident	85.3	Confident	207 Å²	207	57.8 Å²	57.8	78%	0.781	34%	0.343	S	S	*	.	H	α-helix	trans	-62.1	-49.3	174.1	-173.2	-172.6	-65.1	175.7	-0.1	111.6	S618 A623 A624	S618-R620 PolarHBondContact O-N 3.06Å; R620-A623 WeakPolarHBondContact O-CB 3.2Å; R620-A623 PolarHBondContact O-N 2.93Å; R620-A624 WeakPolarHBondContact O-CB 3.48Å; R620-A624 PolarHBondContact O-N 2.93Å
621	M	87.9	Confident	84.9	Confident	25 Å²	25	61.4 Å²	61.4	12%	0.123	36%	0.358	C	S	.	.	H	α-helix	trans	-69.2	-37.6	-178.8	176.7	55.2	65.2	0	0	112	V617 S618 A623 A624 L625 H652 E655 A656	V617-M621 HydrophobicContact CG1-CB 3.54Å; V617-M621 HydrophobicContact CG1-CG 3.43Å; V617-M621 VanDerWaalsContact CG1-CG 3.43Å; S618-M621 PolarHBondContact O-N 3.12Å; S618-M621 VanDerWaalsContact O-N 3.1Å; S618-M621 PolarHBondContact OG-N 3.23Å; M621-A623 VanDerWaalsContact C-N 3.32Å; M621-A623 PolarHBondContact O-N 3.22Å; M621-A624 PolarHBondContact O-N 2.74Å; M621-A624 HydrophobicContact SD-CB 4.5Å; M621-L625 PolarHBondContact O-N 3.24Å; M621-L625 HydrophobicContact SD-CG 4.49Å; M621-H652 HydrophobicContact SD-CB 4.09Å; M621-E655 HydrophobicContact CE-CB 3.75Å; M621-E655 HydrophobicContact CE-CG 4.48Å; M621-E655 WeakPolarHBondContact CE-OE2 3.48Å; M621-E655 HydrophobicContact SD-CB 4.4Å; M621-A656 HydrophobicContact CG-CB 4.05Å
622	K	85.9	Confident	84.4	Confident	87 Å²	87	58 Å²	58	38%	0.378	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-39.5	171	-73.9	167.9	175.5	150.7	0	112.3	I614 E615 V617 S618 S626	I614-K622 WeakPolarHBondContact O-CE 3.43Å; E615-K622 PolarHBondContact O-NZ 3.32Å; V617-K622 HydrophobicContact CB-CG 4.45Å; V617-K622 HydrophobicContact CG1-CG 4.22Å; V617-K622 WeakPolarHBondContact O-CE 3.38Å; V617-K622 PolarHBondContact O-NZ 3.15Å; S618-K622 PolarHBondContact O-N 3.4Å; K622-S626 PolarHBondContact O-N 3.18Å; K622-S626 VanDerWaalsContact O-N 3.14Å
623	A	86.7	Confident	83.8	Confident	59 Å²	59	60.4 Å²	60.4	49%	0.488	35%	0.352	S	S	.	.	H	α-helix	trans	-67.6	-40.2	173.5	0	0	0	0	0	112.3	G619 R620 M621 S626 A627	G619-A623 WeakPolarHBondContact O-CB 3.48Å; G619-A623 PolarHBondContact O-N 3.14Å; R620-A623 WeakPolarHBondContact O-CB 3.2Å; R620-A623 PolarHBondContact O-N 2.93Å; M621-A623 VanDerWaalsContact C-N 3.32Å; M621-A623 PolarHBondContact O-N 3.22Å; A623-S626 PolarHBondContact O-N 3.37Å; A623-A627 WeakPolarHBondContact O-CB 3.38Å; A623-A627 PolarHBondContact O-N 3.36Å
624	A	89	Confident	83.5	Confident	26 Å²	26	63.3 Å²	63.3	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-47	177.3	0	0	0	0	0	112.3	R620 M621 S626 A627 A628	R620-A624 WeakPolarHBondContact O-CB 3.48Å; R620-A624 PolarHBondContact O-N 2.93Å; M621-A624 PolarHBondContact O-N 2.74Å; M621-A624 HydrophobicContact SD-CB 4.5Å; A624-S626 PolarHBondContact O-N 2.98Å; A624-A627 PolarHBondContact O-N 2.91Å; A624-A627 VanDerWaalsContact O-N 3.16Å; A624-A628 WeakPolarHBondContact O-CB 3.32Å; A624-A628 PolarHBondContact O-N 3.12Å
625	L	87.4	Confident	83	Confident	7 Å²	7	68.1 Å²	68.1	4%	0.037	40%	0.395	C	S	.	.	H	α-helix	trans	-54.8	-48.6	171.1	-84.4	172.8	0	0	0	111.9	I614 M621 A627 A628 A629 F649 H652 A656 T785	I614-L625 HydrophobicContact CD1-CD1 4.25Å; M621-L625 PolarHBondContact O-N 3.24Å; M621-L625 HydrophobicContact SD-CG 4.49Å; L625-A627 VanDerWaalsContact C-N 3.3Å; L625-A627 PolarHBondContact O-N 3.36Å; L625-A628 PolarHBondContact O-N 3.46Å; L625-A629 WeakPolarHBondContact O-CB 3.19Å; L625-A629 PolarHBondContact O-N 3.45Å; L625-F649 HydrophobicContact CD2-CD2 4.02Å; L625-F649 HydrophobicContact CD2-CE2 3.84Å; L625-H652 HydrophobicContact CD2-CB 3.72Å; L625-H652 HydrophobicContact CG-CB 4.15Å; L625-A656 HydrophobicContact CD1-CB 3.59Å; L625-T785 HydrophobicContact CD1-CG2 4.33Å
626	S	86.9	Confident	83.2	Confident	50 Å²	50	63 Å²	63	35%	0.35	37%	0.371	S	S	.	.	H	α-helix	trans	-63	-36.6	178.1	-169.5	0	0	0	0	112.2	K622 A623 A624 K630	K622-S626 PolarHBondContact O-N 3.18Å; K622-S626 VanDerWaalsContact O-N 3.14Å; A623-S626 PolarHBondContact O-N 3.37Å; A624-S626 PolarHBondContact O-N 2.98Å; S626-K630 VanDerWaalsContact O-CB 3.32Å; S626-K630 WeakPolarHBondContact O-CB 3.48Å; S626-K630 VanDerWaalsContact O-CD 3.32Å; S626-K630 WeakPolarHBondContact O-CD 3.37Å; S626-K630 WeakPolarHBondContact O-CG 3.39Å; S626-K630 PolarHBondContact O-N 3.38Å; S626-K630 PolarHBondContact OG-NZ 3.37Å
627	A	88	Confident	83.2	Confident	49 Å²	49	71.6 Å²	71.6	41%	0.405	39%	0.387	S	S	.	.	H	α-helix	trans	-69.1	-43.4	176.8	0	0	0	0	0	112.1	A623 A624 L625 K630 Q631	A623-A627 WeakPolarHBondContact O-CB 3.38Å; A623-A627 PolarHBondContact O-N 3.36Å; A624-A627 PolarHBondContact O-N 2.91Å; A624-A627 VanDerWaalsContact O-N 3.16Å; L625-A627 VanDerWaalsContact C-N 3.3Å; L625-A627 PolarHBondContact O-N 3.36Å; A627-K630 CarbonylContact O-C 3.45Å; A627-K630 PolarHBondContact O-N 3.32Å; A627-Q631 WeakPolarHBondContact O-CG 3.28Å; A627-Q631 PolarHBondContact O-N 2.58Å
628	A	86.9	Confident	83.1	Confident	4 Å²	4	73.2 Å²	73.2	3%	0.033	40%	0.399	C	S	.	.	H	α-helix	trans	-64.7	-46.5	177	0	0	0	0	0	111.8	A624 L625 K630 Q631 L632 V648 F649	A624-A628 WeakPolarHBondContact O-CB 3.32Å; A624-A628 PolarHBondContact O-N 3.12Å; L625-A628 PolarHBondContact O-N 3.46Å; A628-K630 VanDerWaalsContact C-N 3.29Å; A628-K630 PolarHBondContact O-N 3.15Å; A628-Q631 WeakPolarHBondContact O-CB 3.2Å; A628-Q631 PolarHBondContact O-N 2.93Å; A628-L632 PolarHBondContact O-N 3.49Å; A628-L632 VanDerWaalsContact O-N 3.13Å; A628-V648 HydrophobicContact CB-CG1 4.39Å; A628-F649 HydrophobicContact CB-CB 4Å; A628-F649 HydrophobicContact CB-CD2 3.96Å; A628-F649 HydrophobicContact CB-CG 4.38Å
629	A	85.8	Confident	82.5	Confident	26 Å²	26	73.6 Å²	73.6	22%	0.215	39%	0.392	C	S	.	.	H	α-helix	trans	-57.9	-39.8	173.1	0	0	0	0	0	112.2	L625 Q631 L632 T633 F649	L625-A629 WeakPolarHBondContact O-CB 3.19Å; L625-A629 PolarHBondContact O-N 3.45Å; A629-Q631 VanDerWaalsContact C-N 3.34Å; A629-Q631 PolarHBondContact O-N 2.92Å; A629-L632 PolarHBondContact O-N 3.34Å; A629-T633 PolarHBondContact O-N 3.16Å; A629-F649 HydrophobicContact CB-CD2 4.42Å; A629-F649 HydrophobicContact CB-CE2 3.88Å; A629-F649 HydrophobicContact CB-CZ 4.01Å
630	K	85.8	Confident	82	Confident	126 Å²	126	75 Å²	75	55%	0.548	38%	0.384	S	S	.	.	H	α-helix	trans	-71.8	-20.3	173.8	-75.5	166.3	-178.5	151.9	0	114.3	S626 A627 A628 T633 K634	S626-K630 VanDerWaalsContact O-CB 3.32Å; S626-K630 WeakPolarHBondContact O-CB 3.48Å; S626-K630 VanDerWaalsContact O-CD 3.32Å; S626-K630 WeakPolarHBondContact O-CD 3.37Å; S626-K630 WeakPolarHBondContact O-CG 3.39Å; S626-K630 PolarHBondContact O-N 3.38Å; S626-K630 PolarHBondContact OG-NZ 3.37Å; A627-K630 CarbonylContact O-C 3.45Å; A627-K630 PolarHBondContact O-N 3.32Å; A628-K630 VanDerWaalsContact C-N 3.29Å; A628-K630 PolarHBondContact O-N 3.15Å; K630-T633 PolarHBondContact O-OG1 2.84Å; K630-T633 VanDerWaalsContact O-OG1 3.06Å; K630-K634 WeakPolarHBondContact O-CE 3.18Å; K630-K634 WeakPolarHBondContact O-CG 3.32Å
631	Q	84.1	Confident	81.5	Confident	96 Å²	96	68.4 Å²	68.4	45%	0.449	36%	0.362	S	S	.	.	H	α-helix	trans	-73.5	-43.1	170.4	-73.6	-167.7	20.5	0	0	110.4	A627 A628 A629 T633 K634 H636 A645	A627-Q631 WeakPolarHBondContact O-CG 3.28Å; A627-Q631 PolarHBondContact O-N 2.58Å; A628-Q631 WeakPolarHBondContact O-CB 3.2Å; A628-Q631 PolarHBondContact O-N 2.93Å; A629-Q631 VanDerWaalsContact C-N 3.34Å; A629-Q631 PolarHBondContact O-N 2.92Å; Q631-T633 PolarHBondContact O-N 3.15Å; Q631-T633 VanDerWaalsContact O-N 3.16Å; Q631-K634 VanDerWaalsContact O-CB 3.3Å; Q631-K634 WeakPolarHBondContact O-CB 3.33Å; Q631-K634 PolarHBondContact O-N 2.68Å; Q631-H636 PolarHBondContact O-NE2 3.48Å; Q631-A645 HydrophobicContact CB-CB 4.49Å
632	L	80.1	Confident	81	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-61.7	-18.7	176.5	-74.3	168.7	0	0	0	114.6	A628 A629 K634 A645 L646 F649 I830 M833 F834	A628-L632 PolarHBondContact O-N 3.49Å; A628-L632 VanDerWaalsContact O-N 3.13Å; A629-L632 PolarHBondContact O-N 3.34Å; L632-K634 VanDerWaalsContact C-N 3.31Å; L632-A645 HydrophobicContact CD2-CB 4.05Å; L632-A645 HydrophobicContact CG-CB 4.4Å; L632-L646 HydrophobicContact CD2-CB 4.06Å; L632-F649 HydrophobicContact CD1-CB 3.73Å; L632-F649 HydrophobicContact CD1-CD1 3.42Å; L632-F649 VanDerWaalsContact CD1-CD1 3.42Å; L632-F649 HydrophobicContact CD1-CE1 4.25Å; L632-F649 HydrophobicContact CD1-CG 3.83Å; L632-I830 HydrophobicContact CB-CD1 4.26Å; L632-I830 HydrophobicContact CB-CG1 4.13Å; L632-I830 HydrophobicContact CD1-CG2 4.34Å; L632-M833 HydrophobicContact CD2-SD 4.07Å; L632-M833 WeakPolarHBondContact O-CE 3.4Å; L632-F834 HydrophobicContact CD1-CE2 4.45Å
633	T	79.1	Confident	80.7	Confident	63 Å²	63	64.1 Å²	64.1	39%	0.387	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2	172.6	59	0	0	0	0	113.8	A629 K630 Q631 N826 I830	A629-T633 PolarHBondContact O-N 3.16Å; K630-T633 PolarHBondContact O-OG1 2.84Å; K630-T633 VanDerWaalsContact O-OG1 3.06Å; Q631-T633 PolarHBondContact O-N 3.15Å; Q631-T633 VanDerWaalsContact O-N 3.16Å; T633-N826 HydrophobicContact CG2-CB 4.16Å; T633-I830 HydrophobicContact CG2-CD1 4.02Å; T633-I830 HydrophobicContact CG2-CG1 4.43Å
634	K	82.1	Confident	80.5	Confident	130 Å²	130	65.6 Å²	65.6	57%	0.565	34%	0.34	S	S	*	.	S	Bend	trans	-95	157.1	-177.8	-62.2	178.4	-176.7	180	0	112	K630 Q631 L632 H636	K630-K634 WeakPolarHBondContact O-CE 3.18Å; K630-K634 WeakPolarHBondContact O-CG 3.32Å; Q631-K634 VanDerWaalsContact O-CB 3.3Å; Q631-K634 WeakPolarHBondContact O-CB 3.33Å; Q631-K634 PolarHBondContact O-N 2.68Å; L632-K634 VanDerWaalsContact C-N 3.31Å; K634-H636 PolarHBondContact O-CD2 2.9Å; K634-H636 PolarHBondContact O-N 3.22Å; K634-H636 VanDerWaalsContact O-N 3.1Å
635	S	74.7	Confident	80.3	Confident	126 Å²	126	64.6 Å²	64.6	88%	0.881	33%	0.332	S	S	*	.			trans	-70.3	102.5	169.5	-52.4	0	0	0	0	110.6
636	H	76.7	Confident	80.2	Confident	46 Å²	46	64.3 Å²	64.3	21%	0.213	33%	0.33	C	S	.	.			trans	-72.7	146.9	170.6	-65	-87.5	0	0	0	111	Q631 K634 E641 E642	Q631-H636 PolarHBondContact O-NE2 3.48Å; K634-H636 PolarHBondContact O-CD2 2.9Å; K634-H636 PolarHBondContact O-N 3.22Å; K634-H636 VanDerWaalsContact O-N 3.1Å; H636-E641 HydrophobicContact CB-CB 4.13Å; H636-E641 PolarHBondContact CE1-O 3.41Å; H636-E641 PolarHBondContact ND1-O 3.3Å; H636-E642 HydrophobicContact CB-CB 4.21Å
637	R	68.6	Low	80.2	Confident	231 Å²	231	62.5 Å²	62.5	87%	0.872	32%	0.317	S	S	*	.	S	Bend	trans	-87.1	-19	-179.7	-47.2	177.7	-162.5	-175.5	7.5	112.4	E641	R637-E641 WeakPolarHBondContact CB-OE2 3.49Å; R637-E641 WeakPolarHBondContact CG-OE2 3.35Å; R637-E641 PolarHBondContact N-OE2 2.7Å
638	S	75.7	Confident	80.2	Confident	51 Å²	51	62 Å²	62	36%	0.357	31%	0.309	S	S	.	.	S	Bend	trans	-146.4	158.4	178.8	75.1	0	0	0	0	112.3	M640 E641 E642	S638-M640 PolarHBondContact O-N 3.27Å; S638-M640 PolarHBondContact OG-N 2.86Å; S638-E641 PolarHBondContact O-N 3Å; S638-E641 PolarHBondContact OG-N 3.13Å; S638-E642 PolarHBondContact O-N 3.2Å
639	K	70.2	Confident	80.4	Confident	78 Å²	78	62 Å²	62	34%	0.339	31%	0.308	S	S	.	.	H	α-helix	trans	-51.4	-33	167.5	-97.9	-168	165.4	-157.4	0	112.8	E642 K643 E841 D842	K639-E642 PolarHBondContact O-N 2.93Å; K639-K643 WeakPolarHBondContact O-CB 3.43Å; K639-K643 PolarHBondContact O-N 3.13Å; K639-E841 IonicContact NZ-OE2 3.49Å; K639-D842 IonicContact NZ-OD1 3.84Å; K639-D842 PolarHBondContact NZ-OD1 3.15Å; K639-D842 IonicContact NZ-OD2 2.97Å; K639-D842 PolarHBondContact NZ-OD2 3.03Å
640	M	72.9	Confident	80.6	Confident	88 Å²	88	61 Å²	61	43%	0.433	30%	0.298	S	S	.	.	H	α-helix	trans	-73	-44.2	-175	-171.3	172.7	177.2	0	0	110.8	S638 E642 K643 E644 L849 F887	S638-M640 PolarHBondContact O-N 3.27Å; S638-M640 PolarHBondContact OG-N 2.86Å; M640-E642 VanDerWaalsContact C-N 3.32Å; M640-E642 PolarHBondContact O-N 3.26Å; M640-K643 PolarHBondContact O-N 3.04Å; M640-E644 WeakPolarHBondContact O-CB 3.48Å; M640-E644 PolarHBondContact O-N 3.3Å; M640-L849 HydrophobicContact CE-CD2 4.47Å; M640-F887 HydrophobicContact CE-CD1 3.62Å; M640-F887 HydrophobicContact CE-CD2 4.12Å; M640-F887 HydrophobicContact CE-CE1 3.36Å; M640-F887 HydrophobicContact CE-CE2 3.87Å; M640-F887 HydrophobicContact CE-CG 4.01Å; M640-F887 HydrophobicContact CE-CZ 3.5Å; M640-F887 VanDerWaalsContact CE-CZ 3.5Å
641	E	77.3	Confident	80.9	Confident	68 Å²	68	56.8 Å²	56.8	32%	0.318	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-38.6	171.8	-66.8	172.1	-167.9	0	0	112	H636 R637 S638 A645	H636-E641 HydrophobicContact CB-CB 4.13Å; H636-E641 PolarHBondContact CE1-O 3.41Å; H636-E641 PolarHBondContact ND1-O 3.3Å; R637-E641 WeakPolarHBondContact CB-OE2 3.49Å; R637-E641 WeakPolarHBondContact CG-OE2 3.35Å; R637-E641 PolarHBondContact N-OE2 2.7Å; S638-E641 PolarHBondContact O-N 3Å; S638-E641 PolarHBondContact OG-N 3.13Å; E641-A645 PolarHBondContact O-N 3.43Å; E641-A645 VanDerWaalsContact O-N 3.14Å
642	E	76.5	Confident	81.3	Confident	12 Å²	12	54.2 Å²	54.2	6%	0.056	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-47.6	175.5	-169.2	-176.5	141.7	0	0	110.4	H636 S638 K639 M640 L646 M833 R836 S837	H636-E642 HydrophobicContact CB-CB 4.21Å; S638-E642 PolarHBondContact O-N 3.2Å; K639-E642 PolarHBondContact O-N 2.93Å; M640-E642 VanDerWaalsContact C-N 3.32Å; M640-E642 PolarHBondContact O-N 3.26Å; E642-L646 WeakPolarHBondContact O-CB 3.24Å; E642-L646 PolarHBondContact O-N 3.06Å; E642-M833 HydrophobicContact CG-CB 4.21Å; E642-M833 HydrophobicContact CG-CG 3.88Å; E642-M833 HydrophobicContact CG-SD 3.94Å; E642-R836 IonicContact OE1-CZ 2.7Å; E642-R836 IonicContact OE1-NE 3.67Å; E642-R836 PolarHBondContact OE1-NE 2.76Å; E642-R836 IonicContact OE1-NH2 3.67Å; E642-R836 IonicContact OE2-CZ 3.78Å; E642-R836 IonicContact OE2-NE 3.46Å; E642-R836 IonicContact OE2-NH2 3.22Å; E642-R836 PolarHBondContact OE2-NH2 3.4Å; E642-S837 PolarHBondContact OE1-OG 3.5Å
643	K	79.3	Confident	81.9	Confident	11 Å²	11	54.4 Å²	54.4	5%	0.048	27%	0.271	C	S	.	.	H	α-helix	trans	-70.7	-36.3	179.8	-169.8	169	-176.6	169.4	0	113	K639 M640 L646 L647 D842 L849	K639-K643 WeakPolarHBondContact O-CB 3.43Å; K639-K643 PolarHBondContact O-N 3.13Å; M640-K643 PolarHBondContact O-N 3.04Å; K643-L646 PolarHBondContact O-N 3.18Å; K643-L647 WeakPolarHBondContact O-CG 3.43Å; K643-L647 PolarHBondContact O-N 3.42Å; K643-D842 PolarHBondContact NZ-O 3.16Å; K643-L849 HydrophobicContact CD-CD1 4.1Å
644	E	83.1	Confident	82.5	Confident	90 Å²	90	51.6 Å²	51.6	42%	0.421	25%	0.254	S	S	.	.	H	α-helix	trans	-64.6	-51.7	176.6	-175.4	-178.3	175.7	0	0	111.4	M640 L646 L647 V648	M640-E644 WeakPolarHBondContact O-CB 3.48Å; M640-E644 PolarHBondContact O-N 3.3Å; E644-L646 PolarHBondContact O-N 2.96Å; E644-L647 PolarHBondContact O-N 3.22Å; E644-V648 WeakPolarHBondContact O-CG2 3.26Å; E644-V648 PolarHBondContact O-N 2.9Å
645	A	85.8	Confident	83	Confident	5 Å²	5	49.3 Å²	49.3	4%	0.041	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-32.6	178.3	0	0	0	0	0	112.6	Q631 L632 E641 F649	Q631-A645 HydrophobicContact CB-CB 4.49Å; L632-A645 HydrophobicContact CD2-CB 4.05Å; L632-A645 HydrophobicContact CG-CB 4.4Å; E641-A645 PolarHBondContact O-N 3.43Å; E641-A645 VanDerWaalsContact O-N 3.14Å; A645-F649 PolarHBondContact O-N 3.35Å; A645-F649 VanDerWaalsContact O-N 3.09Å
646	L	84.6	Confident	83.9	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.2	-51.3	174.5	-171.8	163.3	0	0	0	111.6	L632 E642 K643 E644 V648 F649 Y650 F834 F838	L632-L646 HydrophobicContact CD2-CB 4.06Å; E642-L646 WeakPolarHBondContact O-CB 3.24Å; E642-L646 PolarHBondContact O-N 3.06Å; K643-L646 PolarHBondContact O-N 3.18Å; E644-L646 PolarHBondContact O-N 2.96Å; L646-V648 VanDerWaalsContact C-N 3.28Å; L646-V648 PolarHBondContact O-N 3.11Å; L646-F649 PolarHBondContact O-N 3.39Å; L646-F649 VanDerWaalsContact O-N 3.11Å; L646-Y650 PolarHBondContact O-N 2.96Å; L646-F834 HydrophobicContact CD1-CB 4.21Å; L646-F834 HydrophobicContact CD1-CD1 3.84Å; L646-F834 HydrophobicContact CD1-CD2 3.68Å; L646-F834 HydrophobicContact CD1-CE1 4.14Å; L646-F834 HydrophobicContact CD1-CE2 4.01Å; L646-F834 HydrophobicContact CD1-CG 3.6Å; L646-F834 HydrophobicContact CD1-CZ 4.23Å; L646-F834 HydrophobicContact CD2-CD1 4.06Å; L646-F834 HydrophobicContact CD2-CE1 3.66Å; L646-F834 HydrophobicContact CD2-CE2 4.43Å; L646-F834 HydrophobicContact CD2-CZ 3.88Å; L646-F834 HydrophobicContact CG-CD1 4.12Å; L646-F834 HydrophobicContact CG-CD2 3.98Å; L646-F834 HydrophobicContact CG-CE1 3.88Å; L646-F834 HydrophobicContact CG-CE2 3.76Å; L646-F834 HydrophobicContact CG-CG 4.17Å; L646-F834 HydrophobicContact CG-CZ 3.71Å; L646-F838 HydrophobicContact CD1-CE2 4.01Å; L646-F838 HydrophobicContact CD2-CE2 3.53Å; L646-F838 HydrophobicContact CD2-CZ 3.54Å; L646-F838 HydrophobicContact CG-CE2 4.46Å
647	L	86.2	Confident	84.8	Confident	13 Å²	13	41.3 Å²	41.3	7%	0.068	19%	0.194	C	C	.	.	H	α-helix	trans	-60.5	-39.8	178.1	-68.5	173.2	0	0	0	111.1	K643 E644 F649 Y650 N651 M850	K643-L647 WeakPolarHBondContact O-CG 3.43Å; K643-L647 PolarHBondContact O-N 3.42Å; E644-L647 PolarHBondContact O-N 3.22Å; L647-F649 PolarHBondContact O-N 3.09Å; L647-Y650 PolarHBondContact O-N 3.15Å; L647-N651 WeakPolarHBondContact O-CB 3.46Å; L647-N651 VanDerWaalsContact O-CG 3.3Å; L647-N651 PolarHBondContact O-N 3.35Å; L647-N651 PolarHBondContact O-OD1 2.86Å; L647-M850 HydrophobicContact CD2-CG 4.34Å; L647-M850 HydrophobicContact CD2-SD 4.26Å
648	V	89.5	Confident	86	Confident	39 Å²	39	31.7 Å²	31.7	24%	0.236	16%	0.16	C	C	.	.	H	α-helix	trans	-60.1	-41.5	173.8	171.7	0	0	0	0	111.9	A628 E644 L646 H652	A628-V648 HydrophobicContact CB-CG1 4.39Å; E644-V648 WeakPolarHBondContact O-CG2 3.26Å; E644-V648 PolarHBondContact O-N 2.9Å; L646-V648 VanDerWaalsContact C-N 3.28Å; L646-V648 PolarHBondContact O-N 3.11Å; V648-H652 PolarHBondContact O-N 3.4Å; V648-H652 PolarHBondContact O-ND1 3.16Å
649	F	90	Very high	86.8	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.018	16%	0.163	C	C	.	.	H	α-helix	trans	-69.4	-34.3	176.4	-176.2	-136.6	0	0	0	113	L625 A628 A629 L632 A645 L646 L647 T653 T785 A786 F834	L625-F649 HydrophobicContact CD2-CD2 4.02Å; L625-F649 HydrophobicContact CD2-CE2 3.84Å; A628-F649 HydrophobicContact CB-CB 4Å; A628-F649 HydrophobicContact CB-CD2 3.96Å; A628-F649 HydrophobicContact CB-CG 4.38Å; A629-F649 HydrophobicContact CB-CD2 4.42Å; A629-F649 HydrophobicContact CB-CE2 3.88Å; A629-F649 HydrophobicContact CB-CZ 4.01Å; L632-F649 HydrophobicContact CD1-CB 3.73Å; L632-F649 HydrophobicContact CD1-CD1 3.42Å; L632-F649 VanDerWaalsContact CD1-CD1 3.42Å; L632-F649 HydrophobicContact CD1-CE1 4.25Å; L632-F649 HydrophobicContact CD1-CG 3.83Å; A645-F649 PolarHBondContact O-N 3.35Å; A645-F649 VanDerWaalsContact O-N 3.09Å; L646-F649 PolarHBondContact O-N 3.39Å; L646-F649 VanDerWaalsContact O-N 3.11Å; L647-F649 PolarHBondContact O-N 3.09Å; F649-T653 WeakPolarHBondContact O-CB 3.25Å; F649-T653 PolarHBondContact O-N 2.86Å; F649-T653 VanDerWaalsContact O-N 3.07Å; F649-T653 PolarHBondContact O-OG1 3.43Å; F649-T785 VanDerWaalsContact CZ-C 3.46Å; F649-A786 HydrophobicContact CD1-CB 3.92Å; F649-A786 HydrophobicContact CE1-CB 3.89Å; F649-A786 HydrophobicContact CZ-CB 4.47Å; F649-F834 HydrophobicContact CD1-CE2 4.48Å; F649-F834 HydrophobicContact CD1-CZ 4.45Å
650	Y	90.6	Very high	87.9	Confident	5 Å²	5	30.1 Å²	30.1	2%	0.02	15%	0.149	C	C	.	.	H	α-helix	trans	-70	-42.3	176.3	-176.4	-120.2	0	0	0	112.1	L646 L647 T653 A654 H681 H682 L752 W754 L790	L646-Y650 PolarHBondContact O-N 2.96Å; L647-Y650 PolarHBondContact O-N 3.15Å; Y650-T653 WeakPolarHBondContact O-CB 3.4Å; Y650-T653 PolarHBondContact O-N 2.94Å; Y650-A654 PolarHBondContact O-N 2.94Å; Y650-A654 VanDerWaalsContact O-N 3.09Å; Y650-H681 AromaticContact CE1-CD2 3.79Å; Y650-H682 AromaticContact CD1-CE1 3.37Å; Y650-H682 WeakPolarHBondContact CD1-CE1 3.4Å; Y650-H682 AromaticContact CD1-NE2 3.42Å; Y650-H682 WeakPolarHBondContact CD1-NE2 3.14Å; Y650-H682 AromaticContact CE1-CE1 3.17Å; Y650-H682 WeakPolarHBondContact CE1-CE1 3.37Å; Y650-H682 AromaticContact CE1-NE2 3.42Å; Y650-H682 WeakPolarHBondContact CE1-NE2 3.48Å; Y650-H682 AromaticContact CZ-CE1 3.68Å; Y650-L752 PolarHBondContact OH-O 3.21Å; Y650-W754 HydrophobicContact CD1-CZ3 4.37Å; Y650-W754 AromaticContact CE1-CZ3 3.73Å; Y650-W754 HydrophobicContact CE1-CZ3 3.73Å; Y650-W754 AromaticContact CZ-CZ3 3.94Å; Y650-L790 HydrophobicContact CD2-CD1 3.86Å; Y650-L790 HydrophobicContact CE2-CD1 3.8Å
651	N	91.5	Very high	89	Confident	36 Å²	36	25.9 Å²	25.9	19%	0.193	13%	0.129	C	C	.	.	H	α-helix	trans	-59.2	-51.1	173.2	-71.4	12.2	0	0	0	111.6	L647 T653 A654 E655 H682	L647-N651 WeakPolarHBondContact O-CB 3.46Å; L647-N651 VanDerWaalsContact O-CG 3.3Å; L647-N651 PolarHBondContact O-N 3.35Å; L647-N651 PolarHBondContact O-OD1 2.86Å; N651-T653 PolarHBondContact O-N 3.14Å; N651-A654 VanDerWaalsContact O-CB 3.31Å; N651-A654 WeakPolarHBondContact O-CB 3.33Å; N651-A654 PolarHBondContact O-N 3.34Å; N651-A654 VanDerWaalsContact O-N 3.08Å; N651-E655 PolarHBondContact O-N 3.38Å; N651-E655 VanDerWaalsContact O-N 3.14Å; N651-H682 PolarHBondContact OD1-NE2 2.73Å
652	H	92.1	Very high	89.9	Confident	43 Å²	43	23.8 Å²	23.8	20%	0.199	12%	0.119	C	C	.	.	H	α-helix	trans	-61.1	-30.6	176.6	-71.4	110.6	0	0	0	112.7	M621 L625 V648 A656	M621-H652 HydrophobicContact SD-CB 4.09Å; L625-H652 HydrophobicContact CD2-CB 3.72Å; L625-H652 HydrophobicContact CG-CB 4.15Å; V648-H652 PolarHBondContact O-N 3.4Å; V648-H652 PolarHBondContact O-ND1 3.16Å; H652-A656 WeakPolarHBondContact O-CB 3.38Å; H652-A656 PolarHBondContact O-N 2.79Å
653	T	92.9	Very high	90.7	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.025	14%	0.137	C	C	.	.	H	α-helix	trans	-65.8	-41.2	174.6	-65.1	0	0	0	0	111.3	F649 Y650 N651 K657 T785 A786	F649-T653 WeakPolarHBondContact O-CB 3.25Å; F649-T653 PolarHBondContact O-N 2.86Å; F649-T653 VanDerWaalsContact O-N 3.07Å; F649-T653 PolarHBondContact O-OG1 3.43Å; Y650-T653 WeakPolarHBondContact O-CB 3.4Å; Y650-T653 PolarHBondContact O-N 2.94Å; N651-T653 PolarHBondContact O-N 3.14Å; T653-K657 HydrophobicContact CG2-CD 3.87Å; T653-K657 WeakPolarHBondContact O-CB 3.28Å; T653-K657 WeakPolarHBondContact O-CD 3.44Å; T653-K657 VanDerWaalsContact O-CG 3.25Å; T653-K657 WeakPolarHBondContact O-CG 3.4Å; T653-K657 PolarHBondContact O-N 2.81Å; T653-T785 HydrophobicContact CG2-CG2 4.36Å; T653-T785 WeakPolarHBondContact CG2-OG1 3.21Å; T653-A786 HydrophobicContact CG2-CB 4.11Å; T653-A786 WeakPolarHBondContact OG1-CB 3.35Å; T653-A786 PolarHBondContact OG1-N 3.33Å
654	A	92.9	Very high	91.4	Very high	4 Å²	4	28.5 Å²	28.5	3%	0.033	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-48.8	175	0	0	0	0	0	111.8	Y650 N651 K657 L658 H682 V685 E751	Y650-A654 PolarHBondContact O-N 2.94Å; Y650-A654 VanDerWaalsContact O-N 3.09Å; N651-A654 VanDerWaalsContact O-CB 3.31Å; N651-A654 WeakPolarHBondContact O-CB 3.33Å; N651-A654 PolarHBondContact O-N 3.34Å; N651-A654 VanDerWaalsContact O-N 3.08Å; A654-K657 PolarHBondContact O-N 3.32Å; A654-L658 PolarHBondContact O-N 3.02Å; A654-H682 HydrophobicContact CB-CB 4.4Å; A654-H682 VanDerWaalsContact CB-ND1 3.29Å; A654-H682 WeakPolarHBondContact CB-ND1 3.48Å; A654-V685 HydrophobicContact CB-CG2 3.95Å; A654-E751 WeakPolarHBondContact CB-OE1 3.46Å
655	E	92.4	Very high	92	Very high	82 Å²	82	24.5 Å²	24.5	38%	0.383	12%	0.121	S	C	.	.	H	α-helix	trans	-63.1	-44.8	-180	-72.1	-176.3	-144.5	0	0	113	M621 N651 K657 L658 L684	M621-E655 HydrophobicContact CE-CB 3.75Å; M621-E655 HydrophobicContact CE-CG 4.48Å; M621-E655 WeakPolarHBondContact CE-OE2 3.48Å; M621-E655 HydrophobicContact SD-CB 4.4Å; N651-E655 PolarHBondContact O-N 3.38Å; N651-E655 VanDerWaalsContact O-N 3.14Å; E655-K657 PolarHBondContact O-N 2.97Å; E655-L658 HydrophobicContact CB-CD1 4.41Å; E655-L658 WeakPolarHBondContact O-CB 3.15Å; E655-L658 WeakPolarHBondContact O-CD1 3.36Å; E655-L658 VanDerWaalsContact O-CG 3.29Å; E655-L658 WeakPolarHBondContact O-CG 3.25Å; E655-L658 PolarHBondContact O-N 3.06Å; E655-L684 HydrophobicContact CG-CD1 4.36Å
656	A	93.8	Very high	92.4	Very high	2 Å²	2	25.1 Å²	25.1	2%	0.017	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-28.9	177	0	0	0	0	0	112.9	I614 V617 M621 L625 H652	I614-A656 WeakPolarHBondContact CG2-O 3.41Å; V617-A656 HydrophobicContact CG1-CB 4.26Å; V617-A656 HydrophobicContact CG2-CB 4.26Å; V617-A656 WeakPolarHBondContact CG2-O 3.19Å; M621-A656 HydrophobicContact CG-CB 4.05Å; L625-A656 HydrophobicContact CD1-CB 3.59Å; H652-A656 WeakPolarHBondContact O-CB 3.38Å; H652-A656 PolarHBondContact O-N 2.79Å
657	K	94.4	Very high	92.8	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-80.1	-16.5	179	-72	170.4	70.5	174.7	0	113.8	I614 T653 A654 E655 Q659 A660 I661 A750 L780 A782 D787	I614-K657 HydrophobicContact CG2-CG 4.44Å; T653-K657 HydrophobicContact CG2-CD 3.87Å; T653-K657 WeakPolarHBondContact O-CB 3.28Å; T653-K657 WeakPolarHBondContact O-CD 3.44Å; T653-K657 VanDerWaalsContact O-CG 3.25Å; T653-K657 WeakPolarHBondContact O-CG 3.4Å; T653-K657 PolarHBondContact O-N 2.81Å; A654-K657 PolarHBondContact O-N 3.32Å; E655-K657 PolarHBondContact O-N 2.97Å; K657-Q659 VanDerWaalsContact C-N 3.29Å; K657-Q659 PolarHBondContact O-N 2.87Å; K657-Q659 VanDerWaalsContact O-N 3.1Å; K657-A660 PolarHBondContact O-N 2.95Å; K657-A660 VanDerWaalsContact O-N 3.1Å; K657-I661 HydrophobicContact CB-CD1 3.65Å; K657-I661 HydrophobicContact CB-CG1 4.04Å; K657-I661 WeakPolarHBondContact O-CA 3.32Å; K657-I661 VanDerWaalsContact O-CG1 3.31Å; K657-I661 WeakPolarHBondContact O-CG1 3.47Å; K657-I661 PolarHBondContact O-N 2.73Å; K657-A750 WeakPolarHBondContact CE-O 3.29Å; K657-A750 PolarHBondContact NZ-O 3.26Å; K657-L780 PolarHBondContact NZ-O 3.48Å; K657-A782 HydrophobicContact CD-CB 3.97Å; K657-A782 HydrophobicContact CG-CB 3.73Å; K657-D787 WeakPolarHBondContact CD-OD2 3.44Å; K657-D787 VanDerWaalsContact CE-OD2 3.29Å; K657-D787 WeakPolarHBondContact CE-OD2 3.42Å; K657-D787 IonicContact NZ-OD1 2.72Å; K657-D787 PolarHBondContact NZ-OD1 3.19Å; K657-D787 IonicContact NZ-OD2 3.71Å; K657-D787 PolarHBondContact NZ-OD2 3.32Å
658	L	94.1	Very high	93.1	Very high	28 Å²	28	28.8 Å²	28.8	15%	0.147	14%	0.144	C	C	.	.	H	α-helix	trans	-50.1	-40.1	-172.4	-71.9	169.7	0	0	0	115.3	A654 E655 I661 M662 L684 V685 H688	A654-L658 PolarHBondContact O-N 3.02Å; E655-L658 HydrophobicContact CB-CD1 4.41Å; E655-L658 WeakPolarHBondContact O-CB 3.15Å; E655-L658 WeakPolarHBondContact O-CD1 3.36Å; E655-L658 VanDerWaalsContact O-CG 3.29Å; E655-L658 WeakPolarHBondContact O-CG 3.25Å; E655-L658 PolarHBondContact O-N 3.06Å; L658-I661 WeakPolarHBondContact O-CA 3.29Å; L658-M662 WeakPolarHBondContact O-CE 3.16Å; L658-M662 WeakPolarHBondContact O-CG 3.5Å; L658-M662 PolarHBondContact O-N 3.27Å; L658-M662 VanDerWaalsContact O-N 3.07Å; L658-L684 HydrophobicContact CD1-CD2 3.51Å; L658-L684 HydrophobicContact CD2-CD2 3.76Å; L658-L684 HydrophobicContact CG-CD2 4.19Å; L658-V685 HydrophobicContact CD2-CB 4.38Å; L658-V685 HydrophobicContact CD2-CG2 3.87Å; L658-H688 HydrophobicContact CD2-CB 3.97Å
659	Q	92.9	Very high	93.2	Very high	89 Å²	89	28.9 Å²	28.9	42%	0.416	14%	0.143	S	C	.	.	H	α-helix	trans	-67.8	-52.5	179.3	179.2	177.2	-10.3	0	0	111	K657 I661 M662 E663	K657-Q659 VanDerWaalsContact C-N 3.29Å; K657-Q659 PolarHBondContact O-N 2.87Å; K657-Q659 VanDerWaalsContact O-N 3.1Å; Q659-I661 CarbonylContact O-C 3.51Å; Q659-M662 PolarHBondContact O-N 3.21Å; Q659-E663 HydrophobicContact CG-CG 4.39Å; Q659-E663 VanDerWaalsContact CG-OE1 3.29Å; Q659-E663 WeakPolarHBondContact CG-OE1 3.48Å; Q659-E663 PolarHBondContact NE2-OE1 3.33Å; Q659-E663 WeakPolarHBondContact O-CG 3.19Å; Q659-E663 PolarHBondContact O-N 3.36Å
660	A	94	Very high	93.3	Very high	7 Å²	7	34.2 Å²	34.2	6%	0.058	17%	0.168	C	C	.	.	H	α-helix	trans	-73.1	-38.4	-174.6	0	0	0	0	0	112.3	V612 K657 Y664	V612-A660 HydrophobicContact CB-CB 3.81Å; V612-A660 HydrophobicContact CG2-CB 4.14Å; K657-A660 PolarHBondContact O-N 2.95Å; K657-A660 VanDerWaalsContact O-N 3.1Å; A660-Y664 WeakPolarHBondContact O-CB 3.39Å; A660-Y664 PolarHBondContact O-N 2.83Å
661	I	95.9	Very high	93.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	H	α-helix		6.5	-102.5	123.1	20.8	124.3	0	0	0	116.3	K657 L658 Q659 E663 Y664 I665 V685 A750 L780	K657-I661 HydrophobicContact CB-CD1 3.65Å; K657-I661 HydrophobicContact CB-CG1 4.04Å; K657-I661 WeakPolarHBondContact O-CA 3.32Å; K657-I661 VanDerWaalsContact O-CG1 3.31Å; K657-I661 WeakPolarHBondContact O-CG1 3.47Å; K657-I661 PolarHBondContact O-N 2.73Å; L658-I661 WeakPolarHBondContact O-CA 3.29Å; Q659-I661 CarbonylContact O-C 3.51Å; I661-E663 VanDerWaalsContact C-N 3.33Å; I661-E663 PolarHBondContact O-N 3.29Å; I661-Y664 PolarHBondContact O-N 3.44Å; I661-I665 HydrophobicContact CG2-CD1 3.78Å; I661-I665 HydrophobicContact CG2-CG1 4.08Å; I661-I665 PolarHBondContact O-N 3.45Å; I661-V685 HydrophobicContact CD1-CG1 4.13Å; I661-A750 HydrophobicContact CD1-CB 4.06Å; I661-A750 HydrophobicContact CG1-CB 4.27Å; I661-A750 HydrophobicContact CG2-CB 3.89Å; I661-L780 HydrophobicContact CB-CD1 4.41Å; I661-L780 HydrophobicContact CG1-CD1 4.17Å; I661-L780 HydrophobicContact CG2-CD1 3.7Å
662	M	94.8	Very high	92.9	Very high	24 Å²	24	39.7 Å²	39.7	12%	0.118	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-32.1	-173.3	-59.5	-42.3	100.4	0	0	113.7	L658 Q659 T666 I689 E692	L658-M662 WeakPolarHBondContact O-CE 3.16Å; L658-M662 WeakPolarHBondContact O-CG 3.5Å; L658-M662 PolarHBondContact O-N 3.27Å; L658-M662 VanDerWaalsContact O-N 3.07Å; Q659-M662 PolarHBondContact O-N 3.21Å; M662-T666 VanDerWaalsContact O-CB 3.29Å; M662-T666 WeakPolarHBondContact O-CB 3.3Å; M662-T666 PolarHBondContact O-N 3.39Å; M662-T666 PolarHBondContact O-OG1 2.8Å; M662-I689 HydrophobicContact CE-CG1 3.62Å; M662-I689 HydrophobicContact SD-CG1 4.17Å; M662-E692 HydrophobicContact CB-CG 4.18Å; M662-E692 HydrophobicContact CG-CB 4.22Å; M662-E692 HydrophobicContact CG-CG 4.15Å; M662-E692 HydrophobicContact SD-CB 3.89Å; M662-E692 HydrophobicContact SD-CG 4.36Å
663	E	93.8	Very high	92.7	Very high	90 Å²	90	40.6 Å²	40.6	42%	0.421	22%	0.219	S	C	.	.	H	α-helix	trans	-60	-48.5	174.2	-71.9	172.8	-178.9	0	0	110.5	Q659 I661 I665 T666 D667	Q659-E663 HydrophobicContact CG-CG 4.39Å; Q659-E663 VanDerWaalsContact CG-OE1 3.29Å; Q659-E663 WeakPolarHBondContact CG-OE1 3.48Å; Q659-E663 PolarHBondContact NE2-OE1 3.33Å; Q659-E663 WeakPolarHBondContact O-CG 3.19Å; Q659-E663 PolarHBondContact O-N 3.36Å; I661-E663 VanDerWaalsContact C-N 3.33Å; I661-E663 PolarHBondContact O-N 3.29Å; E663-I665 PolarHBondContact O-N 2.9Å; E663-T666 WeakPolarHBondContact O-CB 3.46Å; E663-T666 PolarHBondContact O-N 2.99Å; E663-D667 PolarHBondContact O-N 3.22Å
664	Y	95.3	Very high	92.4	Very high	32 Å²	32	46.3 Å²	46.3	13%	0.125	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-41.3	-179.7	-167.6	-98.9	0	0	0	113	V610 A660 I661 T666 D667 M668 I748 H778 L780	V610-Y664 HydrophobicContact CG1-CD2 4.26Å; V610-Y664 HydrophobicContact CG1-CE2 3.79Å; A660-Y664 WeakPolarHBondContact O-CB 3.39Å; A660-Y664 PolarHBondContact O-N 2.83Å; I661-Y664 PolarHBondContact O-N 3.44Å; Y664-T666 VanDerWaalsContact C-N 3.29Å; Y664-T666 PolarHBondContact O-N 2.97Å; Y664-D667 PolarHBondContact O-N 3.48Å; Y664-M668 HydrophobicContact CD1-CG 4.24Å; Y664-M668 HydrophobicContact CE1-CE 4.43Å; Y664-M668 HydrophobicContact CE1-CG 3.83Å; Y664-M668 HydrophobicContact CE1-SD 4.15Å; Y664-M668 HydrophobicContact CE2-CE 3.98Å; Y664-M668 WeakPolarHBondContact O-CG 3.44Å; Y664-M668 PolarHBondContact O-N 2.83Å; Y664-I748 HydrophobicContact CD1-CD1 4.18Å; Y664-I748 HydrophobicContact CD1-CG2 4.26Å; Y664-I748 HydrophobicContact CE1-CD1 4.02Å; Y664-I748 HydrophobicContact CE1-CG1 4.41Å; Y664-I748 HydrophobicContact CE1-CG2 4.32Å; Y664-H778 AromaticContact CZ-ND1 3.85Å; Y664-H778 PolarHBondContact OH-CE1 3.38Å; Y664-H778 PolarHBondContact OH-ND1 3.48Å; Y664-L780 HydrophobicContact CD1-CD1 3.9Å; Y664-L780 HydrophobicContact CD1-CD2 3.7Å; Y664-L780 HydrophobicContact CD1-CG 4.43Å; Y664-L780 HydrophobicContact CE1-CD2 3.78Å; Y664-L780 HydrophobicContact CG-CD1 4.22Å; Y664-L780 HydrophobicContact CG-CD2 4.12Å
665	I	95.1	Very high	92.4	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.026	25%	0.25	C	S	.	.	H	α-helix	trans	-63.5	-38.7	174.5	-66.1	173.6	0	0	0	110.5	I661 E663 L669 F676 V678 I689 L693	I661-I665 HydrophobicContact CG2-CD1 3.78Å; I661-I665 HydrophobicContact CG2-CG1 4.08Å; I661-I665 PolarHBondContact O-N 3.45Å; E663-I665 PolarHBondContact O-N 2.9Å; I665-L669 HydrophobicContact CG2-CD1 4.21Å; I665-L669 WeakPolarHBondContact O-CD1 3.48Å; I665-L669 WeakPolarHBondContact O-CG 3.29Å; I665-L669 PolarHBondContact O-N 2.92Å; I665-F676 HydrophobicContact CG2-CE2 4.24Å; I665-F676 HydrophobicContact CG2-CZ 4.12Å; I665-V678 HydrophobicContact CD1-CG1 3.96Å; I665-V678 HydrophobicContact CD1-CG2 4.14Å; I665-V678 HydrophobicContact CG1-CG2 4.36Å; I665-I689 HydrophobicContact CD1-CD1 4.26Å; I665-I689 HydrophobicContact CD1-CG1 3.86Å; I665-I689 HydrophobicContact CD1-CG2 3.99Å; I665-L693 HydrophobicContact CG2-CD2 4.39Å
666	T	93.5	Very high	92.5	Very high	19 Å²	19	43.7 Å²	43.7	12%	0.117	23%	0.232	C	C	.	.	H	α-helix	trans	-64.1	-48	174.6	-61.8	0	0	0	0	111.3	M662 E663 Y664 M668 L669 E670 K696	M662-T666 VanDerWaalsContact O-CB 3.29Å; M662-T666 WeakPolarHBondContact O-CB 3.3Å; M662-T666 PolarHBondContact O-N 3.39Å; M662-T666 PolarHBondContact O-OG1 2.8Å; E663-T666 WeakPolarHBondContact O-CB 3.46Å; E663-T666 PolarHBondContact O-N 2.99Å; Y664-T666 VanDerWaalsContact C-N 3.29Å; Y664-T666 PolarHBondContact O-N 2.97Å; T666-M668 VanDerWaalsContact C-N 3.29Å; T666-M668 PolarHBondContact O-N 2.86Å; T666-L669 CarbonylContact O-C 3.56Å; T666-L669 WeakPolarHBondContact O-CB 3.3Å; T666-L669 PolarHBondContact O-N 2.85Å; T666-L669 VanDerWaalsContact O-N 3.08Å; T666-E670 HydrophobicContact CG2-CG 4.21Å; T666-E670 WeakPolarHBondContact CG2-OE1 3.36Å; T666-E670 PolarHBondContact O-N 3.03Å; T666-K696 WeakPolarHBondContact OG1-CE 3.47Å; T666-K696 PolarHBondContact OG1-NZ 3.35Å
667	D	93.2	Very high	92.6	Very high	63 Å²	63	43.6 Å²	43.6	34%	0.337	23%	0.231	S	C	.	.	H	α-helix	trans	-59.8	-38.1	179.5	-79.4	-8.5	0	0	0	111.8	E663 Y664 E670 C671	E663-D667 PolarHBondContact O-N 3.22Å; Y664-D667 PolarHBondContact O-N 3.48Å; D667-E670 PolarHBondContact O-N 3.13Å; D667-C671 VanDerWaalsContact O-CB 3.3Å; D667-C671 WeakPolarHBondContact O-CB 3.46Å; D667-C671 PolarHBondContact O-N 3.12Å; D667-C671 PolarHBondContact O-SG 3.26Å
668	M	93.5	Very high	92.7	Very high	26 Å²	26	43.5 Å²	43.5	13%	0.128	23%	0.231	C	C	.	.	H	α-helix	trans	-66.1	-36.9	174.7	-65.1	-57.2	94.5	0	0	112.8	Y664 T666 C671 G672 R673 F676 L746 I748	Y664-M668 HydrophobicContact CD1-CG 4.24Å; Y664-M668 HydrophobicContact CE1-CE 4.43Å; Y664-M668 HydrophobicContact CE1-CG 3.83Å; Y664-M668 HydrophobicContact CE1-SD 4.15Å; Y664-M668 HydrophobicContact CE2-CE 3.98Å; Y664-M668 WeakPolarHBondContact O-CG 3.44Å; Y664-M668 PolarHBondContact O-N 2.83Å; T666-M668 VanDerWaalsContact C-N 3.29Å; T666-M668 PolarHBondContact O-N 2.86Å; M668-C671 PolarHBondContact O-N 2.94Å; M668-G672 PolarHBondContact O-N 2.96Å; M668-R673 WeakPolarHBondContact O-CB 3.44Å; M668-R673 PolarHBondContact O-N 3.02Å; M668-R673 VanDerWaalsContact O-N 3.15Å; M668-F676 HydrophobicContact CB-CE1 4.41Å; M668-F676 HydrophobicContact CB-CZ 4.31Å; M668-L746 HydrophobicContact CB-CD2 4.41Å; M668-L746 HydrophobicContact CG-CD2 4.09Å; M668-L746 HydrophobicContact SD-CD2 4.05Å; M668-I748 HydrophobicContact CG-CD1 4Å
669	L	91.3	Very high	92.8	Very high	42 Å²	42	42.2 Å²	42.2	22%	0.22	22%	0.224	C	C	.	.	H	α-helix	trans	-69.4	-43.1	173.4	-69.8	161.1	0	0	0	111.6	I665 T666 C671 G672 F676 L693 V698 V727	I665-L669 HydrophobicContact CG2-CD1 4.21Å; I665-L669 WeakPolarHBondContact O-CD1 3.48Å; I665-L669 WeakPolarHBondContact O-CG 3.29Å; I665-L669 PolarHBondContact O-N 2.92Å; T666-L669 CarbonylContact O-C 3.56Å; T666-L669 WeakPolarHBondContact O-CB 3.3Å; T666-L669 PolarHBondContact O-N 2.85Å; T666-L669 VanDerWaalsContact O-N 3.08Å; L669-C671 PolarHBondContact O-N 3.42Å; L669-G672 PolarHBondContact O-N 2.97Å; L669-F676 HydrophobicContact CD2-CE1 3.75Å; L669-F676 HydrophobicContact CD2-CZ 4.11Å; L669-F676 HydrophobicContact CG-CE1 3.97Å; L669-F676 HydrophobicContact CG-CZ 3.95Å; L669-L693 HydrophobicContact CD1-CD2 4.02Å; L669-V698 HydrophobicContact CD1-CG2 4.19Å; L669-V698 HydrophobicContact CD2-CG1 4.04Å; L669-V698 HydrophobicContact CD2-CG2 4.46Å; L669-V727 HydrophobicContact CD2-CG2 4.23Å
670	E	91.1	Very high	92.9	Very high	116 Å²	116	38 Å²	38	54%	0.542	20%	0.204	S	C	.	.	H	α-helix	trans	-64.6	-26	174.9	-73.9	-174.9	-159.6	0	0	112.4	R27 T666 D667 G672	R27-E670 IonicContact NH2-OE2 3.92Å; R27-E670 PolarHBondContact NH2-OE2 3.42Å; T666-E670 HydrophobicContact CG2-CG 4.21Å; T666-E670 WeakPolarHBondContact CG2-OE1 3.36Å; T666-E670 PolarHBondContact O-N 3.03Å; D667-E670 PolarHBondContact O-N 3.13Å; E670-G672 VanDerWaalsContact C-N 3.26Å; E670-G672 PolarHBondContact O-N 3.36Å
671	C	88.9	Confident	92.8	Very high	100 Å²	100	38.5 Å²	38.5	68%	0.676	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	2.4	171.1	-69.2	0	0	0	0	113.9	D667 M668 L669	D667-C671 VanDerWaalsContact O-CB 3.3Å; D667-C671 WeakPolarHBondContact O-CB 3.46Å; D667-C671 PolarHBondContact O-N 3.12Å; D667-C671 PolarHBondContact O-SG 3.26Å; M668-C671 PolarHBondContact O-N 2.94Å; L669-C671 PolarHBondContact O-N 3.42Å
672	G	86.1	Confident	92.7	Very high	55 Å²	55	39.1 Å²	39.1	57%	0.567	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.4	19.4	173.5	0	0	0	0	0	115.7	M668 L669 E670 E674	M668-G672 PolarHBondContact O-N 2.96Å; L669-G672 PolarHBondContact O-N 2.97Å; E670-G672 VanDerWaalsContact C-N 3.26Å; E670-G672 PolarHBondContact O-N 3.36Å; G672-E674 PolarHBondContact O-N 3.21Å; G672-E674 VanDerWaalsContact O-N 3.16Å
673	R	86.8	Confident	92.6	Very high	63 Å²	63	43.8 Å²	43.8	24%	0.238	23%	0.228	C	C	.	.			trans	-72.3	106.3	171.9	-69	-72	-170.9	149.8	12.6	109.9	M668 F676 D745 L746 D776	M668-R673 WeakPolarHBondContact O-CB 3.44Å; M668-R673 PolarHBondContact O-N 3.02Å; M668-R673 VanDerWaalsContact O-N 3.15Å; R673-F676 HydrophobicContact CB-CD1 3.92Å; R673-F676 HydrophobicContact CB-CE1 4.28Å; R673-D745 IonicContact CZ-OD2 3.93Å; R673-D745 IonicContact NH1-OD1 2.95Å; R673-D745 PolarHBondContact NH1-OD1 2.85Å; R673-D745 VanDerWaalsContact NH1-OD1 3.15Å; R673-D745 IonicContact NH1-OD2 3.75Å; R673-D745 PolarHBondContact NH1-OD2 3.12Å; R673-L746 HydrophobicContact CG-CD2 4.08Å; R673-D776 IonicContact CZ-OD2 3.87Å; R673-D776 IonicContact NH1-OD2 2.75Å; R673-D776 PolarHBondContact NH1-OD2 3.4Å; R673-D776 IonicContact NH2-OD2 3.15Å; R673-D776 PolarHBondContact NH2-OD2 3.01Å
674	E	86	Confident	92.6	Very high	124 Å²	124	42.8 Å²	42.8	58%	0.579	23%	0.225	S	C	*	.			trans	-74.5	-37.7	-175.8	-61.9	-171.1	155.6	0	0	113.9	G672 S725 C726	G672-E674 PolarHBondContact O-N 3.21Å; G672-E674 VanDerWaalsContact O-N 3.16Å; E674-S725 CarbonylContact O-C 3.59Å; E674-S725 WeakPolarHBondContact O-CA 3.49Å; E674-S725 WeakPolarHBondContact O-CB 3.3Å; E674-C726 PolarHBondContact O-N 3.01Å
675	K	92.7	Very high	92.6	Very high	31 Å²	31	41.3 Å²	41.3	14%	0.135	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	116	-177.8	-69.5	-170.5	-177.2	-171.4	0	112.2	F719 Q720 S722 C726 S743	K675-F719 HydrophobicContact CB-CZ 4.16Å; K675-F719 PolarHBondContact NZ-O 2.84Å; K675-Q720 PolarHBondContact NZ-O 3.27Å; K675-S722 WeakPolarHBondContact CE-O 3.48Å; K675-S722 PolarHBondContact NZ-O 2.62Å; K675-C726 WeakPolarHBondContact CA-O 3.45Å; K675-S743 WeakPolarHBondContact CB-O 3.45Å; K675-S743 VanDerWaalsContact CD-O 3.27Å; K675-S743 WeakPolarHBondContact CD-O 3.36Å
676	F	95	Very high	92.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	157.6	176	60.6	-90.1	0	0	0	112.1	I665 M668 L669 R673 V678 V727 A728 L746 I748	I665-F676 HydrophobicContact CG2-CE2 4.24Å; I665-F676 HydrophobicContact CG2-CZ 4.12Å; M668-F676 HydrophobicContact CB-CE1 4.41Å; M668-F676 HydrophobicContact CB-CZ 4.31Å; L669-F676 HydrophobicContact CD2-CE1 3.75Å; L669-F676 HydrophobicContact CD2-CZ 4.11Å; L669-F676 HydrophobicContact CG-CE1 3.97Å; L669-F676 HydrophobicContact CG-CZ 3.95Å; R673-F676 HydrophobicContact CB-CD1 3.92Å; R673-F676 HydrophobicContact CB-CE1 4.28Å; F676-V678 HydrophobicContact CD2-CG2 3.77Å; F676-V678 HydrophobicContact CE2-CG2 3.59Å; F676-V727 HydrophobicContact CD1-CG2 4.4Å; F676-V727 HydrophobicContact CD2-CG1 4.17Å; F676-V727 HydrophobicContact CE1-CG2 3.83Å; F676-V727 HydrophobicContact CE2-CG1 3.86Å; F676-V727 HydrophobicContact CE2-CG2 4.02Å; F676-V727 HydrophobicContact CZ-CG1 4.32Å; F676-V727 HydrophobicContact CZ-CG2 3.62Å; F676-A728 PolarHBondContact O-N 2.95Å; F676-L746 WeakPolarHBondContact CA-O 3.3Å; F676-L746 HydrophobicContact CB-CB 3.77Å; F676-L746 HydrophobicContact CB-CD2 4.03Å; F676-L746 HydrophobicContact CB-CG 3.91Å; F676-L746 WeakPolarHBondContact CB-O 3.49Å; F676-L746 HydrophobicContact CG-CD2 4.24Å; F676-I748 HydrophobicContact CD2-CD1 3.73Å; F676-I748 HydrophobicContact CD2-CG1 4.35Å; F676-I748 HydrophobicContact CE2-CD1 3.73Å
677	L	95.8	Very high	92.8	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	142.4	173.8	-44.1	-166.1	0	0	0	110	F679 F719 A728 L730 L741 A744 L746 V747 I748 V766	L677-F679 HydrophobicContact CB-CD2 4.49Å; L677-F679 HydrophobicContact CB-CE2 4.17Å; L677-F679 HydrophobicContact CD1-CE2 3.82Å; L677-F679 HydrophobicContact CD1-CZ 4Å; L677-F719 HydrophobicContact CD2-CE1 3.87Å; L677-F719 HydrophobicContact CD2-CE2 4.33Å; L677-F719 HydrophobicContact CD2-CZ 3.61Å; L677-A728 HydrophobicContact CD2-CB 3.58Å; L677-L730 HydrophobicContact CB-CD1 4.21Å; L677-L730 HydrophobicContact CD1-CD1 3.85Å; L677-L730 HydrophobicContact CD2-CD1 4.46Å; L677-L730 HydrophobicContact CG-CD1 4.41Å; L677-L741 HydrophobicContact CD1-CB 4.16Å; L677-L741 HydrophobicContact CD1-CD1 3.92Å; L677-L741 HydrophobicContact CD2-CB 4.07Å; L677-L741 HydrophobicContact CD2-CD1 4.05Å; L677-A744 HydrophobicContact CD2-CB 3.91Å; L677-A744 HydrophobicContact CG-CB 4.18Å; L677-L746 PolarHBondContact N-O 3.29Å; L677-V747 HydrophobicContact CB-CG2 4.47Å; L677-V747 HydrophobicContact CD1-CG2 4.4Å; L677-V747 HydrophobicContact CG-CG2 4.38Å; L677-I748 PolarHBondContact O-N 2.86Å; L677-V766 HydrophobicContact CD1-CG2 3.23Å; L677-V766 HydrophobicContact CD2-CG2 4.41Å; L677-V766 HydrophobicContact CG-CG2 3.65Å
678	V	96.9	Very high	92.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	112.1	167.7	-174.2	0	0	0	0	108.5	I665 F676 I689 V727 A728 L730 I748 A750	I665-V678 HydrophobicContact CD1-CG1 3.96Å; I665-V678 HydrophobicContact CD1-CG2 4.14Å; I665-V678 HydrophobicContact CG1-CG2 4.36Å; F676-V678 HydrophobicContact CD2-CG2 3.77Å; F676-V678 HydrophobicContact CE2-CG2 3.59Å; V678-I689 HydrophobicContact CG1-CD1 3.72Å; V678-V727 HydrophobicContact CG2-CG1 3.72Å; V678-A728 PolarHBondContact N-O 3.47Å; V678-L730 PolarHBondContact O-N 2.78Å; V678-I748 CarbonylContact C-O 3.58Å; V678-I748 WeakPolarHBondContact CA-O 3.49Å; V678-I748 HydrophobicContact CG2-CB 4.41Å; V678-I748 HydrophobicContact CG2-CD1 4.39Å; V678-A750 HydrophobicContact CG1-CB 4.16Å
679	F	96.6	Very high	93.1	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.1	173.8	-74.2	-76.4	0	0	0	110.6	L677 L730 V732 A735 V747 I748 F749 A750 A762 R765	L677-F679 HydrophobicContact CB-CD2 4.49Å; L677-F679 HydrophobicContact CB-CE2 4.17Å; L677-F679 HydrophobicContact CD1-CE2 3.82Å; L677-F679 HydrophobicContact CD1-CZ 4Å; F679-L730 VanDerWaalsContact CA-O 3.31Å; F679-L730 WeakPolarHBondContact CA-O 3.43Å; F679-L730 HydrophobicContact CD1-CB 3.54Å; F679-L730 HydrophobicContact CD1-CD1 4.23Å; F679-L730 HydrophobicContact CE1-CB 3.59Å; F679-L730 HydrophobicContact CE1-CD1 3.57Å; F679-L730 HydrophobicContact CE1-CG 4.24Å; F679-L730 HydrophobicContact CE2-CD1 4.28Å; F679-L730 HydrophobicContact CG-CB 4.35Å; F679-L730 HydrophobicContact CZ-CB 4.42Å; F679-L730 HydrophobicContact CZ-CD1 3.59Å; F679-V732 HydrophobicContact CB-CG2 3.84Å; F679-A735 HydrophobicContact CE1-CB 4.13Å; F679-V747 HydrophobicContact CD2-CG1 3.55Å; F679-V747 HydrophobicContact CE2-CG1 3.66Å; F679-I748 PolarHBondContact N-O 3.5Å; F679-F749 HydrophobicContact CB-CD1 3.64Å; F679-F749 HydrophobicContact CB-CE1 3.86Å; F679-F749 HydrophobicContact CB-CG 4.44Å; F679-F749 HydrophobicContact CD2-CD1 4.31Å; F679-F749 AromaticContact CD2-CE1 3.87Å; F679-F749 HydrophobicContact CD2-CE1 3.87Å; F679-F749 HydrophobicContact CD2-CZ 4.11Å; F679-F749 HydrophobicContact CG-CD1 4.24Å; F679-F749 AromaticContact CG-CE1 3.96Å; F679-F749 HydrophobicContact CG-CE1 3.96Å; F679-A750 WeakPolarHBondContact O-CB 3.44Å; F679-A750 PolarHBondContact O-N 3.07Å; F679-A762 HydrophobicContact CD1-CB 4.24Å; F679-A762 HydrophobicContact CD2-CB 4.31Å; F679-A762 HydrophobicContact CE1-CB 3.85Å; F679-A762 HydrophobicContact CE2-CB 3.94Å; F679-A762 HydrophobicContact CG-CB 4.46Å; F679-A762 HydrophobicContact CZ-CB 3.69Å; F679-R765 HydrophobicContact CZ-CG 4.35Å
680	A	95.5	Very high	93.3	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	162.6	171.1	0	0	0	0	0	110.3	V685 L686 I689 L730 S731 V732 A750 E751	A680-V685 HydrophobicContact CB-CB 4.15Å; A680-V685 HydrophobicContact CB-CG1 3.68Å; A680-L686 HydrophobicContact CB-CD2 3.81Å; A680-L686 HydrophobicContact CB-CG 4.11Å; A680-I689 HydrophobicContact CB-CD1 4.31Å; A680-L730 PolarHBondContact N-O 2.98Å; A680-S731 CarbonylContact O-C 3.18Å; A680-S731 VanDerWaalsContact O-CA 3.29Å; A680-S731 WeakPolarHBondContact O-CA 3.36Å; A680-V732 WeakPolarHBondContact O-CG2 3.47Å; A680-V732 PolarHBondContact O-N 3.43Å; A680-A750 HydrophobicContact CB-CB 4.27Å; A680-E751 HydrophobicContact CB-CG 4.37Å
681	H	92	Very high	93.5	Very high	19 Å²	19	39.8 Å²	39.8	9%	0.088	22%	0.215	C	C	.	.	S	Bend	trans	-100.5	-53.4	178.9	-173.2	79.2	0	0	0	111.4	Y650 E751 F753	Y650-H681 AromaticContact CE1-CD2 3.79Å; H681-E751 WeakPolarHBondContact CA-OE2 3.4Å; H681-E751 HydrophobicContact CB-CB 4.49Å; H681-E751 PolarHBondContact N-OE2 3.18Å; H681-F753 AromaticContact CE1-CD2 4Å; H681-F753 AromaticContact CE1-CE2 3.57Å; H681-F753 AromaticContact ND1-CD2 3.65Å; H681-F753 AromaticContact ND1-CE2 3.68Å
682	H	92.6	Very high	93.8	Very high	13 Å²	13	37.1 Å²	37.1	6%	0.06	19%	0.193	C	C	.	.	S	Bend	trans	-77.8	138.7	-172.7	-62.7	98.7	0	0	0	111.7	Y650 N651 A654 L684 V685 L686 E751	Y650-H682 AromaticContact CD1-CE1 3.37Å; Y650-H682 WeakPolarHBondContact CD1-CE1 3.4Å; Y650-H682 AromaticContact CD1-NE2 3.42Å; Y650-H682 WeakPolarHBondContact CD1-NE2 3.14Å; Y650-H682 AromaticContact CE1-CE1 3.17Å; Y650-H682 WeakPolarHBondContact CE1-CE1 3.37Å; Y650-H682 AromaticContact CE1-NE2 3.42Å; Y650-H682 WeakPolarHBondContact CE1-NE2 3.48Å; Y650-H682 AromaticContact CZ-CE1 3.68Å; N651-H682 PolarHBondContact OD1-NE2 2.73Å; A654-H682 HydrophobicContact CB-CB 4.4Å; A654-H682 VanDerWaalsContact CB-ND1 3.29Å; A654-H682 WeakPolarHBondContact CB-ND1 3.48Å; H682-L684 PolarHBondContact O-N 3.13Å; H682-V685 HydrophobicContact CB-CG2 4.2Å; H682-V685 PolarHBondContact O-N 2.92Å; H682-V685 VanDerWaalsContact O-N 3.13Å; H682-L686 PolarHBondContact O-N 2.89Å; H682-L686 VanDerWaalsContact O-N 3.16Å; H682-E751 IonicContact CE1-OE1 2.87Å; H682-E751 IonicContact CG-OE1 2.82Å; H682-E751 PolarHBondContact N-OE2 3.17Å; H682-E751 IonicContact ND1-OE1 3.61Å; H682-E751 PolarHBondContact ND1-OE1 3.46Å; H682-E751 IonicContact ND1-OE2 2.76Å
683	K	92	Very high	94.2	Very high	122 Å²	122	34.7 Å²	34.7	53%	0.53	17%	0.167	S	C	.	.	H	α-helix	trans	-57.8	-40.1	178	-175.3	-174.7	168.9	-170.8	0	111.8	V685 L686 D687	K683-V685 VanDerWaalsContact C-N 3.32Å; K683-V685 PolarHBondContact O-N 3.47Å; K683-L686 WeakPolarHBondContact O-CB 3.42Å; K683-L686 PolarHBondContact O-N 3.05Å; K683-D687 WeakPolarHBondContact CE-OD2 3.2Å; K683-D687 WeakPolarHBondContact O-CB 3.41Å; K683-D687 PolarHBondContact O-N 3.37Å
684	L	94.4	Very high	94.6	Very high	69 Å²	69	36.8 Å²	36.8	36%	0.361	18%	0.182	S	C	.	.	H	α-helix	trans	-56.5	-44.1	177.3	-168.8	158	0	0	0	111.8	E655 L658 H682 D687 H688	E655-L684 HydrophobicContact CG-CD1 4.36Å; L658-L684 HydrophobicContact CD1-CD2 3.51Å; L658-L684 HydrophobicContact CD2-CD2 3.76Å; L658-L684 HydrophobicContact CG-CD2 4.19Å; H682-L684 PolarHBondContact O-N 3.13Å; L684-D687 PolarHBondContact O-N 2.95Å; L684-H688 WeakPolarHBondContact O-CB 3.42Å; L684-H688 PolarHBondContact O-CD2 2.93Å; L684-H688 VanDerWaalsContact O-CD2 3.29Å; L684-H688 PolarHBondContact O-N 3.17Å
685	V	95.7	Very high	95	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.8	-44.3	177.4	179.5	0	0	0	0	110.7	A654 L658 I661 A680 H682 K683 D687 H688 I689 E751	A654-V685 HydrophobicContact CB-CG2 3.95Å; L658-V685 HydrophobicContact CD2-CB 4.38Å; L658-V685 HydrophobicContact CD2-CG2 3.87Å; I661-V685 HydrophobicContact CD1-CG1 4.13Å; A680-V685 HydrophobicContact CB-CB 4.15Å; A680-V685 HydrophobicContact CB-CG1 3.68Å; H682-V685 HydrophobicContact CB-CG2 4.2Å; H682-V685 PolarHBondContact O-N 2.92Å; H682-V685 VanDerWaalsContact O-N 3.13Å; K683-V685 VanDerWaalsContact C-N 3.32Å; K683-V685 PolarHBondContact O-N 3.47Å; V685-D687 VanDerWaalsContact C-N 3.34Å; V685-D687 PolarHBondContact O-N 3.33Å; V685-H688 PolarHBondContact O-N 3.26Å; V685-I689 HydrophobicContact CG1-CD1 3.86Å; V685-I689 HydrophobicContact CG1-CG1 4.44Å; V685-I689 WeakPolarHBondContact O-CD1 3.4Å; V685-I689 WeakPolarHBondContact O-CG1 3.43Å; V685-I689 PolarHBondContact O-N 3.47Å; V685-E751 HydrophobicContact CG1-CG 4.48Å
686	L	96.1	Very high	94.9	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-60	-41.8	175.1	-63.7	166.2	0	0	0	112	A680 H682 K683 T690 R702 D704 V729	A680-L686 HydrophobicContact CB-CD2 3.81Å; A680-L686 HydrophobicContact CB-CG 4.11Å; H682-L686 PolarHBondContact O-N 2.89Å; H682-L686 VanDerWaalsContact O-N 3.16Å; K683-L686 WeakPolarHBondContact O-CB 3.42Å; K683-L686 PolarHBondContact O-N 3.05Å; L686-T690 WeakPolarHBondContact O-CB 3.33Å; L686-T690 PolarHBondContact O-N 2.78Å; L686-T690 PolarHBondContact O-OG1 3.3Å; L686-R702 PolarHBondContact O-NH1 2.95Å; L686-D704 HydrophobicContact CD1-CB 4.24Å; L686-V729 HydrophobicContact CB-CG1 4.38Å; L686-V729 HydrophobicContact CD2-CG1 3.65Å
687	D	95.9	Very high	94.7	Very high	55 Å²	55	47.8 Å²	47.8	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-66.3	-42	178	-68.4	-9.8	0	0	0	111.5	K683 L684 V685 T690 T691 R702	K683-D687 WeakPolarHBondContact CE-OD2 3.2Å; K683-D687 WeakPolarHBondContact O-CB 3.41Å; K683-D687 PolarHBondContact O-N 3.37Å; L684-D687 PolarHBondContact O-N 2.95Å; V685-D687 VanDerWaalsContact C-N 3.34Å; V685-D687 PolarHBondContact O-N 3.33Å; D687-T690 WeakPolarHBondContact O-CB 3.24Å; D687-T690 PolarHBondContact O-N 3.18Å; D687-T691 WeakPolarHBondContact O-CB 3.27Å; D687-T691 PolarHBondContact O-N 2.84Å; D687-T691 PolarHBondContact O-OG1 3.22Å; D687-R702 IonicContact OD1-CZ 2.68Å; D687-R702 IonicContact OD1-NH1 2.71Å; D687-R702 PolarHBondContact OD1-NH1 3.49Å; D687-R702 IonicContact OD1-NH2 2.79Å; D687-R702 PolarHBondContact OD1-NH2 3.03Å
688	H	95.9	Very high	94.5	Very high	90 Å²	90	49.2 Å²	49.2	42%	0.417	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-45.8	175.1	-89.6	-104.5	0	0	0	112.8	L658 L684 V685 T690 T691 E692	L658-H688 HydrophobicContact CD2-CB 3.97Å; L684-H688 WeakPolarHBondContact O-CB 3.42Å; L684-H688 PolarHBondContact O-CD2 2.93Å; L684-H688 VanDerWaalsContact O-CD2 3.29Å; L684-H688 PolarHBondContact O-N 3.17Å; V685-H688 PolarHBondContact O-N 3.26Å; H688-T690 VanDerWaalsContact C-N 3.33Å; H688-T690 PolarHBondContact O-N 3.25Å; H688-T691 PolarHBondContact O-N 2.85Å; H688-E692 PolarHBondContact O-N 3.03Å
689	I	96.7	Very high	94.4	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-57.8	-48	174.8	-63.1	160.9	0	0	0	110.1	M662 I665 V678 A680 V685 T691 E692 L693 V729	M662-I689 HydrophobicContact CE-CG1 3.62Å; M662-I689 HydrophobicContact SD-CG1 4.17Å; I665-I689 HydrophobicContact CD1-CD1 4.26Å; I665-I689 HydrophobicContact CD1-CG1 3.86Å; I665-I689 HydrophobicContact CD1-CG2 3.99Å; V678-I689 HydrophobicContact CG1-CD1 3.72Å; A680-I689 HydrophobicContact CB-CD1 4.31Å; V685-I689 HydrophobicContact CG1-CD1 3.86Å; V685-I689 HydrophobicContact CG1-CG1 4.44Å; V685-I689 WeakPolarHBondContact O-CD1 3.4Å; V685-I689 WeakPolarHBondContact O-CG1 3.43Å; V685-I689 PolarHBondContact O-N 3.47Å; I689-T691 VanDerWaalsContact C-N 3.29Å; I689-T691 PolarHBondContact O-N 3.42Å; I689-E692 PolarHBondContact O-N 3.14Å; I689-L693 HydrophobicContact CG2-CD1 3.76Å; I689-L693 HydrophobicContact CG2-CG 4.36Å; I689-L693 VanDerWaalsContact O-CG 3.3Å; I689-L693 WeakPolarHBondContact O-CG 3.4Å; I689-L693 PolarHBondContact O-N 3.38Å; I689-V729 HydrophobicContact CB-CG1 4.26Å; I689-V729 HydrophobicContact CG2-CG1 4.11Å; I689-V729 HydrophobicContact CG2-CG2 3.67Å
690	T	96.3	Very high	94.3	Very high	19 Å²	19	53.5 Å²	53.5	12%	0.117	27%	0.269	C	S	.	.	H	α-helix	trans	-55.2	-46.1	177.5	-58.3	0	0	0	0	111.2	L686 D687 H688 L694 F700 R702	L686-T690 WeakPolarHBondContact O-CB 3.33Å; L686-T690 PolarHBondContact O-N 2.78Å; L686-T690 PolarHBondContact O-OG1 3.3Å; D687-T690 WeakPolarHBondContact O-CB 3.24Å; D687-T690 PolarHBondContact O-N 3.18Å; H688-T690 VanDerWaalsContact C-N 3.33Å; H688-T690 PolarHBondContact O-N 3.25Å; T690-L694 HydrophobicContact CG2-CD1 4.37Å; T690-L694 WeakPolarHBondContact O-CG 3.3Å; T690-L694 PolarHBondContact O-N 3.24Å; T690-F700 HydrophobicContact CG2-CE2 3.71Å; T690-F700 HydrophobicContact CG2-CZ 3.66Å; T690-R702 PolarHBondContact OG1-NH1 3.03Å; T690-R702 VanDerWaalsContact OG1-NH1 3.12Å
691	T	96.2	Very high	94.3	Very high	71 Å²	71	53.6 Å²	53.6	44%	0.436	27%	0.269	S	S	.	.	H	α-helix	trans	-68.2	-38.9	-177.4	-56.7	0	0	0	0	112.3	D687 H688 I689 L694 K695	D687-T691 WeakPolarHBondContact O-CB 3.27Å; D687-T691 PolarHBondContact O-N 2.84Å; D687-T691 PolarHBondContact O-OG1 3.22Å; H688-T691 PolarHBondContact O-N 2.85Å; I689-T691 VanDerWaalsContact C-N 3.29Å; I689-T691 PolarHBondContact O-N 3.42Å; T691-L694 PolarHBondContact O-N 2.86Å; T691-K695 WeakPolarHBondContact O-CG 3.36Å; T691-K695 PolarHBondContact O-N 3.39Å; T691-K695 VanDerWaalsContact O-N 3.16Å
692	E	94.3	Very high	94.5	Very high	44 Å²	44	55 Å²	55	21%	0.206	27%	0.274	C	S	.	.	H	α-helix	trans	-73	-37.3	180	-164.4	60.4	-149	0	0	112.6	M662 H688 I689 L694 K695 K696	M662-E692 HydrophobicContact CB-CG 4.18Å; M662-E692 HydrophobicContact CG-CB 4.22Å; M662-E692 HydrophobicContact CG-CG 4.15Å; M662-E692 HydrophobicContact SD-CB 3.89Å; M662-E692 HydrophobicContact SD-CG 4.36Å; H688-E692 PolarHBondContact O-N 3.03Å; I689-E692 PolarHBondContact O-N 3.14Å; E692-L694 VanDerWaalsContact C-N 3.31Å; E692-L694 PolarHBondContact O-N 3.46Å; E692-K695 PolarHBondContact O-N 3.27Å; E692-K695 WeakPolarHBondContact OE2-CD 3.45Å; E692-K695 WeakPolarHBondContact OE2-CE 3.21Å; E692-K695 IonicContact OE2-NZ 3.56Å; E692-K695 PolarHBondContact OE2-NZ 3.31Å; E692-K696 HydrophobicContact CG-CD 4.29Å; E692-K696 WeakPolarHBondContact O-CG 3.21Å; E692-K696 PolarHBondContact O-N 3.38Å; E692-K696 VanDerWaalsContact O-N 3.1Å; E692-K696 WeakPolarHBondContact OE1-CE 3.25Å; E692-K696 IonicContact OE1-NZ 3.5Å
693	L	94.6	Very high	94.4	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-62.8	-38.2	173.1	-67.9	169.2	0	0	0	111.7	I665 L669 I689 K696 N697 V698 F700 V727 V729	I665-L693 HydrophobicContact CG2-CD2 4.39Å; L669-L693 HydrophobicContact CD1-CD2 4.02Å; I689-L693 HydrophobicContact CG2-CD1 3.76Å; I689-L693 HydrophobicContact CG2-CG 4.36Å; I689-L693 VanDerWaalsContact O-CG 3.3Å; I689-L693 WeakPolarHBondContact O-CG 3.4Å; I689-L693 PolarHBondContact O-N 3.38Å; L693-K696 CarbonylContact O-C 3.58Å; L693-K696 PolarHBondContact O-N 3.05Å; L693-N697 PolarHBondContact O-N 3.01Å; L693-N697 VanDerWaalsContact O-N 3.12Å; L693-V698 HydrophobicContact CB-CB 4.47Å; L693-V698 HydrophobicContact CD2-CB 3.98Å; L693-V698 HydrophobicContact CD2-CG1 3.93Å; L693-V698 PolarHBondContact O-N 2.68Å; L693-F700 HydrophobicContact CB-CD1 4.19Å; L693-F700 HydrophobicContact CD1-CB 4.07Å; L693-F700 HydrophobicContact CD1-CG 4.42Å; L693-V727 HydrophobicContact CD1-CB 3.92Å; L693-V727 HydrophobicContact CD1-CG1 4.03Å; L693-V727 HydrophobicContact CD1-CG2 4.43Å; L693-V727 HydrophobicContact CD2-CB 4.28Å; L693-V727 HydrophobicContact CD2-CG2 3.87Å; L693-V729 HydrophobicContact CD1-CG2 3.74Å
694	L	94.8	Very high	94.4	Very high	108 Å²	108	49.5 Å²	49.5	57%	0.565	25%	0.25	S	S	*	.	H	α-helix	trans	-61.7	-47.4	172.9	-76.2	168	0	0	0	112.3	T690 T691 E692 K696 N697 F700	T690-L694 HydrophobicContact CG2-CD1 4.37Å; T690-L694 WeakPolarHBondContact O-CG 3.3Å; T690-L694 PolarHBondContact O-N 3.24Å; T691-L694 PolarHBondContact O-N 2.86Å; E692-L694 VanDerWaalsContact C-N 3.31Å; E692-L694 PolarHBondContact O-N 3.46Å; L694-K696 VanDerWaalsContact C-N 3.26Å; L694-K696 PolarHBondContact O-N 3.17Å; L694-N697 PolarHBondContact O-N 3.2Å; L694-F700 HydrophobicContact CD1-CZ 4.49Å; L694-F700 HydrophobicContact CD2-CE1 3.73Å; L694-F700 HydrophobicContact CD2-CZ 4.23Å; L694-F700 HydrophobicContact CG-CE1 3.78Å; L694-F700 HydrophobicContact CG-CZ 4.18Å
695	K	94.2	Very high	93.9	Very high	146 Å²	146	49.3 Å²	49.3	64%	0.635	27%	0.266	S	S	*	.	H	α-helix	trans	-57.9	-39.1	176.4	-66.7	176.4	-156	161.6	0	112.3	T691 E692 N697	T691-K695 WeakPolarHBondContact O-CG 3.36Å; T691-K695 PolarHBondContact O-N 3.39Å; T691-K695 VanDerWaalsContact O-N 3.16Å; E692-K695 PolarHBondContact O-N 3.27Å; E692-K695 WeakPolarHBondContact OE2-CD 3.45Å; E692-K695 WeakPolarHBondContact OE2-CE 3.21Å; E692-K695 IonicContact OE2-NZ 3.56Å; E692-K695 PolarHBondContact OE2-NZ 3.31Å; K695-N697 VanDerWaalsContact C-N 3.25Å; K695-N697 PolarHBondContact O-N 3.49Å
696	K	90.4	Very high	93.4	Very high	85 Å²	85	53.4 Å²	53.4	37%	0.37	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	2.3	179.7	-66.2	170.1	-171.7	-90	0	113.3	T666 E692 L693 L694 V698	T666-K696 WeakPolarHBondContact OG1-CE 3.47Å; T666-K696 PolarHBondContact OG1-NZ 3.35Å; E692-K696 HydrophobicContact CG-CD 4.29Å; E692-K696 WeakPolarHBondContact O-CG 3.21Å; E692-K696 PolarHBondContact O-N 3.38Å; E692-K696 VanDerWaalsContact O-N 3.1Å; E692-K696 WeakPolarHBondContact OE1-CE 3.25Å; E692-K696 IonicContact OE1-NZ 3.5Å; L693-K696 CarbonylContact O-C 3.58Å; L693-K696 PolarHBondContact O-N 3.05Å; L694-K696 VanDerWaalsContact C-N 3.26Å; L694-K696 PolarHBondContact O-N 3.17Å; K696-V698 HydrophobicContact CB-CG2 3.93Å; K696-V698 PolarHBondContact O-N 3.43Å
697	N	91.9	Very high	92.9	Very high	155 Å²	155	54 Å²	54	83%	0.829	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	32.7	-177.6	-162.9	21.7	0	0	0	113.7	L693 L694 K695	L693-N697 PolarHBondContact O-N 3.01Å; L693-N697 VanDerWaalsContact O-N 3.12Å; L694-N697 PolarHBondContact O-N 3.2Å; K695-N697 VanDerWaalsContact C-N 3.25Å; K695-N697 PolarHBondContact O-N 3.49Å
698	V	92.1	Very high	92.3	Very high	29 Å²	29	54.4 Å²	54.4	18%	0.176	31%	0.309	C	S	.	.			trans	-89.7	134.6	178.9	179.2	0	0	0	0	109.1	L669 L693 K696 V727	L669-V698 HydrophobicContact CD1-CG2 4.19Å; L669-V698 HydrophobicContact CD2-CG1 4.04Å; L669-V698 HydrophobicContact CD2-CG2 4.46Å; L693-V698 HydrophobicContact CB-CB 4.47Å; L693-V698 HydrophobicContact CD2-CB 3.98Å; L693-V698 HydrophobicContact CD2-CG1 3.93Å; L693-V698 PolarHBondContact O-N 2.68Å; K696-V698 HydrophobicContact CB-CG2 3.93Å; K696-V698 PolarHBondContact O-N 3.43Å; V698-V727 HydrophobicContact CG1-CG2 4.12Å
699	S	93.8	Very high	91.3	Very high	46 Å²	46	53.1 Å²	53.1	32%	0.322	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	147.5	177.3	-149.6	0	0	0	0	111	S725 C726 V727	S699-S725 WeakPolarHBondContact CB-O 3.24Å; S699-C726 VanDerWaalsContact O-CA 3.27Å; S699-C726 WeakPolarHBondContact O-CA 3.46Å; S699-V727 PolarHBondContact O-N 3.26Å
700	F	95.3	Very high	90.3	Very high	45 Å²	45	56.8 Å²	56.8	20%	0.197	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	166.8	175.6	65.8	-84.4	0	0	0	113.1	T690 L693 L694 K718 V727	T690-F700 HydrophobicContact CG2-CE2 3.71Å; T690-F700 HydrophobicContact CG2-CZ 3.66Å; L693-F700 HydrophobicContact CB-CD1 4.19Å; L693-F700 HydrophobicContact CD1-CB 4.07Å; L693-F700 HydrophobicContact CD1-CG 4.42Å; L694-F700 HydrophobicContact CD1-CZ 4.49Å; L694-F700 HydrophobicContact CD2-CE1 3.73Å; L694-F700 HydrophobicContact CD2-CZ 4.23Å; L694-F700 HydrophobicContact CG-CE1 3.78Å; L694-F700 HydrophobicContact CG-CZ 4.18Å; F700-K718 PolarHBondContact O-NZ 2.74Å; F700-V727 CarbonylContact C-O 3.32Å; F700-V727 WeakPolarHBondContact CA-O 3.46Å; F700-V727 WeakPolarHBondContact CB-O 3.49Å
701	I	95.5	Very high	89.8	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.01	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	156.4	156.8	65	158.5	0	0	0	108.8	I703 L715 K718 F719 V727 A728 V729	I701-I703 HydrophobicContact CD1-CD1 4.24Å; I701-L715 HydrophobicContact CB-CB 4.47Å; I701-L715 HydrophobicContact CB-CD2 4.28Å; I701-L715 HydrophobicContact CD1-CB 4.44Å; I701-L715 HydrophobicContact CG2-CD2 4.21Å; I701-K718 HydrophobicContact CG2-CD 3.95Å; I701-K718 HydrophobicContact CG2-CG 4.4Å; I701-F719 HydrophobicContact CD1-CB 3.76Å; I701-F719 HydrophobicContact CD1-CD2 4.35Å; I701-F719 HydrophobicContact CD1-CG 4.21Å; I701-F719 HydrophobicContact CG1-CB 4.21Å; I701-F719 HydrophobicContact CG1-CD2 4.17Å; I701-F719 HydrophobicContact CG2-CB 4.29Å; I701-V727 PolarHBondContact N-O 3.45Å; I701-A728 HydrophobicContact CD1-CB 3.95Å; I701-A728 HydrophobicContact CG1-CB 3.66Å; I701-V729 PolarHBondContact O-N 2.61Å
702	R	95.1	Very high	89.2	Confident	48 Å²	48	58.8 Å²	58.8	18%	0.181	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	132.2	173.7	178.4	175.6	170.1	148.2	-7.1	109.7	L686 D687 T690 D704 V729	L686-R702 PolarHBondContact O-NH1 2.95Å; D687-R702 IonicContact OD1-CZ 2.68Å; D687-R702 IonicContact OD1-NH1 2.71Å; D687-R702 PolarHBondContact OD1-NH1 3.49Å; D687-R702 IonicContact OD1-NH2 2.79Å; D687-R702 PolarHBondContact OD1-NH2 3.03Å; T690-R702 PolarHBondContact OG1-NH1 3.03Å; T690-R702 VanDerWaalsContact OG1-NH1 3.12Å; R702-D704 IonicContact CZ-OD2 3.39Å; R702-D704 VanDerWaalsContact CZ-OD2 3.27Å; R702-D704 IonicContact NE-OD2 3.06Å; R702-D704 PolarHBondContact NE-OD2 2.87Å; R702-D704 IonicContact NH2-OD2 3.91Å; R702-D704 PolarHBondContact NH2-OD2 3.45Å; R702-V729 CarbonylContact C-O 3.56Å; R702-V729 VanDerWaalsContact CA-O 3.25Å; R702-V729 WeakPolarHBondContact CA-O 3.37Å
703	I	92.2	Very high	88.7	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	113.4	173.4	-57.3	174.5	0	0	0	109.4	I701 T707 R712 L715 V729 L730 S731 L739	I701-I703 HydrophobicContact CD1-CD1 4.24Å; I703-T707 HydrophobicContact CG1-CG2 4.47Å; I703-T707 HydrophobicContact CG2-CG2 4.28Å; I703-R712 HydrophobicContact CG2-CG 4Å; I703-L715 HydrophobicContact CD1-CB 4.16Å; I703-L715 HydrophobicContact CG1-CB 4.33Å; I703-L715 HydrophobicContact CG1-CD1 4Å; I703-V729 PolarHBondContact N-O 3.17Å; I703-L730 HydrophobicContact CB-CD2 3.79Å; I703-L730 HydrophobicContact CD1-CD2 4.22Å; I703-L730 HydrophobicContact CG1-CD2 4.16Å; I703-S731 PolarHBondContact O-N 3.06Å; I703-L739 HydrophobicContact CD1-CD1 3.73Å; I703-L739 HydrophobicContact CG2-CD1 4.32Å
704	D	91	Very high	88.3	Confident	19 Å²	19	67.9 Å²	67.9	10%	0.102	38%	0.384	C	S	.	.			trans	-134.9	-169.2	-178.8	64.6	21.1	0	0	0	112.2	L686 R702 A706 T707 R712 A734	L686-D704 HydrophobicContact CD1-CB 4.24Å; R702-D704 IonicContact CZ-OD2 3.39Å; R702-D704 VanDerWaalsContact CZ-OD2 3.27Å; R702-D704 IonicContact NE-OD2 3.06Å; R702-D704 PolarHBondContact NE-OD2 2.87Å; R702-D704 IonicContact NH2-OD2 3.91Å; R702-D704 PolarHBondContact NH2-OD2 3.45Å; D704-A706 VanDerWaalsContact C-N 3.27Å; D704-A706 PolarHBondContact O-N 2.84Å; D704-A706 PolarHBondContact OD1-N 2.79Å; D704-T707 PolarHBondContact N-OG1 2.82Å; D704-T707 WeakPolarHBondContact O-CB 3.35Å; D704-T707 PolarHBondContact O-N 2.85Å; D704-T707 PolarHBondContact OD1-N 3.04Å; D704-T707 VanDerWaalsContact OD1-N 3.15Å; D704-T707 PolarHBondContact OD1-OG1 2.68Å; D704-R712 PolarHBondContact O-NH2 2.89Å; D704-A734 VanDerWaalsContact C-CB 3.42Å
705	G	84.1	Confident	88.1	Confident	66 Å²	66	64.5 Å²	64.5	68%	0.68	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.2	180	0	0	0	0	0	114.3
706	A	85.5	Confident	87.9	Confident	86 Å²	86	58.2 Å²	58.2	71%	0.711	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-19.1	179.3	0	0	0	0	0	112.8	D704 P708	D704-A706 VanDerWaalsContact C-N 3.27Å; D704-A706 PolarHBondContact O-N 2.84Å; D704-A706 PolarHBondContact OD1-N 2.79Å; A706-P708 VanDerWaalsContact O-CD 3.24Å; A706-P708 WeakPolarHBondContact O-CD 3.27Å
707	T	85.9	Confident	87.8	Confident	17 Å²	17	58.1 Å²	58.1	10%	0.104	34%	0.342	C	S	.	.	S	Bend	trans	-68	114.3	-174.7	-52.7	0	0	0	0	111.9	I703 D704 R712 L715	I703-T707 HydrophobicContact CG1-CG2 4.47Å; I703-T707 HydrophobicContact CG2-CG2 4.28Å; D704-T707 PolarHBondContact N-OG1 2.82Å; D704-T707 WeakPolarHBondContact O-CB 3.35Å; D704-T707 PolarHBondContact O-N 2.85Å; D704-T707 PolarHBondContact OD1-N 3.04Å; D704-T707 VanDerWaalsContact OD1-N 3.15Å; D704-T707 PolarHBondContact OD1-OG1 2.68Å; T707-R712 HydrophobicContact CG2-CG 3.9Å; T707-R712 PolarHBondContact O-NE 3.22Å; T707-R712 PolarHBondContact O-NH2 2.95Å; T707-R712 VanDerWaalsContact O-NH2 3.08Å; T707-L715 HydrophobicContact CG2-CD1 3.82Å
708	P	82.7	Confident	87.8	Confident	62 Å²	62	55.6 Å²	55.6	40%	0.403	32%	0.323	S	S	.	.			trans	-61.2	144	-175.4	-26.6	37.6	0	0	0	113.8	A706 A710 E711 R712	A706-P708 VanDerWaalsContact O-CD 3.24Å; A706-P708 WeakPolarHBondContact O-CD 3.27Å; P708-A710 PolarHBondContact O-N 3.22Å; P708-A710 VanDerWaalsContact O-N 3.1Å; P708-E711 HydrophobicContact CB-CG 4.43Å; P708-E711 WeakPolarHBondContact CG-OE1 3.27Å; P708-E711 PolarHBondContact O-N 3.16Å; P708-E711 VanDerWaalsContact O-N 3.09Å; P708-R712 WeakPolarHBondContact O-CG 3.37Å; P708-R712 PolarHBondContact O-N 3.37Å
709	S	74.3	Confident	87.9	Confident	64 Å²	64	54.2 Å²	54.2	45%	0.448	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.9	-170.9	-164.3	0	0	0	0	115	S432	S432-S709 WeakPolarHBondContact CA-OG 3.32Å
710	A	76.8	Confident	87.7	Confident	78 Å²	78	53.4 Å²	53.4	65%	0.645	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-33.6	177	0	0	0	0	0	112.7	P708	P708-A710 PolarHBondContact O-N 3.22Å; P708-A710 VanDerWaalsContact O-N 3.1Å
711	E	84.3	Confident	87.4	Confident	96 Å²	96	59.4 Å²	59.4	45%	0.449	33%	0.332	S	S	.	.	H	α-helix	trans	-75.7	-29.1	-178.8	-67.3	169.7	-147.6	0	0	112.1	P708 Q713 Q714 L715	P708-E711 HydrophobicContact CB-CG 4.43Å; P708-E711 WeakPolarHBondContact CG-OE1 3.27Å; P708-E711 PolarHBondContact O-N 3.16Å; P708-E711 VanDerWaalsContact O-N 3.09Å; E711-Q713 PolarHBondContact O-N 2.95Å; E711-Q714 PolarHBondContact O-N 2.86Å; E711-Q714 VanDerWaalsContact O-N 3.08Å; E711-L715 WeakPolarHBondContact O-CG 3.4Å; E711-L715 PolarHBondContact O-N 2.78Å
712	R	85.1	Confident	86.9	Confident	36 Å²	36	60.7 Å²	60.7	14%	0.136	34%	0.342	C	S	.	.	H	α-helix	trans	-53.3	-39.4	-179.3	-68.6	177.6	-175	-134.7	-6.6	113.3	I703 D704 T707 P708 C716 A734 L739	I703-R712 HydrophobicContact CG2-CG 4Å; D704-R712 PolarHBondContact O-NH2 2.89Å; T707-R712 HydrophobicContact CG2-CG 3.9Å; T707-R712 PolarHBondContact O-NE 3.22Å; T707-R712 PolarHBondContact O-NH2 2.95Å; T707-R712 VanDerWaalsContact O-NH2 3.08Å; P708-R712 WeakPolarHBondContact O-CG 3.37Å; P708-R712 PolarHBondContact O-N 3.37Å; R712-C716 PolarHBondContact O-N 3.15Å; R712-C716 PolarHBondContact O-SG 2.96Å; R712-A734 PolarHBondContact NH1-O 3.26Å; R712-L739 HydrophobicContact CB-CD2 4.25Å
713	Q	82.1	Confident	86.2	Confident	105 Å²	105	64.1 Å²	64.1	49%	0.491	37%	0.373	S	S	.	.	H	α-helix	trans	-67.1	-48.6	177.2	176.3	169.9	-15.8	0	0	111.4	E711 L715 C716 E717	E711-Q713 PolarHBondContact O-N 2.95Å; Q713-L715 PolarHBondContact O-N 2.94Å; Q713-C716 WeakPolarHBondContact O-CB 3.45Å; Q713-C716 PolarHBondContact O-N 2.83Å; Q713-E717 HydrophobicContact CG-CG 4.38Å; Q713-E717 WeakPolarHBondContact CG-OE1 3.32Å; Q713-E717 PolarHBondContact NE2-OE1 2.64Å; Q713-E717 WeakPolarHBondContact O-CG 3.45Å; Q713-E717 PolarHBondContact O-N 2.81Å
714	Q	87.3	Confident	85.8	Confident	132 Å²	132	71.3 Å²	71.3	62%	0.617	40%	0.404	S	S	*	.	H	α-helix	trans	-59.7	-36.5	178.3	-58.9	177.6	-0.6	0	0	111.7	E711 K718	E711-Q714 PolarHBondContact O-N 2.86Å; E711-Q714 VanDerWaalsContact O-N 3.08Å; Q714-K718 VanDerWaalsContact O-CB 3.28Å; Q714-K718 WeakPolarHBondContact O-CB 3.46Å; Q714-K718 PolarHBondContact O-N 3.05Å
715	L	91.2	Very high	85.4	Confident	38 Å²	38	73 Å²	73	20%	0.199	42%	0.417	C	S	.	.	H	α-helix	trans	-67.2	-43.1	173.8	-68.7	167.7	0	0	0	112.1	I701 I703 T707 E711 Q713 K718 F719	I701-L715 HydrophobicContact CB-CB 4.47Å; I701-L715 HydrophobicContact CB-CD2 4.28Å; I701-L715 HydrophobicContact CD1-CB 4.44Å; I701-L715 HydrophobicContact CG2-CD2 4.21Å; I703-L715 HydrophobicContact CD1-CB 4.16Å; I703-L715 HydrophobicContact CG1-CB 4.33Å; I703-L715 HydrophobicContact CG1-CD1 4Å; T707-L715 HydrophobicContact CG2-CD1 3.82Å; E711-L715 WeakPolarHBondContact O-CG 3.4Å; E711-L715 PolarHBondContact O-N 2.78Å; Q713-L715 PolarHBondContact O-N 2.94Å; L715-K718 PolarHBondContact O-N 3.23Å; L715-F719 PolarHBondContact O-N 3.47Å
716	C	89.2	Confident	85.7	Confident	13 Å²	13	69.9 Å²	69.9	9%	0.088	39%	0.385	C	S	.	.	H	α-helix	trans	-62	-45.1	173.1	-70.1	0	0	0	0	112	R712 Q713 F719 Q720 L741	R712-C716 PolarHBondContact O-N 3.15Å; R712-C716 PolarHBondContact O-SG 2.96Å; Q713-C716 WeakPolarHBondContact O-CB 3.45Å; Q713-C716 PolarHBondContact O-N 2.83Å; C716-F719 PolarHBondContact O-N 2.8Å; C716-Q720 WeakPolarHBondContact O-CB 3.45Å; C716-Q720 WeakPolarHBondContact O-CG 3.46Å; C716-Q720 PolarHBondContact O-N 3.47Å; C716-L741 HydrophobicContact CB-CD2 4.18Å
717	E	89.4	Confident	86.2	Confident	83 Å²	83	65.8 Å²	65.8	39%	0.388	35%	0.351	S	S	.	.	H	α-helix	trans	-61.7	-43.9	177.3	-70.8	169	-176.8	0	0	111.4	Q713 F719 Q720 F721	Q713-E717 HydrophobicContact CG-CG 4.38Å; Q713-E717 WeakPolarHBondContact CG-OE1 3.32Å; Q713-E717 PolarHBondContact NE2-OE1 2.64Å; Q713-E717 WeakPolarHBondContact O-CG 3.45Å; Q713-E717 PolarHBondContact O-N 2.81Å; E717-F719 VanDerWaalsContact C-N 3.35Å; E717-F719 PolarHBondContact O-N 2.98Å; E717-Q720 PolarHBondContact O-N 3.48Å; E717-F721 HydrophobicContact CB-CD2 4.14Å; E717-F721 HydrophobicContact CB-CE2 4.22Å; E717-F721 HydrophobicContact CG-CE2 4.23Å; E717-F721 WeakPolarHBondContact O-CD2 3.16Å; E717-F721 PolarHBondContact O-N 3.14Å
718	K	91.8	Very high	86.7	Confident	102 Å²	102	65 Å²	65	44%	0.443	35%	0.346	S	S	.	.	H	α-helix	trans	-56.1	-45.9	172.5	179.9	-170.5	171.9	-156.2	0	111.9	F700 I701 Q714 L715 S722	F700-K718 PolarHBondContact O-NZ 2.74Å; I701-K718 HydrophobicContact CG2-CD 3.95Å; I701-K718 HydrophobicContact CG2-CG 4.4Å; Q714-K718 VanDerWaalsContact O-CB 3.28Å; Q714-K718 WeakPolarHBondContact O-CB 3.46Å; Q714-K718 PolarHBondContact O-N 3.05Å; L715-K718 PolarHBondContact O-N 3.23Å; K718-S722 WeakPolarHBondContact O-CB 3.26Å; K718-S722 PolarHBondContact O-N 3.31Å
719	F	92.8	Very high	87.3	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-67	-46.2	178.7	179.7	-93.3	0	0	0	112.2	K675 L677 I701 L715 C716 E717 C726 A728 L741 S743 A744	K675-F719 HydrophobicContact CB-CZ 4.16Å; K675-F719 PolarHBondContact NZ-O 2.84Å; L677-F719 HydrophobicContact CD2-CE1 3.87Å; L677-F719 HydrophobicContact CD2-CE2 4.33Å; L677-F719 HydrophobicContact CD2-CZ 3.61Å; I701-F719 HydrophobicContact CD1-CB 3.76Å; I701-F719 HydrophobicContact CD1-CD2 4.35Å; I701-F719 HydrophobicContact CD1-CG 4.21Å; I701-F719 HydrophobicContact CG1-CB 4.21Å; I701-F719 HydrophobicContact CG1-CD2 4.17Å; I701-F719 HydrophobicContact CG2-CB 4.29Å; L715-F719 PolarHBondContact O-N 3.47Å; C716-F719 PolarHBondContact O-N 2.8Å; E717-F719 VanDerWaalsContact C-N 3.35Å; E717-F719 PolarHBondContact O-N 2.98Å; F719-C726 HydrophobicContact CD2-CB 4.15Å; F719-C726 HydrophobicContact CE2-CB 4.37Å; F719-C726 VanDerWaalsContact CE2-O 3.3Å; F719-C726 WeakPolarHBondContact CE2-O 3.43Å; F719-A728 HydrophobicContact CD2-CB 3.87Å; F719-A728 HydrophobicContact CE2-CB 3.66Å; F719-A728 HydrophobicContact CZ-CB 4.18Å; F719-L741 HydrophobicContact CB-CD2 4.37Å; F719-L741 HydrophobicContact CD1-CD2 3.7Å; F719-L741 HydrophobicContact CE1-CB 4.42Å; F719-L741 HydrophobicContact CE1-CD2 4.33Å; F719-L741 HydrophobicContact CG-CD2 4.23Å; F719-S743 WeakPolarHBondContact CD1-OG 3.15Å; F719-S743 VanDerWaalsContact CE1-OG 3.28Å; F719-S743 WeakPolarHBondContact CE1-OG 3.18Å; F719-A744 HydrophobicContact CE1-CB 4.15Å; F719-A744 HydrophobicContact CZ-CB 4.02Å
720	Q	89.7	Confident	88.4	Confident	30 Å²	30	59 Å²	59	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-59.3	-54.3	179.7	-74.9	-77.9	121.3	0	0	111.7	K675 C716 E717 L741 H742 S743	K675-Q720 PolarHBondContact NZ-O 3.27Å; C716-Q720 WeakPolarHBondContact O-CB 3.45Å; C716-Q720 WeakPolarHBondContact O-CG 3.46Å; C716-Q720 PolarHBondContact O-N 3.47Å; E717-Q720 PolarHBondContact O-N 3.48Å; Q720-L741 VanDerWaalsContact OE1-CA 3.27Å; Q720-H742 PolarHBondContact NE2-CD2 3.24Å; Q720-H742 PolarHBondContact NE2-CE1 3.06Å; Q720-H742 PolarHBondContact NE2-NE2 3.1Å; Q720-S743 WeakPolarHBondContact CA-OG 3.48Å; Q720-S743 PolarHBondContact OE1-OG 3.4Å
721	F	89.1	Confident	89.1	Confident	170 Å²	170	55.6 Å²	55.6	75%	0.746	28%	0.278	S	S	*	.	H	α-helix	trans	-93.7	-6.7	-170.1	-55.2	-58.8	0	0	0	115	E717 S723	E717-F721 HydrophobicContact CB-CD2 4.14Å; E717-F721 HydrophobicContact CB-CE2 4.22Å; E717-F721 HydrophobicContact CG-CE2 4.23Å; E717-F721 WeakPolarHBondContact O-CD2 3.16Å; E717-F721 PolarHBondContact O-N 3.14Å; F721-S723 PolarHBondContact O-N 3.11Å
722	S	86.1	Confident	89.3	Confident	30 Å²	30	51 Å²	51	21%	0.21	26%	0.256	C	S	.	.			trans	-60.3	130.2	170.7	172.3	0	0	0	0	111.3	K675 K718 K724	K675-S722 WeakPolarHBondContact CE-O 3.48Å; K675-S722 PolarHBondContact NZ-O 2.62Å; K718-S722 WeakPolarHBondContact O-CB 3.26Å; K718-S722 PolarHBondContact O-N 3.31Å; S722-K724 VanDerWaalsContact C-N 3.34Å; S722-K724 PolarHBondContact OG-N 3.44Å; S722-K724 PolarHBondContact OG-O 2.82Å
723	S	80.7	Confident	89.3	Confident	120 Å²	120	52.3 Å²	52.3	84%	0.839	27%	0.268	S	S	*	.			trans	-84.5	-6.8	166.8	55.5	0	0	0	0	113.6	F721	F721-S723 PolarHBondContact O-N 3.11Å
724	K	83.5	Confident	89.1	Confident	151 Å²	151	48.3 Å²	48.3	66%	0.657	25%	0.253	S	S	*	.	S	Bend	trans	-88.9	146.8	174.3	-60.7	-175.6	-180	-175.2	0	110.7	S722 C726	S722-K724 VanDerWaalsContact C-N 3.34Å; S722-K724 PolarHBondContact OG-N 3.44Å; S722-K724 PolarHBondContact OG-O 2.82Å; K724-C726 PolarHBondContact O-N 3.25Å
725	S	82.6	Confident	88.6	Confident	53 Å²	53	42 Å²	42	37%	0.371	22%	0.224	S	C	.	.			trans	-50.4	129.3	168.6	-36.9	0	0	0	0	110.3	E674 S699	E674-S725 CarbonylContact O-C 3.59Å; E674-S725 WeakPolarHBondContact O-CA 3.49Å; E674-S725 WeakPolarHBondContact O-CB 3.3Å; S699-S725 WeakPolarHBondContact CB-O 3.24Å
726	C	90.1	Very high	87.5	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.007	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	127.8	-170.6	-163.9	0	0	0	0	111.2	E674 K675 S699 F719 K724	E674-C726 PolarHBondContact O-N 3.01Å; K675-C726 WeakPolarHBondContact CA-O 3.45Å; S699-C726 VanDerWaalsContact O-CA 3.27Å; S699-C726 WeakPolarHBondContact O-CA 3.46Å; F719-C726 HydrophobicContact CD2-CB 4.15Å; F719-C726 HydrophobicContact CE2-CB 4.37Å; F719-C726 VanDerWaalsContact CE2-O 3.3Å; F719-C726 WeakPolarHBondContact CE2-O 3.43Å; K724-C726 PolarHBondContact O-N 3.25Å
727	V	95.7	Very high	86.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	135.5	172.8	-177.1	0	0	0	0	109.7	L669 F676 V678 L693 V698 S699 F700 I701 V729	L669-V727 HydrophobicContact CD2-CG2 4.23Å; F676-V727 HydrophobicContact CD1-CG2 4.4Å; F676-V727 HydrophobicContact CD2-CG1 4.17Å; F676-V727 HydrophobicContact CE1-CG2 3.83Å; F676-V727 HydrophobicContact CE2-CG1 3.86Å; F676-V727 HydrophobicContact CE2-CG2 4.02Å; F676-V727 HydrophobicContact CZ-CG1 4.32Å; F676-V727 HydrophobicContact CZ-CG2 3.62Å; V678-V727 HydrophobicContact CG2-CG1 3.72Å; L693-V727 HydrophobicContact CD1-CB 3.92Å; L693-V727 HydrophobicContact CD1-CG1 4.03Å; L693-V727 HydrophobicContact CD1-CG2 4.43Å; L693-V727 HydrophobicContact CD2-CB 4.28Å; L693-V727 HydrophobicContact CD2-CG2 3.87Å; V698-V727 HydrophobicContact CG1-CG2 4.12Å; S699-V727 PolarHBondContact O-N 3.26Å; F700-V727 CarbonylContact C-O 3.32Å; F700-V727 WeakPolarHBondContact CA-O 3.46Å; F700-V727 WeakPolarHBondContact CB-O 3.49Å; I701-V727 PolarHBondContact N-O 3.45Å; V727-V729 HydrophobicContact CG1-CG2 4.34Å
728	A	96	Very high	85.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	111.1	172.1	0	0	0	0	0	110.6	F676 L677 V678 I701 F719 L730	F676-A728 PolarHBondContact O-N 2.95Å; L677-A728 HydrophobicContact CD2-CB 3.58Å; V678-A728 PolarHBondContact N-O 3.47Å; I701-A728 HydrophobicContact CD1-CB 3.95Å; I701-A728 HydrophobicContact CG1-CB 3.66Å; F719-A728 HydrophobicContact CD2-CB 3.87Å; F719-A728 HydrophobicContact CE2-CB 3.66Å; F719-A728 HydrophobicContact CZ-CB 4.18Å; A728-L730 HydrophobicContact CB-CD1 4.27Å; A728-L730 HydrophobicContact CB-CD2 4.36Å; A728-L730 HydrophobicContact CB-CG 4.17Å
729	V	96.7	Very high	85.3	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	107.6	-179.8	-175	0	0	0	0	108.7	L686 I689 L693 I701 R702 I703 V727	L686-V729 HydrophobicContact CB-CG1 4.38Å; L686-V729 HydrophobicContact CD2-CG1 3.65Å; I689-V729 HydrophobicContact CB-CG1 4.26Å; I689-V729 HydrophobicContact CG2-CG1 4.11Å; I689-V729 HydrophobicContact CG2-CG2 3.67Å; L693-V729 HydrophobicContact CD1-CG2 3.74Å; I701-V729 PolarHBondContact O-N 2.61Å; R702-V729 CarbonylContact C-O 3.56Å; R702-V729 VanDerWaalsContact CA-O 3.25Å; R702-V729 WeakPolarHBondContact CA-O 3.37Å; I703-V729 PolarHBondContact N-O 3.17Å; V727-V729 HydrophobicContact CG1-CG2 4.34Å
730	L	95.4	Very high	85	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	132.6	-164.5	-59.3	176.9	0	0	0	111.7	L677 V678 F679 A680 I703 A728 V732 A735 L741	L677-L730 HydrophobicContact CB-CD1 4.21Å; L677-L730 HydrophobicContact CD1-CD1 3.85Å; L677-L730 HydrophobicContact CD2-CD1 4.46Å; L677-L730 HydrophobicContact CG-CD1 4.41Å; V678-L730 PolarHBondContact O-N 2.78Å; F679-L730 VanDerWaalsContact CA-O 3.31Å; F679-L730 WeakPolarHBondContact CA-O 3.43Å; F679-L730 HydrophobicContact CD1-CB 3.54Å; F679-L730 HydrophobicContact CD1-CD1 4.23Å; F679-L730 HydrophobicContact CE1-CB 3.59Å; F679-L730 HydrophobicContact CE1-CD1 3.57Å; F679-L730 HydrophobicContact CE1-CG 4.24Å; F679-L730 HydrophobicContact CE2-CD1 4.28Å; F679-L730 HydrophobicContact CG-CB 4.35Å; F679-L730 HydrophobicContact CZ-CB 4.42Å; F679-L730 HydrophobicContact CZ-CD1 3.59Å; A680-L730 PolarHBondContact N-O 2.98Å; I703-L730 HydrophobicContact CB-CD2 3.79Å; I703-L730 HydrophobicContact CD1-CD2 4.22Å; I703-L730 HydrophobicContact CG1-CD2 4.16Å; A728-L730 HydrophobicContact CB-CD1 4.27Å; A728-L730 HydrophobicContact CB-CD2 4.36Å; A728-L730 HydrophobicContact CB-CG 4.17Å; L730-V732 PolarHBondContact O-N 3.43Å; L730-A735 HydrophobicContact CB-CB 3.93Å; L730-A735 HydrophobicContact CD2-CB 4.2Å; L730-A735 HydrophobicContact CG-CB 4.44Å; L730-L741 HydrophobicContact CD1-CD1 3.66Å
731	S	92.8	Very high	85	Confident	8 Å²	8	36.2 Å²	36.2	6%	0.056	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	124.4	166.9	171.2	0	0	0	0	110	A680 I703 T733 A734 A735	A680-S731 CarbonylContact O-C 3.18Å; A680-S731 VanDerWaalsContact O-CA 3.29Å; A680-S731 WeakPolarHBondContact O-CA 3.36Å; I703-S731 PolarHBondContact O-N 3.06Å; S731-T733 PolarHBondContact O-N 3.13Å; S731-T733 PolarHBondContact OG-OG1 3.36Å; S731-A734 PolarHBondContact O-N 3.38Å; S731-A734 PolarHBondContact OG-N 2.83Å; S731-A735 VanDerWaalsContact O-CB 3.26Å; S731-A735 WeakPolarHBondContact O-CB 3.25Å; S731-A735 PolarHBondContact O-N 3.2Å
732	V	88.7	Confident	84.9	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48	-44.9	178.9	170.4	0	0	0	0	111.9	F679 A680 L730 F753 V758	F679-V732 HydrophobicContact CB-CG2 3.84Å; A680-V732 WeakPolarHBondContact O-CG2 3.47Å; A680-V732 PolarHBondContact O-N 3.43Å; L730-V732 PolarHBondContact O-N 3.43Å; V732-F753 HydrophobicContact CG1-CB 3.92Å; V732-F753 HydrophobicContact CG1-CD1 4.45Å; V732-F753 HydrophobicContact CG1-CG 4.07Å; V732-V758 HydrophobicContact CG1-CG1 3.61Å
733	T	83.5	Confident	85.1	Confident	62 Å²	62	30.8 Å²	30.8	38%	0.38	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-37.6	-176.8	52	0	0	0	0	112.8	S731 N736 F753	S731-T733 PolarHBondContact O-N 3.13Å; S731-T733 PolarHBondContact OG-OG1 3.36Å; T733-N736 VanDerWaalsContact O-CB 3.22Å; T733-N736 WeakPolarHBondContact O-CB 3.3Å; T733-F753 HydrophobicContact CG2-CE1 4.32Å; T733-F753 HydrophobicContact CG2-CE2 3.87Å; T733-F753 HydrophobicContact CG2-CZ 3.76Å
734	A	78.7	Confident	85.6	Confident	21 Å²	21	25.2 Å²	25.2	17%	0.174	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-28.3	-175.9	0	0	0	0	0	113.9	D704 R712 S731 N736	D704-A734 VanDerWaalsContact C-CB 3.42Å; R712-A734 PolarHBondContact NH1-O 3.26Å; S731-A734 PolarHBondContact O-N 3.38Å; S731-A734 PolarHBondContact OG-N 2.83Å; A734-N736 VanDerWaalsContact C-N 3.31Å
735	A	76.2	Confident	85.9	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-88.5	1.6	175.7	0	0	0	0	0	113.3	F679 L730 S731 M737 L739	F679-A735 HydrophobicContact CE1-CB 4.13Å; L730-A735 HydrophobicContact CB-CB 3.93Å; L730-A735 HydrophobicContact CD2-CB 4.2Å; L730-A735 HydrophobicContact CG-CB 4.44Å; S731-A735 VanDerWaalsContact O-CB 3.26Å; S731-A735 WeakPolarHBondContact O-CB 3.25Å; S731-A735 PolarHBondContact O-N 3.2Å; A735-M737 PolarHBondContact O-N 3.5Å; A735-L739 HydrophobicContact CB-CD1 3.87Å
736	N	69.9	Low	86.4	Confident	14 Å²	14	17.6 Å²	17.6	8%	0.075	11%	0.112	C	C	.	.	S	Bend	trans	-62.1	-15.2	-172.2	-166.8	40.8	0	0	0	114.9	T733 A734 V758 Q761 R765	T733-N736 VanDerWaalsContact O-CB 3.22Å; T733-N736 WeakPolarHBondContact O-CB 3.3Å; A734-N736 VanDerWaalsContact C-N 3.31Å; N736-V758 PolarHBondContact OD1-O 3.43Å; N736-Q761 VanDerWaalsContact CG-OE1 3.26Å; N736-Q761 PolarHBondContact ND2-OE1 2.83Å; N736-Q761 PolarHBondContact O-OE1 3.19Å; N736-Q761 WeakPolarHBondContact OD1-CB 3.25Å; N736-Q761 PolarHBondContact OD1-OE1 2.99Å; N736-R765 PolarHBondContact O-NH2 2.85Å
737	M	73.8	Confident	86.7	Confident	25 Å²	25	17.6 Å²	17.6	12%	0.123	11%	0.112	C	C	.	.	S	Bend	trans	-136.3	153.4	-169.7	-46.8	-160.2	93	0	0	113.2	P430 E495 F498 A735 L739	P430-M737 HydrophobicContact CB-CE 4.24Å; P430-M737 HydrophobicContact CB-SD 3.7Å; P430-M737 HydrophobicContact CG-CE 3.47Å; P430-M737 VanDerWaalsContact CG-CE 3.47Å; P430-M737 HydrophobicContact CG-SD 3.63Å; E495-M737 HydrophobicContact CB-CE 3.56Å; E495-M737 HydrophobicContact CG-CE 3.61Å; F498-M737 HydrophobicContact CD2-CE 4.17Å; F498-M737 HydrophobicContact CE2-CE 3.42Å; F498-M737 VanDerWaalsContact CE2-CE 3.42Å; F498-M737 HydrophobicContact CE2-SD 3.46Å; F498-M737 WeakPolarHBondContact CE2-SD 3.19Å; F498-M737 HydrophobicContact CZ-CE 4.15Å; F498-M737 HydrophobicContact CZ-SD 3.53Å; F498-M737 VanDerWaalsContact CZ-SD 3.53Å; A735-M737 PolarHBondContact O-N 3.5Å; M737-L739 PolarHBondContact O-N 2.99Å
738	G	68.4	Low	86.7	Confident	42 Å²	42	17.6 Å²	17.6	43%	0.433	11%	0.112	S	C	.	.	S	Bend	trans	71.9	-38.9	173.3	0	0	0	0	0	117.2
739	L	81.4	Confident	86.8	Confident	13 Å²	13	17.6 Å²	17.6	7%	0.068	11%	0.112	C	C	.	.			trans	-68.7	153.4	-170.6	-44	-173.4	0	0	0	113.4	I703 R712 A735 M737 R765 R768	I703-L739 HydrophobicContact CD1-CD1 3.73Å; I703-L739 HydrophobicContact CG2-CD1 4.32Å; R712-L739 HydrophobicContact CB-CD2 4.25Å; A735-L739 HydrophobicContact CB-CD1 3.87Å; M737-L739 PolarHBondContact O-N 2.99Å; L739-R765 WeakPolarHBondContact O-CD 3.27Å; L739-R765 PolarHBondContact O-NH1 2.64Å; L739-R768 PolarHBondContact O-NH1 2.88Å
740	T	85.4	Confident	86.7	Confident	51 Å²	51	17.6 Å²	17.6	31%	0.313	11%	0.112	S	C	.	.			trans	-134.4	123	171.4	-63.7	0	0	0	0	108.4	R768	T740-R768 PolarHBondContact OG1-NH1 2.93Å
741	L	89.3	Confident	86.7	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.113	C	C	.	.			trans	-138.7	44.6	-170.1	-65.1	170.9	0	0	0	110.6	L677 C716 F719 Q720 L730 S743 A744 R765	L677-L741 HydrophobicContact CD1-CB 4.16Å; L677-L741 HydrophobicContact CD1-CD1 3.92Å; L677-L741 HydrophobicContact CD2-CB 4.07Å; L677-L741 HydrophobicContact CD2-CD1 4.05Å; C716-L741 HydrophobicContact CB-CD2 4.18Å; F719-L741 HydrophobicContact CB-CD2 4.37Å; F719-L741 HydrophobicContact CD1-CD2 3.7Å; F719-L741 HydrophobicContact CE1-CB 4.42Å; F719-L741 HydrophobicContact CE1-CD2 4.33Å; F719-L741 HydrophobicContact CG-CD2 4.23Å; Q720-L741 VanDerWaalsContact OE1-CA 3.27Å; L730-L741 HydrophobicContact CD1-CD1 3.66Å; L741-S743 PolarHBondContact O-N 3.21Å; L741-A744 PolarHBondContact O-N 3.06Å; L741-R765 PolarHBondContact N-O 3.35Å
742	H	87.7	Confident	86.6	Confident	54 Å²	54	17.5 Å²	17.5	25%	0.25	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-5.3	-175.9	65.6	-115.2	0	0	0	114.4	Q720 A744 G770 Q771	Q720-H742 PolarHBondContact NE2-CD2 3.24Å; Q720-H742 PolarHBondContact NE2-CE1 3.06Å; Q720-H742 PolarHBondContact NE2-NE2 3.1Å; H742-A744 PolarHBondContact O-N 3.33Å; H742-G770 PolarHBondContact CD2-O 2.93Å; H742-Q771 HydrophobicContact CB-CB 4.41Å; H742-Q771 PolarHBondContact O-NE2 3.3Å; H742-Q771 VanDerWaalsContact O-NE2 3.11Å
743	S	89.6	Confident	86.6	Confident	32 Å²	32	18.1 Å²	18.1	22%	0.224	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	7.1	173.8	76.3	0	0	0	0	114.2	K675 F719 Q720 L741	K675-S743 WeakPolarHBondContact CB-O 3.45Å; K675-S743 VanDerWaalsContact CD-O 3.27Å; K675-S743 WeakPolarHBondContact CD-O 3.36Å; F719-S743 WeakPolarHBondContact CD1-OG 3.15Å; F719-S743 VanDerWaalsContact CE1-OG 3.28Å; F719-S743 WeakPolarHBondContact CE1-OG 3.18Å; Q720-S743 WeakPolarHBondContact CA-OG 3.48Å; Q720-S743 PolarHBondContact OE1-OG 3.4Å; L741-S743 PolarHBondContact O-N 3.21Å
744	A	91.5	Very high	86.7	Confident	2 Å²	2	15.7 Å²	15.7	2%	0.017	10%	0.098	C	C	.	.			trans	-101.4	153.9	169.6	0	0	0	0	0	110.1	L677 F719 L741 H742 V766 Q771	L677-A744 HydrophobicContact CD2-CB 3.91Å; L677-A744 HydrophobicContact CG-CB 4.18Å; F719-A744 HydrophobicContact CE1-CB 4.15Å; F719-A744 HydrophobicContact CZ-CB 4.02Å; L741-A744 PolarHBondContact O-N 3.06Å; H742-A744 PolarHBondContact O-N 3.33Å; A744-V766 HydrophobicContact CB-CG1 4.17Å; A744-V766 HydrophobicContact CB-CG2 4.18Å; A744-V766 WeakPolarHBondContact O-CG1 3.22Å; A744-Q771 PolarHBondContact O-NE2 2.79Å
745	D	90.8	Very high	87.1	Confident	45 Å²	45	15.7 Å²	15.7	24%	0.241	10%	0.095	C	C	.	.	S	Bend	trans	-113.4	-13.3	169.6	66.7	-5.8	0	0	0	112.9	R673 V775 D776	R673-D745 IonicContact CZ-OD2 3.93Å; R673-D745 IonicContact NH1-OD1 2.95Å; R673-D745 PolarHBondContact NH1-OD1 2.85Å; R673-D745 VanDerWaalsContact NH1-OD1 3.15Å; R673-D745 IonicContact NH1-OD2 3.75Å; R673-D745 PolarHBondContact NH1-OD2 3.12Å; D745-V775 CarbonylContact O-C 3.48Å; D745-V775 WeakPolarHBondContact O-CA 3.48Å; D745-D776 PolarHBondContact O-N 2.87Å
746	L	93.4	Very high	87.7	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.9	-177.8	169.4	65.5	0	0	0	111.5	M668 R673 F676 L677 I748 D776 H778	M668-L746 HydrophobicContact CB-CD2 4.41Å; M668-L746 HydrophobicContact CG-CD2 4.09Å; M668-L746 HydrophobicContact SD-CD2 4.05Å; R673-L746 HydrophobicContact CG-CD2 4.08Å; F676-L746 WeakPolarHBondContact CA-O 3.3Å; F676-L746 HydrophobicContact CB-CB 3.77Å; F676-L746 HydrophobicContact CB-CD2 4.03Å; F676-L746 HydrophobicContact CB-CG 3.91Å; F676-L746 WeakPolarHBondContact CB-O 3.49Å; F676-L746 HydrophobicContact CG-CD2 4.24Å; L677-L746 PolarHBondContact N-O 3.29Å; L746-I748 HydrophobicContact CD1-CG1 4.2Å; L746-I748 HydrophobicContact CD2-CD1 4.22Å; L746-I748 HydrophobicContact CD2-CG1 4.25Å; L746-I748 HydrophobicContact CG-CG1 4.07Å; L746-D776 CarbonylContact C-O 3.57Å; L746-D776 WeakPolarHBondContact CA-O 3.41Å; L746-D776 HydrophobicContact CD1-CB 3.87Å; L746-H778 WeakPolarHBondContact CD1-ND1 3.45Å
747	V	95.1	Very high	88.5	Confident	0 Å²	0	15 Å²	15	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.4	171.8	-178.5	0	0	0	0	109.2	L677 F679 F749 V766 V775 D776 I777 H778	L677-V747 HydrophobicContact CB-CG2 4.47Å; L677-V747 HydrophobicContact CD1-CG2 4.4Å; L677-V747 HydrophobicContact CG-CG2 4.38Å; F679-V747 HydrophobicContact CD2-CG1 3.55Å; F679-V747 HydrophobicContact CE2-CG1 3.66Å; V747-F749 HydrophobicContact CG1-CD2 4.24Å; V747-F749 HydrophobicContact CG1-CE2 3.89Å; V747-F749 HydrophobicContact CG1-CZ 4.32Å; V747-V766 HydrophobicContact CG2-CB 4.07Å; V747-V766 HydrophobicContact CG2-CG2 3.51Å; V747-V775 HydrophobicContact CG2-CG1 4.48Å; V747-D776 PolarHBondContact N-O 3.35Å; V747-I777 HydrophobicContact CB-CD1 3.68Å; V747-I777 HydrophobicContact CG1-CD1 4.42Å; V747-I777 HydrophobicContact CG2-CD1 3.73Å; V747-H778 PolarHBondContact O-N 3.1Å
748	I	96.7	Very high	89.2	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	113.7	176.3	-52.1	176	0	0	0	108.5	Y664 M668 F676 L677 V678 F679 L746 A750 H778 L780	Y664-I748 HydrophobicContact CD1-CD1 4.18Å; Y664-I748 HydrophobicContact CD1-CG2 4.26Å; Y664-I748 HydrophobicContact CE1-CD1 4.02Å; Y664-I748 HydrophobicContact CE1-CG1 4.41Å; Y664-I748 HydrophobicContact CE1-CG2 4.32Å; M668-I748 HydrophobicContact CG-CD1 4Å; F676-I748 HydrophobicContact CD2-CD1 3.73Å; F676-I748 HydrophobicContact CD2-CG1 4.35Å; F676-I748 HydrophobicContact CE2-CD1 3.73Å; L677-I748 PolarHBondContact O-N 2.86Å; V678-I748 CarbonylContact C-O 3.58Å; V678-I748 WeakPolarHBondContact CA-O 3.49Å; V678-I748 HydrophobicContact CG2-CB 4.41Å; V678-I748 HydrophobicContact CG2-CD1 4.39Å; F679-I748 PolarHBondContact N-O 3.5Å; L746-I748 HydrophobicContact CD1-CG1 4.2Å; L746-I748 HydrophobicContact CD2-CD1 4.22Å; L746-I748 HydrophobicContact CD2-CG1 4.25Å; L746-I748 HydrophobicContact CG-CG1 4.07Å; I748-A750 PolarHBondContact O-N 3Å; I748-H778 CarbonylContact C-O 3.54Å; I748-H778 WeakPolarHBondContact CA-O 3.47Å; I748-L780 HydrophobicContact CG2-CD1 3.84Å; I748-L780 HydrophobicContact CG2-CD2 4.14Å; I748-L780 HydrophobicContact CG2-CG 3.85Å
749	F	96.7	Very high	90.2	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	99.5	163.2	-69.9	-82.6	0	0	0	108.1	F679 V747 E751 L759 A762 E763 I777 H778 Y779 L780	F679-F749 HydrophobicContact CB-CD1 3.64Å; F679-F749 HydrophobicContact CB-CE1 3.86Å; F679-F749 HydrophobicContact CB-CG 4.44Å; F679-F749 HydrophobicContact CD2-CD1 4.31Å; F679-F749 AromaticContact CD2-CE1 3.87Å; F679-F749 HydrophobicContact CD2-CE1 3.87Å; F679-F749 HydrophobicContact CD2-CZ 4.11Å; F679-F749 HydrophobicContact CG-CD1 4.24Å; F679-F749 AromaticContact CG-CE1 3.96Å; F679-F749 HydrophobicContact CG-CE1 3.96Å; V747-F749 HydrophobicContact CG1-CD2 4.24Å; V747-F749 HydrophobicContact CG1-CE2 3.89Å; V747-F749 HydrophobicContact CG1-CZ 4.32Å; F749-E751 PolarHBondContact O-N 3Å; F749-L759 HydrophobicContact CD1-CD2 3.74Å; F749-L759 HydrophobicContact CE1-CD2 3.59Å; F749-L759 HydrophobicContact CZ-CB 4.48Å; F749-L759 HydrophobicContact CZ-CD2 4.25Å; F749-A762 HydrophobicContact CE1-CB 3.82Å; F749-A762 HydrophobicContact CZ-CB 3.78Å; F749-E763 HydrophobicContact CE2-CG 3.97Å; F749-E763 HydrophobicContact CZ-CG 4.19Å; F749-I777 HydrophobicContact CD2-CG2 3.92Å; F749-I777 HydrophobicContact CE2-CG2 3.71Å; F749-H778 PolarHBondContact N-O 3.23Å; F749-Y779 HydrophobicContact CB-CD1 3.84Å; F749-Y779 AromaticContact CD2-CD1 3.48Å; F749-Y779 HydrophobicContact CD2-CD1 3.48Å; F749-Y779 VanDerWaalsContact CD2-CD1 3.48Å; F749-Y779 AromaticContact CD2-CE1 3.41Å; F749-Y779 HydrophobicContact CD2-CE1 3.41Å; F749-Y779 VanDerWaalsContact CD2-CE1 3.41Å; F749-Y779 HydrophobicContact CD2-CG 4.42Å; F749-Y779 HydrophobicContact CE2-CD1 4.26Å; F749-Y779 AromaticContact CE2-CE1 3.71Å; F749-Y779 HydrophobicContact CE2-CE1 3.71Å; F749-Y779 AromaticContact CG-CD1 3.83Å; F749-Y779 HydrophobicContact CG-CD1 3.83Å; F749-Y779 HydrophobicContact CG-CE1 4.08Å; F749-L780 PolarHBondContact O-N 3.48Å
750	A	96.6	Very high	90.5	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.068	C	C	.	.	S	Bend	trans	-63.9	-30.4	173.9	0	0	0	0	0	111.7	K657 I661 V678 F679 A680 I748	K657-A750 WeakPolarHBondContact CE-O 3.29Å; K657-A750 PolarHBondContact NZ-O 3.26Å; I661-A750 HydrophobicContact CD1-CB 4.06Å; I661-A750 HydrophobicContact CG1-CB 4.27Å; I661-A750 HydrophobicContact CG2-CB 3.89Å; V678-A750 HydrophobicContact CG1-CB 4.16Å; F679-A750 WeakPolarHBondContact O-CB 3.44Å; F679-A750 PolarHBondContact O-N 3.07Å; A680-A750 HydrophobicContact CB-CB 4.27Å; I748-A750 PolarHBondContact O-N 3Å
751	E	94	Very high	90.6	Very high	5 Å²	5	10.1 Å²	10.1	2%	0.023	5%	0.053	C	C	.	.	S	Bend	trans	-134.2	143.7	-177.8	-54.9	-168.8	90	0	0	110.4	A654 A680 H681 H682 V685 F749	A654-E751 WeakPolarHBondContact CB-OE1 3.46Å; A680-E751 HydrophobicContact CB-CG 4.37Å; H681-E751 WeakPolarHBondContact CA-OE2 3.4Å; H681-E751 HydrophobicContact CB-CB 4.49Å; H681-E751 PolarHBondContact N-OE2 3.18Å; H682-E751 IonicContact CE1-OE1 2.87Å; H682-E751 IonicContact CG-OE1 2.82Å; H682-E751 PolarHBondContact N-OE2 3.17Å; H682-E751 IonicContact ND1-OE1 3.61Å; H682-E751 PolarHBondContact ND1-OE1 3.46Å; H682-E751 IonicContact ND1-OE2 2.76Å; V685-E751 HydrophobicContact CG1-CG 4.48Å; F749-E751 PolarHBondContact O-N 3Å
752	L	90.9	Very high	90.6	Very high	1 Å²	1	10.1 Å²	10.1	1%	0.005	5%	0.053	C	C	.	.			trans	-84	149.4	174.1	-65.9	-177.4	0	0	0	110.9	Y650 Y779 V781 D787 L790 W791 I794	Y650-L752 PolarHBondContact OH-O 3.21Å; L752-Y779 HydrophobicContact CD2-CD1 4.18Å; L752-Y779 HydrophobicContact CD2-CG 4.47Å; L752-V781 HydrophobicContact CD1-CG1 3.91Å; L752-V781 HydrophobicContact CD2-CG1 4.44Å; L752-V781 HydrophobicContact CG-CG1 4.34Å; L752-D787 HydrophobicContact CD1-CB 4.25Å; L752-L790 HydrophobicContact CB-CB 4.43Å; L752-L790 HydrophobicContact CB-CD1 4.41Å; L752-L790 HydrophobicContact CD1-CB 4.07Å; L752-W791 HydrophobicContact CD1-CB 3.86Å; L752-W791 HydrophobicContact CD1-CE3 4.02Å; L752-W791 HydrophobicContact CD2-CE3 3.78Å; L752-W791 HydrophobicContact CD2-CZ3 4.09Å; L752-I794 HydrophobicContact CB-CD1 3.95Å; L752-I794 HydrophobicContact CD1-CD1 4.21Å; L752-I794 HydrophobicContact CD2-CD1 4.38Å; L752-I794 HydrophobicContact CG-CD1 4.43Å
753	F	89.4	Confident	90.7	Very high	13 Å²	13	7.5 Å²	7.5	6%	0.057	4%	0.042	C	C	.	.			trans	-122.8	136.1	173.5	-168.3	-108.9	0	0	0	110.3	H681 V732 T733 N755 V758 L759 I794	H681-F753 AromaticContact CE1-CD2 4Å; H681-F753 AromaticContact CE1-CE2 3.57Å; H681-F753 AromaticContact ND1-CD2 3.65Å; H681-F753 AromaticContact ND1-CE2 3.68Å; V732-F753 HydrophobicContact CG1-CB 3.92Å; V732-F753 HydrophobicContact CG1-CD1 4.45Å; V732-F753 HydrophobicContact CG1-CG 4.07Å; T733-F753 HydrophobicContact CG2-CE1 4.32Å; T733-F753 HydrophobicContact CG2-CE2 3.87Å; T733-F753 HydrophobicContact CG2-CZ 3.76Å; F753-N755 HydrophobicContact CD1-CB 3.9Å; F753-N755 HydrophobicContact CE1-CB 3.76Å; F753-N755 PolarHBondContact O-N 2.89Å; F753-V758 HydrophobicContact CD1-CB 3.85Å; F753-V758 HydrophobicContact CD1-CG1 3.97Å; F753-V758 HydrophobicContact CD1-CG2 4.15Å; F753-V758 HydrophobicContact CE1-CB 4.09Å; F753-V758 HydrophobicContact CE1-CG1 4.21Å; F753-V758 HydrophobicContact CE1-CG2 3.88Å; F753-L759 HydrophobicContact CB-CD2 3.98Å; F753-L759 HydrophobicContact CB-CG 4.45Å; F753-I794 VanDerWaalsContact O-CD1 3.25Å; F753-I794 WeakPolarHBondContact O-CD1 3.4Å
754	W	85.6	Confident	90.5	Very high	12 Å²	12	6.2 Å²	6.2	5%	0.045	3%	0.032	C	C	.	.	S	Bend	trans	-65.5	-10.6	-169.7	53.4	91.7	0	0	0	115.4	Y650 L790 K797 F838 E846 M850	Y650-W754 HydrophobicContact CD1-CZ3 4.37Å; Y650-W754 AromaticContact CE1-CZ3 3.73Å; Y650-W754 HydrophobicContact CE1-CZ3 3.73Å; Y650-W754 AromaticContact CZ-CZ3 3.94Å; W754-L790 HydrophobicContact CB-CD2 3.97Å; W754-K797 PolarHBondContact O-NZ 3.31Å; W754-F838 HydrophobicContact CB-CD2 4.02Å; W754-F838 HydrophobicContact CB-CE2 4.25Å; W754-F838 HydrophobicContact CB-CG 4.49Å; W754-F838 AromaticContact CD1-CD1 3.76Å; W754-F838 AromaticContact CD1-CD2 3.95Å; W754-F838 AromaticContact CD1-CG 3.55Å; W754-F838 AromaticContact CD2-CD1 3.98Å; W754-F838 HydrophobicContact CD2-CD1 3.98Å; W754-F838 HydrophobicContact CD2-CD2 4.09Å; W754-F838 AromaticContact CD2-CE1 3.75Å; W754-F838 HydrophobicContact CD2-CE1 3.75Å; W754-F838 AromaticContact CD2-CE2 3.85Å; W754-F838 HydrophobicContact CD2-CE2 3.85Å; W754-F838 HydrophobicContact CD2-CG 4.14Å; W754-F838 AromaticContact CD2-CZ 3.68Å; W754-F838 HydrophobicContact CD2-CZ 3.68Å; W754-F838 AromaticContact CE2-CD1 3.51Å; W754-F838 AromaticContact CE2-CE1 3.4Å; W754-F838 AromaticContact CE2-CZ 3.84Å; W754-F838 HydrophobicContact CE3-CE1 4.12Å; W754-F838 HydrophobicContact CE3-CE2 4.01Å; W754-F838 AromaticContact CE3-CZ 3.7Å; W754-F838 HydrophobicContact CE3-CZ 3.7Å; W754-F838 HydrophobicContact CG-CB 4.35Å; W754-F838 HydrophobicContact CG-CD1 4.13Å; W754-F838 AromaticContact CG-CD2 3.77Å; W754-F838 HydrophobicContact CG-CD2 3.77Å; W754-F838 HydrophobicContact CG-CE1 4.34Å; W754-F838 AromaticContact CG-CE2 3.97Å; W754-F838 HydrophobicContact CG-CE2 3.97Å; W754-F838 AromaticContact CG-CG 3.84Å; W754-F838 HydrophobicContact CG-CG 3.84Å; W754-F838 HydrophobicContact CG-CZ 4.26Å; W754-F838 AromaticContact CH2-CE1 3.84Å; W754-F838 HydrophobicContact CH2-CE1 3.84Å; W754-F838 HydrophobicContact CH2-CZ 4.03Å; W754-F838 AromaticContact CZ2-CD1 3.93Å; W754-F838 HydrophobicContact CZ2-CD1 3.93Å; W754-F838 AromaticContact CZ2-CE1 3.45Å; W754-F838 HydrophobicContact CZ2-CE1 3.45Å; W754-F838 VanDerWaalsContact CZ2-CE1 3.45Å; W754-F838 HydrophobicContact CZ2-CZ 4.03Å; W754-F838 HydrophobicContact CZ3-CE1 4.15Å; W754-F838 AromaticContact CZ3-CZ 3.88Å; W754-F838 HydrophobicContact CZ3-CZ 3.88Å; W754-F838 AromaticContact NE1-CD1 3.35Å; W754-F838 VanDerWaalsContact NE1-CD1 3.35Å; W754-F838 AromaticContact NE1-CE1 3.78Å; W754-F838 AromaticContact NE1-CG 3.67Å; W754-E846 WeakPolarHBondContact CZ2-OE1 3.3Å; W754-E846 PolarHBondContact NE1-OE1 3.18Å; W754-M850 HydrophobicContact CH2-CE 3.97Å; W754-M850 HydrophobicContact CH2-SD 3.8Å; W754-M850 HydrophobicContact CZ2-CE 4.32Å
755	N	86.7	Confident	90.3	Very high	21 Å²	21	6.3 Å²	6.3	11%	0.112	3%	0.032	C	C	.	.			trans	-111.5	110.8	179.2	-174	-29.7	0	0	0	110.3	M529 F753 G757 V758	M529-N755 WeakPolarHBondContact CB-OD1 3.49Å; M529-N755 PolarHBondContact O-OD1 3.49Å; F753-N755 HydrophobicContact CD1-CB 3.9Å; F753-N755 HydrophobicContact CE1-CB 3.76Å; F753-N755 PolarHBondContact O-N 2.89Å; N755-G757 VanDerWaalsContact C-N 3.33Å; N755-G757 PolarHBondContact O-N 2.99Å; N755-G757 PolarHBondContact OD1-N 2.55Å; N755-V758 HydrophobicContact CB-CG2 4.3Å; N755-V758 PolarHBondContact O-N 2.86Å
756	P	88.5	Confident	90.1	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-69.5	-25.7	-176.5	26.7	-33	0	0	0	114	M529 V758 L759 I760 I794 K797 M798 L801	M529-P756 WeakPolarHBondContact O-CG 3.4Å; P756-V758 PolarHBondContact O-N 2.81Å; P756-L759 PolarHBondContact O-N 2.98Å; P756-L759 VanDerWaalsContact O-N 3.08Å; P756-I760 WeakPolarHBondContact O-CG1 3.41Å; P756-I760 PolarHBondContact O-N 2.9Å; P756-I794 HydrophobicContact CB-CG2 4.31Å; P756-K797 HydrophobicContact CG-CB 3.72Å; P756-M798 HydrophobicContact CB-CG 3.27Å; P756-M798 HydrophobicContact CB-SD 3.74Å; P756-M798 HydrophobicContact CG-CG 3.87Å; P756-L801 HydrophobicContact CG-CD1 4.03Å
757	G	86.8	Confident	89.6	Confident	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-57.2	-37.7	175.3	0	0	0	0	0	112.3	M529 N755 Q761	M529-G757 PolarHBondContact O-N 2.88Å; N755-G757 VanDerWaalsContact C-N 3.33Å; N755-G757 PolarHBondContact O-N 2.99Å; N755-G757 PolarHBondContact OD1-N 2.55Å; G757-Q761 WeakPolarHBondContact O-CB 3.19Å; G757-Q761 WeakPolarHBondContact O-CG 3.49Å; G757-Q761 PolarHBondContact O-N 2.93Å
758	V	88.4	Confident	88.9	Confident	11 Å²	11	6.5 Å²	6.5	7%	0.067	3%	0.03	C	C	.	.	H	α-helix	trans	-69.5	-39.1	175.5	179.3	0	0	0	0	111.6	V732 N736 F753 N755 P756 Q761 A762	V732-V758 HydrophobicContact CG1-CG1 3.61Å; N736-V758 PolarHBondContact OD1-O 3.43Å; F753-V758 HydrophobicContact CD1-CB 3.85Å; F753-V758 HydrophobicContact CD1-CG1 3.97Å; F753-V758 HydrophobicContact CD1-CG2 4.15Å; F753-V758 HydrophobicContact CE1-CB 4.09Å; F753-V758 HydrophobicContact CE1-CG1 4.21Å; F753-V758 HydrophobicContact CE1-CG2 3.88Å; N755-V758 HydrophobicContact CB-CG2 4.3Å; N755-V758 PolarHBondContact O-N 2.86Å; P756-V758 PolarHBondContact O-N 2.81Å; V758-Q761 PolarHBondContact O-N 2.93Å; V758-A762 WeakPolarHBondContact O-CB 3.35Å; V758-A762 PolarHBondContact O-N 2.97Å
759	L	89.5	Confident	87.9	Confident	1 Å²	1	10.8 Å²	10.8	1%	0.005	5%	0.052	C	C	.	.	H	α-helix	trans	-64.6	-45.3	175.3	-60.9	177.6	0	0	0	111.2	F749 F753 P756 Q761 A762 E763 I794	F749-L759 HydrophobicContact CD1-CD2 3.74Å; F749-L759 HydrophobicContact CE1-CD2 3.59Å; F749-L759 HydrophobicContact CZ-CB 4.48Å; F749-L759 HydrophobicContact CZ-CD2 4.25Å; F753-L759 HydrophobicContact CB-CD2 3.98Å; F753-L759 HydrophobicContact CB-CG 4.45Å; P756-L759 PolarHBondContact O-N 2.98Å; P756-L759 VanDerWaalsContact O-N 3.08Å; L759-Q761 PolarHBondContact O-N 2.67Å; L759-A762 WeakPolarHBondContact O-CB 3.37Å; L759-A762 PolarHBondContact O-N 2.85Å; L759-A762 VanDerWaalsContact O-N 3.16Å; L759-E763 WeakPolarHBondContact O-CG 3.3Å; L759-E763 PolarHBondContact O-N 3.38Å; L759-I794 HydrophobicContact CD1-CD1 4.18Å; L759-I794 HydrophobicContact CD1-CG2 3.96Å
760	I	87.2	Confident	87	Confident	15 Å²	15	12.9 Å²	12.9	8%	0.077	7%	0.074	C	C	.	.	H	α-helix	trans	-60.3	-45.1	174.7	-64	162.6	0	0	0	110.5	T526 P756 A762 E763 D764 M798 L801	T526-I760 HydrophobicContact CG2-CG2 4.2Å; P756-I760 WeakPolarHBondContact O-CG1 3.41Å; P756-I760 PolarHBondContact O-N 2.9Å; I760-A762 PolarHBondContact O-N 3.3Å; I760-E763 PolarHBondContact O-N 2.96Å; I760-D764 WeakPolarHBondContact O-CB 3.46Å; I760-D764 PolarHBondContact O-N 2.86Å; I760-M798 HydrophobicContact CD1-CE 4.13Å; I760-M798 HydrophobicContact CG1-CE 4.16Å; I760-L801 HydrophobicContact CD1-CD1 4.39Å
761	Q	87.9	Confident	86.3	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64	-26	177	-77	-178.9	33.6	0	0	113.7	M404 H497 T526 N736 G757 V758 L759 R765	M404-Q761 HydrophobicContact CE-CB 3.86Å; M404-Q761 HydrophobicContact CE-CG 3.71Å; M404-Q761 HydrophobicContact SD-CB 4.09Å; M404-Q761 HydrophobicContact SD-CG 3.62Å; H497-Q761 PolarHBondContact CE1-NE2 3.22Å; H497-Q761 PolarHBondContact NE2-NE2 2.94Å; T526-Q761 HydrophobicContact CG2-CG 4.21Å; T526-Q761 PolarHBondContact OG1-NE2 2.6Å; N736-Q761 VanDerWaalsContact CG-OE1 3.26Å; N736-Q761 PolarHBondContact ND2-OE1 2.83Å; N736-Q761 PolarHBondContact O-OE1 3.19Å; N736-Q761 WeakPolarHBondContact OD1-CB 3.25Å; N736-Q761 PolarHBondContact OD1-OE1 2.99Å; G757-Q761 WeakPolarHBondContact O-CB 3.19Å; G757-Q761 WeakPolarHBondContact O-CG 3.49Å; G757-Q761 PolarHBondContact O-N 2.93Å; V758-Q761 PolarHBondContact O-N 2.93Å; L759-Q761 PolarHBondContact O-N 2.67Å; Q761-R765 PolarHBondContact O-NE 2.78Å
762	A	89.6	Confident	85.6	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-81.6	-42.1	174.7	0	0	0	0	0	112.9	F679 F749 V758 L759 I760 D764 R765	F679-A762 HydrophobicContact CD1-CB 4.24Å; F679-A762 HydrophobicContact CD2-CB 4.31Å; F679-A762 HydrophobicContact CE1-CB 3.85Å; F679-A762 HydrophobicContact CE2-CB 3.94Å; F679-A762 HydrophobicContact CG-CB 4.46Å; F679-A762 HydrophobicContact CZ-CB 3.69Å; F749-A762 HydrophobicContact CE1-CB 3.82Å; F749-A762 HydrophobicContact CZ-CB 3.78Å; V758-A762 WeakPolarHBondContact O-CB 3.35Å; V758-A762 PolarHBondContact O-N 2.97Å; L759-A762 WeakPolarHBondContact O-CB 3.37Å; L759-A762 PolarHBondContact O-N 2.85Å; L759-A762 VanDerWaalsContact O-N 3.16Å; I760-A762 PolarHBondContact O-N 3.3Å; A762-D764 VanDerWaalsContact C-N 3.28Å; A762-D764 PolarHBondContact O-N 3.08Å; A762-R765 VanDerWaalsContact O-CB 3.32Å; A762-R765 WeakPolarHBondContact O-CB 3.46Å; A762-R765 VanDerWaalsContact O-CG 3.25Å; A762-R765 WeakPolarHBondContact O-CG 3.29Å; A762-R765 PolarHBondContact O-N 3.41Å
763	E	89	Confident	85.2	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-55.4	-45.5	170	-66.7	168.1	-157.7	0	0	111.4	K605 R607 F749 L759 I760 R765 V766 H767 I777 Y779	K605-E763 HydrophobicContact CD-CB 4.2Å; K605-E763 WeakPolarHBondContact CE-OE2 3.4Å; K605-E763 IonicContact NZ-OE2 3.28Å; K605-E763 PolarHBondContact NZ-OE2 3.13Å; R607-E763 IonicContact CZ-OE1 3.58Å; R607-E763 IonicContact CZ-OE2 2.67Å; R607-E763 IonicContact NE-OE1 2.64Å; R607-E763 PolarHBondContact NE-OE1 3.1Å; R607-E763 IonicContact NE-OE2 2.64Å; R607-E763 PolarHBondContact NE-OE2 3.1Å; R607-E763 IonicContact NH2-OE1 3.66Å; R607-E763 PolarHBondContact NH2-OE1 2.86Å; R607-E763 IonicContact NH2-OE2 2.6Å; R607-E763 PolarHBondContact NH2-OE2 3.04Å; F749-E763 HydrophobicContact CE2-CG 3.97Å; F749-E763 HydrophobicContact CZ-CG 4.19Å; L759-E763 WeakPolarHBondContact O-CG 3.3Å; L759-E763 PolarHBondContact O-N 3.38Å; I760-E763 PolarHBondContact O-N 2.96Å; E763-R765 PolarHBondContact O-N 3.41Å; E763-V766 PolarHBondContact O-N 3.48Å; E763-H767 PolarHBondContact O-N 3.42Å; E763-I777 HydrophobicContact CB-CD1 4.18Å; E763-I777 HydrophobicContact CG-CD1 4.01Å; E763-I777 HydrophobicContact CG-CG1 4.19Å; E763-I777 HydrophobicContact CG-CG2 4.04Å; E763-Y779 PolarHBondContact OE1-OH 3.43Å
764	D	87.1	Confident	85.1	Confident	5 Å²	5	25.2 Å²	25.2	3%	0.027	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	17.9	-177.6	-79.9	12.5	0	0	0	113.3	M404 K595 K605 I760 A762 R768	M404-D764 HydrophobicContact CB-CB 3.9Å; M404-D764 HydrophobicContact CE-CB 4.26Å; M404-D764 HydrophobicContact CG-CB 4.48Å; M404-D764 HydrophobicContact SD-CB 3.88Å; K595-D764 IonicContact NZ-OD1 3.95Å; K595-D764 PolarHBondContact NZ-OD1 3.43Å; K595-D764 IonicContact NZ-OD2 2.71Å; K595-D764 PolarHBondContact NZ-OD2 2.95Å; K605-D764 IonicContact NZ-OD1 2.68Å; K605-D764 PolarHBondContact NZ-OD1 3.24Å; I760-D764 WeakPolarHBondContact O-CB 3.46Å; I760-D764 PolarHBondContact O-N 2.86Å; A762-D764 VanDerWaalsContact C-N 3.28Å; A762-D764 PolarHBondContact O-N 3.08Å; D764-R768 WeakPolarHBondContact O-CG 3.34Å; D764-R768 PolarHBondContact O-NE 3.43Å
765	R	86.7	Confident	85.3	Confident	3 Å²	3	24.7 Å²	24.7	1%	0.011	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-31.9	159.5	-57.5	-65.4	132	-167.7	7	111.8	F679 N736 L739 L741 Q761 A762 E763 R768	F679-R765 HydrophobicContact CZ-CG 4.35Å; N736-R765 PolarHBondContact O-NH2 2.85Å; L739-R765 WeakPolarHBondContact O-CD 3.27Å; L739-R765 PolarHBondContact O-NH1 2.64Å; L741-R765 PolarHBondContact N-O 3.35Å; Q761-R765 PolarHBondContact O-NE 2.78Å; A762-R765 VanDerWaalsContact O-CB 3.32Å; A762-R765 WeakPolarHBondContact O-CB 3.46Å; A762-R765 VanDerWaalsContact O-CG 3.25Å; A762-R765 WeakPolarHBondContact O-CG 3.29Å; A762-R765 PolarHBondContact O-N 3.41Å; E763-R765 PolarHBondContact O-N 3.41Å; R765-R768 VanDerWaalsContact NH1-NH2 3.16Å
766	V	86.8	Confident	85.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-43.4	180	-178.1	0	0	0	0	111.8	L677 A744 V747 E763 R768 Q771 V775	L677-V766 HydrophobicContact CD1-CG2 3.23Å; L677-V766 HydrophobicContact CD2-CG2 4.41Å; L677-V766 HydrophobicContact CG-CG2 3.65Å; A744-V766 HydrophobicContact CB-CG1 4.17Å; A744-V766 HydrophobicContact CB-CG2 4.18Å; A744-V766 WeakPolarHBondContact O-CG1 3.22Å; V747-V766 HydrophobicContact CG2-CB 4.07Å; V747-V766 HydrophobicContact CG2-CG2 3.51Å; E763-V766 PolarHBondContact O-N 3.48Å; V766-R768 VanDerWaalsContact C-N 3.33Å; V766-R768 PolarHBondContact O-N 3.42Å; V766-Q771 PolarHBondContact O-NE2 3.2Å; V766-V775 HydrophobicContact CB-CG1 4.18Å; V766-V775 HydrophobicContact CG1-CG1 3.76Å; V766-V775 HydrophobicContact CG1-CG2 4.04Å
767	H	83.4	Confident	85.7	Confident	10 Å²	10	25.4 Å²	25.4	5%	0.046	15%	0.151	C	C	.	.	S	Bend	trans	-79	81.6	179.3	-166.4	-112.3	0	0	0	110.1	K595 P603 K605 E763 V775	K595-H767 WeakPolarHBondContact CD-CE1 3.34Å; K595-H767 WeakPolarHBondContact CD-ND1 3.28Å; K595-H767 PolarHBondContact NZ-ND1 3.5Å; K595-H767 VanDerWaalsContact NZ-ND1 3.16Å; K595-H767 PolarHBondContact NZ-O 2.76Å; P603-H767 PolarHBondContact O-NE2 2.87Å; K605-H767 HydrophobicContact CD-CB 4.16Å; E763-H767 PolarHBondContact O-N 3.42Å; H767-V775 HydrophobicContact CB-CG2 4.42Å
768	R	80.4	Confident	86.1	Confident	39 Å²	39	26.2 Å²	26.2	15%	0.147	15%	0.154	C	C	.	.	S	Bend	trans	-139.5	164.3	-177	-71.9	-172.8	168.4	-138.7	-17.8	111.3	L602 L739 T740 D764 R765 V766 G770 Q771	L602-R768 WeakPolarHBondContact CD2-O 3.49Å; L739-R768 PolarHBondContact O-NH1 2.88Å; T740-R768 PolarHBondContact OG1-NH1 2.93Å; D764-R768 WeakPolarHBondContact O-CG 3.34Å; D764-R768 PolarHBondContact O-NE 3.43Å; R765-R768 VanDerWaalsContact NH1-NH2 3.16Å; V766-R768 VanDerWaalsContact C-N 3.33Å; V766-R768 PolarHBondContact O-N 3.42Å; R768-G770 PolarHBondContact O-N 3.27Å; R768-Q771 WeakPolarHBondContact O-CB 3.31Å; R768-Q771 PolarHBondContact O-N 2.82Å
769	I	75.3	Confident	86.4	Confident	90 Å²	90	25.8 Å²	25.8	46%	0.462	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	129.1	165.9	-56.3	175.7	0	0	0	108.4	G405 L599	G405-I769 WeakPolarHBondContact O-CD1 3.29Å; L599-I769 HydrophobicContact CD1-CD1 4.06Å; L599-I769 HydrophobicContact CD1-CG1 3.81Å
770	G	76.4	Confident	86.6	Confident	45 Å²	45	25.8 Å²	25.8	46%	0.464	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.1	-14.6	-169.1	0	0	0	0	0	114.4	H742 R768	H742-G770 PolarHBondContact CD2-O 2.93Å; R768-G770 PolarHBondContact O-N 3.27Å
771	Q	81.7	Confident	87	Confident	15 Å²	15	25.1 Å²	25.1	7%	0.07	15%	0.148	C	C	.	.			trans	-73.8	131.6	169.9	-179	56.8	-97.5	0	0	111.2	P603 H742 A744 V766 R768 S773 V775	P603-Q771 HydrophobicContact CG-CG 4.49Å; H742-Q771 HydrophobicContact CB-CB 4.41Å; H742-Q771 PolarHBondContact O-NE2 3.3Å; H742-Q771 VanDerWaalsContact O-NE2 3.11Å; A744-Q771 PolarHBondContact O-NE2 2.79Å; V766-Q771 PolarHBondContact O-NE2 3.2Å; R768-Q771 WeakPolarHBondContact O-CB 3.31Å; R768-Q771 PolarHBondContact O-N 2.82Å; Q771-S773 VanDerWaalsContact CG-O 3.29Å; Q771-S773 WeakPolarHBondContact CG-O 3.34Å; Q771-S773 PolarHBondContact OE1-O 2.94Å; Q771-V775 HydrophobicContact CG-CG2 3.76Å
772	T	80.2	Confident	87.1	Confident	127 Å²	127	25.1 Å²	25.1	78%	0.779	15%	0.148	S	C	*	.			trans	-114.9	-17.7	179.3	54.2	0	0	0	0	113.8	P603	P603-T772 WeakPolarHBondContact CG-O 3.09Å
773	S	83.6	Confident	87	Confident	53 Å²	53	29.8 Å²	29.8	37%	0.371	17%	0.169	S	C	.	.	S	Bend	trans	-104.4	152.7	179.8	-67.8	0	0	0	0	112.3	P603 Q771	P603-S773 WeakPolarHBondContact CB-O 3.33Å; P603-S773 WeakPolarHBondContact CG-O 3.44Å; Q771-S773 VanDerWaalsContact CG-O 3.29Å; Q771-S773 WeakPolarHBondContact CG-O 3.34Å; Q771-S773 PolarHBondContact OE1-O 2.94Å
774	N	86.1	Confident	86.8	Confident	83 Å²	83	32.3 Å²	32.3	44%	0.444	20%	0.195	S	C	.	.			trans	-57.6	141.8	166.2	-69.4	-59.5	0	0	0	109.5	S604	S604-N774 PolarHBondContact N-OD1 3.04Å; S604-N774 WeakPolarHBondContact O-CA 3.26Å; S604-N774 PolarHBondContact OG-OD1 2.95Å
775	V	89.4	Confident	87	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	111.5	-174.9	-174.9	0	0	0	0	110	S604 K605 Q606 D745 V747 V766 H767 Q771 I777	S604-V775 PolarHBondContact O-N 3.11Å; K605-V775 CarbonylContact C-O 3.36Å; K605-V775 WeakPolarHBondContact CA-O 3.14Å; Q606-V775 PolarHBondContact N-O 2.74Å; D745-V775 CarbonylContact O-C 3.48Å; D745-V775 WeakPolarHBondContact O-CA 3.48Å; V747-V775 HydrophobicContact CG2-CG1 4.48Å; V766-V775 HydrophobicContact CB-CG1 4.18Å; V766-V775 HydrophobicContact CG1-CG1 3.76Å; V766-V775 HydrophobicContact CG1-CG2 4.04Å; H767-V775 HydrophobicContact CB-CG2 4.42Å; Q771-V775 HydrophobicContact CG-CG2 3.76Å; V775-I777 HydrophobicContact CG1-CD1 3.71Å
776	D	91.1	Very high	87.2	Confident	36 Å²	36	32 Å²	32	19%	0.193	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	125.3	175.3	-67.8	-40.2	0	0	0	110.1	R673 D745 L746 V747	R673-D776 IonicContact CZ-OD2 3.87Å; R673-D776 IonicContact NH1-OD2 2.75Å; R673-D776 PolarHBondContact NH1-OD2 3.4Å; R673-D776 IonicContact NH2-OD2 3.15Å; R673-D776 PolarHBondContact NH2-OD2 3.01Å; D745-D776 PolarHBondContact O-N 2.87Å; L746-D776 CarbonylContact C-O 3.57Å; L746-D776 WeakPolarHBondContact CA-O 3.41Å; L746-D776 HydrophobicContact CD1-CB 3.87Å; V747-D776 PolarHBondContact N-O 3.35Å
777	I	93.1	Very high	87.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	112.7	176	-48.2	-61.4	0	0	0	108.8	K605 Q606 R607 K608 V747 F749 E763 V775 Y779	K605-I777 HydrophobicContact CD-CD1 4.15Å; K605-I777 HydrophobicContact CD-CG1 3.95Å; K605-I777 HydrophobicContact CG-CD1 4.28Å; K605-I777 HydrophobicContact CG-CG1 3.73Å; Q606-I777 WeakPolarHBondContact O-CB 3.33Å; Q606-I777 PolarHBondContact O-N 2.98Å; R607-I777 HydrophobicContact CG-CB 4.14Å; R607-I777 HydrophobicContact CG-CG1 4.38Å; K608-I777 PolarHBondContact N-O 2.72Å; V747-I777 HydrophobicContact CB-CD1 3.68Å; V747-I777 HydrophobicContact CG1-CD1 4.42Å; V747-I777 HydrophobicContact CG2-CD1 3.73Å; F749-I777 HydrophobicContact CD2-CG2 3.92Å; F749-I777 HydrophobicContact CE2-CG2 3.71Å; E763-I777 HydrophobicContact CB-CD1 4.18Å; E763-I777 HydrophobicContact CG-CD1 4.01Å; E763-I777 HydrophobicContact CG-CG1 4.19Å; E763-I777 HydrophobicContact CG-CG2 4.04Å; V775-I777 HydrophobicContact CG1-CD1 3.71Å; I777-Y779 HydrophobicContact CG2-CE1 4.13Å; I777-Y779 HydrophobicContact CG2-CE2 3.85Å
778	H	94.6	Very high	87.5	Confident	17 Å²	17	33 Å²	33	8%	0.079	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	118.6	-179.4	-65.7	175.3	0	0	0	110.7	K608 V610 Y664 L746 V747 I748 F749	K608-H778 WeakPolarHBondContact O-CA 3.48Å; V610-H778 HydrophobicContact CG2-CB 4.12Å; Y664-H778 AromaticContact CZ-ND1 3.85Å; Y664-H778 PolarHBondContact OH-CE1 3.38Å; Y664-H778 PolarHBondContact OH-ND1 3.48Å; L746-H778 WeakPolarHBondContact CD1-ND1 3.45Å; V747-H778 PolarHBondContact O-N 3.1Å; I748-H778 CarbonylContact C-O 3.54Å; I748-H778 WeakPolarHBondContact CA-O 3.47Å; F749-H778 PolarHBondContact N-O 3.23Å
779	Y	94.8	Very high	87.7	Confident	3 Å²	3	32.1 Å²	32.1	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.6	170.7	-48	-91.5	0	0	0	109.5	R607 K608 V610 F749 L752 E763 I777 W791	R607-Y779 HydrophobicContact CB-CE2 4.1Å; R607-Y779 VanDerWaalsContact CD-OH 3.28Å; R607-Y779 WeakPolarHBondContact CD-OH 3.32Å; R607-Y779 HydrophobicContact CG-CE2 4.13Å; R607-Y779 PolarHBondContact NE-OH 2.92Å; K608-Y779 PolarHBondContact O-N 2.78Å; V610-Y779 PolarHBondContact N-O 3.2Å; F749-Y779 HydrophobicContact CB-CD1 3.84Å; F749-Y779 AromaticContact CD2-CD1 3.48Å; F749-Y779 HydrophobicContact CD2-CD1 3.48Å; F749-Y779 VanDerWaalsContact CD2-CD1 3.48Å; F749-Y779 AromaticContact CD2-CE1 3.41Å; F749-Y779 HydrophobicContact CD2-CE1 3.41Å; F749-Y779 VanDerWaalsContact CD2-CE1 3.41Å; F749-Y779 HydrophobicContact CD2-CG 4.42Å; F749-Y779 HydrophobicContact CE2-CD1 4.26Å; F749-Y779 AromaticContact CE2-CE1 3.71Å; F749-Y779 HydrophobicContact CE2-CE1 3.71Å; F749-Y779 AromaticContact CG-CD1 3.83Å; F749-Y779 HydrophobicContact CG-CD1 3.83Å; F749-Y779 HydrophobicContact CG-CE1 4.08Å; L752-Y779 HydrophobicContact CD2-CD1 4.18Å; L752-Y779 HydrophobicContact CD2-CG 4.47Å; E763-Y779 PolarHBondContact OE1-OH 3.43Å; I777-Y779 HydrophobicContact CG2-CE1 4.13Å; I777-Y779 HydrophobicContact CG2-CE2 3.85Å; Y779-W791 HydrophobicContact CD1-CZ3 4.02Å; Y779-W791 AromaticContact CD2-CH2 3.68Å; Y779-W791 HydrophobicContact CD2-CH2 3.68Å; Y779-W791 AromaticContact CD2-CZ3 3.82Å; Y779-W791 HydrophobicContact CD2-CZ3 3.82Å; Y779-W791 HydrophobicContact CE1-CZ3 4.46Å; Y779-W791 AromaticContact CE2-CH2 3.94Å; Y779-W791 HydrophobicContact CE2-CH2 3.94Å; Y779-W791 HydrophobicContact CE2-CZ3 4.27Å; Y779-W791 HydrophobicContact CG-CH2 4.05Å; Y779-W791 AromaticContact CG-CZ3 3.68Å; Y779-W791 HydrophobicContact CG-CZ3 3.68Å
780	L	95.3	Very high	88.3	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	120.5	178.7	-52.3	-167.6	0	0	0	109.7	V610 V612 K657 I661 Y664 I748 F749	V610-L780 HydrophobicContact CB-CD2 3.73Å; V610-L780 HydrophobicContact CG1-CD2 3.94Å; V610-L780 HydrophobicContact CG2-CD2 4.31Å; V610-L780 WeakPolarHBondContact O-CA 3.44Å; V612-L780 HydrophobicContact CG1-CB 4.27Å; V612-L780 HydrophobicContact CG1-CD2 4.37Å; K657-L780 PolarHBondContact NZ-O 3.48Å; I661-L780 HydrophobicContact CB-CD1 4.41Å; I661-L780 HydrophobicContact CG1-CD1 4.17Å; I661-L780 HydrophobicContact CG2-CD1 3.7Å; Y664-L780 HydrophobicContact CD1-CD1 3.9Å; Y664-L780 HydrophobicContact CD1-CD2 3.7Å; Y664-L780 HydrophobicContact CD1-CG 4.43Å; Y664-L780 HydrophobicContact CE1-CD2 3.78Å; Y664-L780 HydrophobicContact CG-CD1 4.22Å; Y664-L780 HydrophobicContact CG-CD2 4.12Å; I748-L780 HydrophobicContact CG2-CD1 3.84Å; I748-L780 HydrophobicContact CG2-CD2 4.14Å; I748-L780 HydrophobicContact CG2-CG 3.85Å; F749-L780 PolarHBondContact O-N 3.48Å
781	V	93.8	Very high	88.9	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.006	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	137.6	-177.5	-58.3	0	0	0	0	111.8	V609 V610 T611 V612 L752 D787 F820	V609-V781 HydrophobicContact CG1-CB 4.44Å; V609-V781 HydrophobicContact CG1-CG1 4.17Å; V609-V781 HydrophobicContact CG1-CG2 3.38Å; V610-V781 PolarHBondContact O-N 3.21Å; T611-V781 CarbonylContact C-O 3.58Å; T611-V781 VanDerWaalsContact CA-O 3.29Å; T611-V781 WeakPolarHBondContact CA-O 3.2Å; V612-V781 PolarHBondContact N-O 3.5Å; L752-V781 HydrophobicContact CD1-CG1 3.91Å; L752-V781 HydrophobicContact CD2-CG1 4.44Å; L752-V781 HydrophobicContact CG-CG1 4.34Å; V781-D787 WeakPolarHBondContact CA-OD2 3.5Å; V781-D787 HydrophobicContact CB-CB 4.04Å; V781-D787 HydrophobicContact CG1-CB 4.41Å; V781-F820 HydrophobicContact CG2-CE1 4.37Å; V781-F820 HydrophobicContact CG2-CE2 4.28Å; V781-F820 HydrophobicContact CG2-CZ 3.7Å
782	A	91.6	Very high	89.1	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130	-179.4	0	0	0	0	0	111.8	V612 I614 K657 T785 D787	V612-A782 HydrophobicContact CG2-CB 4.12Å; I614-A782 HydrophobicContact CG2-CB 3.74Å; K657-A782 HydrophobicContact CD-CB 3.97Å; K657-A782 HydrophobicContact CG-CB 3.73Å; A782-T785 HydrophobicContact CB-CG2 3.69Å; A782-T785 PolarHBondContact O-OG1 3.27Å; A782-D787 PolarHBondContact N-OD2 3.5Å
783	K	87.8	Confident	89.3	Confident	99 Å²	99	20.8 Å²	20.8	43%	0.43	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	144.6	174.2	-70.3	-173	168.3	-167.5	0	111.6	T611 I614 S819 F820	T611-K783 HydrophobicContact CG2-CG 4.28Å; I614-K783 WeakPolarHBondContact CD1-O 3.3Å; K783-S819 VanDerWaalsContact CE-O 3.27Å; K783-S819 WeakPolarHBondContact CE-O 3.49Å; K783-S819 PolarHBondContact NZ-O 3.47Å; K783-F820 HydrophobicContact CD-CE1 4.39Å; K783-F820 HydrophobicContact CD-CZ 4.38Å; K783-F820 HydrophobicContact CG-CE1 3.64Å; K783-F820 HydrophobicContact CG-CZ 3.84Å
784	G	84.8	Confident	89.5	Confident	53 Å²	53	18.3 Å²	18.3	55%	0.546	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	25.1	-172.1	0	0	0	0	0	113.4	D788	G784-D788 WeakPolarHBondContact CA-OD2 3.44Å; G784-D788 PolarHBondContact N-OD2 3.32Å
785	T	90.5	Very high	89.5	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.006	9%	0.089	C	C	.	.	S	Bend	trans	-140.5	179.4	-173.4	82.6	0	0	0	0	112.7	I614 L625 F649 T653 A782 D787 D788	I614-T785 HydrophobicContact CD1-CG2 3.79Å; L625-T785 HydrophobicContact CD1-CG2 4.33Å; F649-T785 VanDerWaalsContact CZ-C 3.46Å; T653-T785 HydrophobicContact CG2-CG2 4.36Å; T653-T785 WeakPolarHBondContact CG2-OG1 3.21Å; A782-T785 HydrophobicContact CB-CG2 3.69Å; A782-T785 PolarHBondContact O-OG1 3.27Å; T785-D787 PolarHBondContact O-N 2.92Å; T785-D787 VanDerWaalsContact O-N 3.12Å; T785-D787 PolarHBondContact OG1-N 2.73Å; T785-D788 PolarHBondContact N-OD2 2.86Å; T785-D788 VanDerWaalsContact N-OD2 3.15Å; T785-D788 PolarHBondContact O-N 2.98Å
786	A	89.6	Confident	89.3	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.9	175.2	0	0	0	0	0	113.7	F649 T653 D788 H789 L790 F834	F649-A786 HydrophobicContact CD1-CB 3.92Å; F649-A786 HydrophobicContact CE1-CB 3.89Å; F649-A786 HydrophobicContact CZ-CB 4.47Å; T653-A786 HydrophobicContact CG2-CB 4.11Å; T653-A786 WeakPolarHBondContact OG1-CB 3.35Å; T653-A786 PolarHBondContact OG1-N 3.33Å; A786-D788 PolarHBondContact O-N 2.72Å; A786-H789 PolarHBondContact O-N 3.18Å; A786-H789 VanDerWaalsContact O-N 3.1Å; A786-L790 HydrophobicContact CB-CD1 4.12Å; A786-L790 WeakPolarHBondContact O-CB 3.48Å; A786-L790 WeakPolarHBondContact O-CG 3.46Å; A786-L790 PolarHBondContact O-N 3.31Å; A786-F834 HydrophobicContact CB-CZ 4.15Å
787	D	91.1	Very high	89.1	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.011	10%	0.102	C	C	.	.	H	α-helix	trans	-60.1	-32.7	176.9	-65.9	-36.5	0	0	0	112.7	K657 L752 V781 A782 T785 H789 L790 W791	K657-D787 WeakPolarHBondContact CD-OD2 3.44Å; K657-D787 VanDerWaalsContact CE-OD2 3.29Å; K657-D787 WeakPolarHBondContact CE-OD2 3.42Å; K657-D787 IonicContact NZ-OD1 2.72Å; K657-D787 PolarHBondContact NZ-OD1 3.19Å; K657-D787 IonicContact NZ-OD2 3.71Å; K657-D787 PolarHBondContact NZ-OD2 3.32Å; L752-D787 HydrophobicContact CD1-CB 4.25Å; V781-D787 WeakPolarHBondContact CA-OD2 3.5Å; V781-D787 HydrophobicContact CB-CB 4.04Å; V781-D787 HydrophobicContact CG1-CB 4.41Å; A782-D787 PolarHBondContact N-OD2 3.5Å; T785-D787 PolarHBondContact O-N 2.92Å; T785-D787 VanDerWaalsContact O-N 3.12Å; T785-D787 PolarHBondContact OG1-N 2.73Å; D787-H789 PolarHBondContact O-N 3.47Å; D787-H789 VanDerWaalsContact O-N 3.14Å; D787-L790 PolarHBondContact O-N 2.81Å; D787-W791 WeakPolarHBondContact O-CB 3.28Å; D787-W791 PolarHBondContact O-N 3.32Å
788	D	85.8	Confident	88.7	Confident	29 Å²	29	17.2 Å²	17.2	16%	0.155	10%	0.104	C	C	.	.	H	α-helix	trans	-64.6	-15.2	177.9	-65.7	-52.3	0	0	0	113.2	G784 T785 A786 F820 Q827	G784-D788 WeakPolarHBondContact CA-OD2 3.44Å; G784-D788 PolarHBondContact N-OD2 3.32Å; T785-D788 PolarHBondContact N-OD2 2.86Å; T785-D788 VanDerWaalsContact N-OD2 3.15Å; T785-D788 PolarHBondContact O-N 2.98Å; A786-D788 PolarHBondContact O-N 2.72Å; D788-F820 VanDerWaalsContact OD1-CD1 3.29Å; D788-F820 WeakPolarHBondContact OD1-CD1 3.32Å; D788-F820 VanDerWaalsContact OD1-CE1 3.26Å; D788-F820 WeakPolarHBondContact OD1-CE1 3.3Å; D788-Q827 PolarHBondContact O-NE2 3.2Å
789	H	84.9	Confident	88.3	Confident	20 Å²	20	19 Å²	19	9%	0.093	11%	0.114	C	C	.	.	H	α-helix	trans	-111.1	-37.2	176.6	-54.6	-92.3	0	0	0	111.7	A786 D787 M793 I830	A786-H789 PolarHBondContact O-N 3.18Å; A786-H789 VanDerWaalsContact O-N 3.1Å; D787-H789 PolarHBondContact O-N 3.47Å; D787-H789 VanDerWaalsContact O-N 3.14Å; H789-M793 WeakPolarHBondContact O-CB 3.05Å; H789-I830 HydrophobicContact CB-CG2 4.36Å; H789-I830 WeakPolarHBondContact ND1-CG2 3.49Å
790	L	87.6	Confident	88	Confident	0 Å²	0	20 Å²	20	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68	-45.3	178.5	-76.8	169.7	0	0	0	112.3	Y650 L752 W754 A786 D787 M793 I794 F834	Y650-L790 HydrophobicContact CD2-CD1 3.86Å; Y650-L790 HydrophobicContact CE2-CD1 3.8Å; L752-L790 HydrophobicContact CB-CB 4.43Å; L752-L790 HydrophobicContact CB-CD1 4.41Å; L752-L790 HydrophobicContact CD1-CB 4.07Å; W754-L790 HydrophobicContact CB-CD2 3.97Å; A786-L790 HydrophobicContact CB-CD1 4.12Å; A786-L790 WeakPolarHBondContact O-CB 3.48Å; A786-L790 WeakPolarHBondContact O-CG 3.46Å; A786-L790 PolarHBondContact O-N 3.31Å; D787-L790 PolarHBondContact O-N 2.81Å; L790-M793 WeakPolarHBondContact O-CB 3.43Å; L790-M793 PolarHBondContact O-N 3.33Å; L790-I794 HydrophobicContact CB-CD1 4.36Å; L790-I794 WeakPolarHBondContact O-CB 3.37Å; L790-I794 WeakPolarHBondContact O-CD1 3.18Å; L790-I794 VanDerWaalsContact O-CG1 3.23Å; L790-I794 WeakPolarHBondContact O-CG1 3.42Å; L790-I794 PolarHBondContact O-N 3.23Å; L790-F834 HydrophobicContact CD1-CE1 4.28Å; L790-F834 HydrophobicContact CD2-CD1 3.66Å; L790-F834 HydrophobicContact CD2-CE1 3.65Å; L790-F834 HydrophobicContact CG-CD1 4.2Å; L790-F834 HydrophobicContact CG-CE1 3.81Å
791	W	89.4	Confident	87.6	Confident	10 Å²	10	20.2 Å²	20.2	4%	0.038	12%	0.122	C	C	.	.	H	α-helix	trans	-63.8	-49.8	-174.8	-177.3	-102.2	0	0	0	113.2	V609 L752 Y779 D787 M793 I794 Q795 L811	V609-W791 HydrophobicContact CG2-CD2 4.37Å; V609-W791 HydrophobicContact CG2-CH2 3.86Å; V609-W791 HydrophobicContact CG2-CZ2 3.26Å; L752-W791 HydrophobicContact CD1-CB 3.86Å; L752-W791 HydrophobicContact CD1-CE3 4.02Å; L752-W791 HydrophobicContact CD2-CE3 3.78Å; L752-W791 HydrophobicContact CD2-CZ3 4.09Å; Y779-W791 HydrophobicContact CD1-CZ3 4.02Å; Y779-W791 AromaticContact CD2-CH2 3.68Å; Y779-W791 HydrophobicContact CD2-CH2 3.68Å; Y779-W791 AromaticContact CD2-CZ3 3.82Å; Y779-W791 HydrophobicContact CD2-CZ3 3.82Å; Y779-W791 HydrophobicContact CE1-CZ3 4.46Å; Y779-W791 AromaticContact CE2-CH2 3.94Å; Y779-W791 HydrophobicContact CE2-CH2 3.94Å; Y779-W791 HydrophobicContact CE2-CZ3 4.27Å; Y779-W791 HydrophobicContact CG-CH2 4.05Å; Y779-W791 AromaticContact CG-CZ3 3.68Å; Y779-W791 HydrophobicContact CG-CZ3 3.68Å; D787-W791 WeakPolarHBondContact O-CB 3.28Å; D787-W791 PolarHBondContact O-N 3.32Å; W791-M793 PolarHBondContact O-N 2.93Å; W791-I794 PolarHBondContact O-N 2.65Å; W791-Q795 HydrophobicContact CD2-CG 4.49Å; W791-Q795 HydrophobicContact CZ2-CG 4.07Å; W791-Q795 WeakPolarHBondContact O-CG 3.32Å; W791-Q795 PolarHBondContact O-N 3.17Å; W791-L811 HydrophobicContact CH2-CD2 4.08Å; W791-L811 HydrophobicContact CZ2-CD2 4.21Å
792	P	86.1	Confident	87.2	Confident	28 Å²	28	24 Å²	24	18%	0.182	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-34.1	175.2	-23.8	35.4	0	0	0	113	A796	P792-A796 WeakPolarHBondContact O-CB 3.4Å; P792-A796 PolarHBondContact O-N 3.46Å
793	M	84.8	Confident	86.9	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-68.3	-41.8	176.5	-176.2	178.7	-51.6	0	0	112.8	H789 L790 W791 A796 K797 M831 F834 Q835	H789-M793 WeakPolarHBondContact O-CB 3.05Å; L790-M793 WeakPolarHBondContact O-CB 3.43Å; L790-M793 PolarHBondContact O-N 3.33Å; W791-M793 PolarHBondContact O-N 2.93Å; M793-A796 PolarHBondContact O-N 2.86Å; M793-K797 HydrophobicContact CG-CD 4.07Å; M793-K797 WeakPolarHBondContact O-CB 3.3Å; M793-K797 WeakPolarHBondContact O-CG 3.17Å; M793-K797 PolarHBondContact O-N 3.03Å; M793-K797 PolarHBondContact SD-NZ 2.81Å; M793-K797 VanDerWaalsContact SD-NZ 3.43Å; M793-M831 HydrophobicContact CE-CG 3.73Å; M793-M831 WeakPolarHBondContact CE-O 3.03Å; M793-F834 HydrophobicContact CE-CB 3.24Å; M793-F834 HydrophobicContact CE-CG 4.37Å; M793-F834 HydrophobicContact SD-CB 4.12Å; M793-Q835 HydrophobicContact CE-CB 4.46Å; M793-Q835 HydrophobicContact CE-CG 3.54Å; M793-Q835 HydrophobicContact CG-CG 4.33Å; M793-Q835 HydrophobicContact SD-CG 3.84Å
794	I	87.1	Confident	86.7	Confident	2 Å²	2	25 Å²	25	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-44.6	176.6	-70.6	160.7	0	0	0	109.5	L752 F753 P756 L759 L790 W791 A796 K797 M798	L752-I794 HydrophobicContact CB-CD1 3.95Å; L752-I794 HydrophobicContact CD1-CD1 4.21Å; L752-I794 HydrophobicContact CD2-CD1 4.38Å; L752-I794 HydrophobicContact CG-CD1 4.43Å; F753-I794 VanDerWaalsContact O-CD1 3.25Å; F753-I794 WeakPolarHBondContact O-CD1 3.4Å; P756-I794 HydrophobicContact CB-CG2 4.31Å; L759-I794 HydrophobicContact CD1-CD1 4.18Å; L759-I794 HydrophobicContact CD1-CG2 3.96Å; L790-I794 HydrophobicContact CB-CD1 4.36Å; L790-I794 WeakPolarHBondContact O-CB 3.37Å; L790-I794 WeakPolarHBondContact O-CD1 3.18Å; L790-I794 VanDerWaalsContact O-CG1 3.23Å; L790-I794 WeakPolarHBondContact O-CG1 3.42Å; L790-I794 PolarHBondContact O-N 3.23Å; W791-I794 PolarHBondContact O-N 2.65Å; I794-A796 PolarHBondContact O-N 2.87Å; I794-K797 PolarHBondContact O-N 3.19Å; I794-M798 HydrophobicContact CG2-SD 4.13Å; I794-M798 WeakPolarHBondContact O-CB 3.23Å; I794-M798 WeakPolarHBondContact O-CG 3.44Å; I794-M798 PolarHBondContact O-N 3.42Å
795	Q	86.3	Confident	86.5	Confident	21 Å²	21	23 Å²	23	10%	0.098	13%	0.125	C	C	.	.	H	α-helix	trans	-57.8	-47.8	173.2	-69.2	177.5	-60.9	0	0	112	W791 M798 N799 N817	W791-Q795 HydrophobicContact CD2-CG 4.49Å; W791-Q795 HydrophobicContact CZ2-CG 4.07Å; W791-Q795 WeakPolarHBondContact O-CG 3.32Å; W791-Q795 PolarHBondContact O-N 3.17Å; Q795-M798 PolarHBondContact O-N 3.27Å; Q795-N799 PolarHBondContact O-N 3.39Å; Q795-N817 PolarHBondContact NE2-OD1 3.43Å
796	A	85.3	Confident	86.1	Confident	49 Å²	49	23.2 Å²	23.2	41%	0.405	13%	0.126	S	C	.	.	H	α-helix	trans	-61.1	-46	178.8	0	0	0	0	0	112.6	P792 M793 I794 M798 N799 V800	P792-A796 WeakPolarHBondContact O-CB 3.4Å; P792-A796 PolarHBondContact O-N 3.46Å; M793-A796 PolarHBondContact O-N 2.86Å; I794-A796 PolarHBondContact O-N 2.87Å; A796-M798 VanDerWaalsContact C-N 3.33Å; A796-M798 PolarHBondContact O-N 2.74Å; A796-N799 PolarHBondContact O-N 3.17Å; A796-V800 PolarHBondContact O-N 3.1Å
797	K	86.5	Confident	85.4	Confident	15 Å²	15	23.8 Å²	23.8	7%	0.065	13%	0.13	C	C	.	.	H	α-helix	trans	-62.7	-37.7	175.3	-70.2	169.7	179.3	-179.3	0	112	W754 P756 M793 I794 V800 L801	W754-K797 PolarHBondContact O-NZ 3.31Å; P756-K797 HydrophobicContact CG-CB 3.72Å; M793-K797 HydrophobicContact CG-CD 4.07Å; M793-K797 WeakPolarHBondContact O-CB 3.3Å; M793-K797 WeakPolarHBondContact O-CG 3.17Å; M793-K797 PolarHBondContact O-N 3.03Å; M793-K797 PolarHBondContact SD-NZ 2.81Å; M793-K797 VanDerWaalsContact SD-NZ 3.43Å; I794-K797 PolarHBondContact O-N 3.19Å; K797-V800 PolarHBondContact O-N 3.28Å; K797-L801 WeakPolarHBondContact O-CG 3.41Å; K797-L801 PolarHBondContact O-N 3.16Å; K797-L801 VanDerWaalsContact O-N 3.08Å
798	M	85.6	Confident	84.3	Confident	10 Å²	10	25.1 Å²	25.1	5%	0.049	14%	0.136	C	C	.	.	H	α-helix	trans	-69	-31	176.1	-74.4	-176.9	68.3	0	0	113.2	P756 I760 I794 Q795 A796 L801 K802 L811	P756-M798 HydrophobicContact CB-CG 3.27Å; P756-M798 HydrophobicContact CB-SD 3.74Å; P756-M798 HydrophobicContact CG-CG 3.87Å; I760-M798 HydrophobicContact CD1-CE 4.13Å; I760-M798 HydrophobicContact CG1-CE 4.16Å; I794-M798 HydrophobicContact CG2-SD 4.13Å; I794-M798 WeakPolarHBondContact O-CB 3.23Å; I794-M798 WeakPolarHBondContact O-CG 3.44Å; I794-M798 PolarHBondContact O-N 3.42Å; Q795-M798 PolarHBondContact O-N 3.27Å; A796-M798 VanDerWaalsContact C-N 3.33Å; A796-M798 PolarHBondContact O-N 2.74Å; M798-L801 PolarHBondContact O-N 3.3Å; M798-K802 WeakPolarHBondContact O-CB 3.2Å; M798-K802 PolarHBondContact O-N 3.42Å; M798-L811 HydrophobicContact CB-CD1 4.22Å; M798-L811 HydrophobicContact CE-CD1 3.53Å; M798-L811 HydrophobicContact CE-CG 4.09Å; M798-L811 HydrophobicContact CG-CD1 4.42Å; M798-L811 HydrophobicContact SD-CD1 3.44Å; M798-L811 WeakPolarHBondContact SD-CD1 3.36Å
799	N	86.3	Confident	82.8	Confident	54 Å²	54	26.6 Å²	26.6	29%	0.289	15%	0.148	S	C	.	.	H	α-helix	trans	-65.7	-42.5	171.4	-70.3	-20.2	0	0	0	111.6	Q795 A796 L801 K802 E803 L812	Q795-N799 PolarHBondContact O-N 3.39Å; A796-N799 PolarHBondContact O-N 3.17Å; N799-L801 VanDerWaalsContact C-N 3.34Å; N799-L801 PolarHBondContact O-N 3Å; N799-K802 WeakPolarHBondContact O-CB 3.43Å; N799-K802 PolarHBondContact O-N 3.17Å; N799-K802 VanDerWaalsContact O-N 3.13Å; N799-E803 PolarHBondContact O-N 3.32Å; N799-L812 WeakPolarHBondContact OD1-CD1 3.33Å
800	V	87.3	Confident	81.2	Confident	25 Å²	25	29.9 Å²	29.9	15%	0.152	17%	0.167	C	C	.	.	H	α-helix	trans	-57.9	-44.9	172.8	171.3	0	0	0	0	111.3	L578 A796 K797 K802 E803 V804	L578-V800 HydrophobicContact CD1-CB 4.34Å; L578-V800 HydrophobicContact CD1-CG1 3.91Å; L578-V800 HydrophobicContact CD1-CG2 4.45Å; A796-V800 PolarHBondContact O-N 3.1Å; K797-V800 PolarHBondContact O-N 3.28Å; V800-K802 PolarHBondContact O-N 3.41Å; V800-E803 PolarHBondContact O-N 2.96Å; V800-V804 WeakPolarHBondContact O-CG2 3.48Å; V800-V804 PolarHBondContact O-N 3.1Å
801	L	86.7	Confident	79.6	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-37.8	175.1	-65.2	178.4	0	0	0	112.9	A528 P756 I760 K797 M798 N799 G805 L806	A528-L801 HydrophobicContact CB-CD2 3.65Å; P756-L801 HydrophobicContact CG-CD1 4.03Å; I760-L801 HydrophobicContact CD1-CD1 4.39Å; K797-L801 WeakPolarHBondContact O-CG 3.41Å; K797-L801 PolarHBondContact O-N 3.16Å; K797-L801 VanDerWaalsContact O-N 3.08Å; M798-L801 PolarHBondContact O-N 3.3Å; N799-L801 VanDerWaalsContact C-N 3.34Å; N799-L801 PolarHBondContact O-N 3Å; L801-G805 PolarHBondContact O-N 3.38Å; L801-L806 HydrophobicContact CD2-CD1 4.43Å; L801-L806 PolarHBondContact O-N 2.95Å
802	K	86.4	Confident	77.8	Confident	80 Å²	80	33.1 Å²	33.1	35%	0.348	18%	0.184	S	C	.	.	H	α-helix	trans	-63.6	-42.3	176.2	177.3	179.2	174	173.8	0	111.7	M798 N799 V800 G805 S809	M798-K802 WeakPolarHBondContact O-CB 3.2Å; M798-K802 PolarHBondContact O-N 3.42Å; N799-K802 WeakPolarHBondContact O-CB 3.43Å; N799-K802 PolarHBondContact O-N 3.17Å; N799-K802 VanDerWaalsContact O-N 3.13Å; V800-K802 PolarHBondContact O-N 3.41Å; K802-G805 WeakPolarHBondContact O-CA 3.47Å; K802-G805 PolarHBondContact O-N 3.47Å; K802-S809 PolarHBondContact NZ-O 3.06Å
803	E	85.1	Confident	75.9	Confident	117 Å²	117	38.4 Å²	38.4	55%	0.547	21%	0.211	S	C	.	.	H	α-helix	trans	-67.6	-36.7	178.9	-73.8	178.8	-147.3	0	0	113	L578 N799 V800 G805	L578-E803 HydrophobicContact CB-CB 3.9Å; L578-E803 HydrophobicContact CD1-CB 3.82Å; N799-E803 PolarHBondContact O-N 3.32Å; V800-E803 PolarHBondContact O-N 2.96Å; E803-G805 PolarHBondContact O-N 3.21Å
804	V	83.8	Confident	73.8	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.018	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-6	170.8	-172.2	0	0	0	0	112.1	L535 L578 L581 K582 L585 V800 L806	L535-V804 HydrophobicContact CD1-CG1 4.02Å; L578-V804 HydrophobicContact CB-CG2 3.9Å; L578-V804 HydrophobicContact CD1-CG2 4.23Å; L578-V804 HydrophobicContact CD2-CG2 3.7Å; L578-V804 HydrophobicContact CG-CG2 4.15Å; L581-V804 HydrophobicContact CD2-CG1 4.23Å; L581-V804 HydrophobicContact CD2-CG2 4.26Å; L581-V804 HydrophobicContact CG-CG1 4.41Å; K582-V804 WeakPolarHBondContact CG-O 3.42Å; L585-V804 HydrophobicContact CD1-CG1 4.11Å; V800-V804 WeakPolarHBondContact O-CG2 3.48Å; V800-V804 PolarHBondContact O-N 3.1Å; V804-L806 HydrophobicContact CB-CD1 4.14Å; V804-L806 HydrophobicContact CB-CG 4.11Å; V804-L806 HydrophobicContact CG1-CD1 3.78Å; V804-L806 HydrophobicContact CG1-CG 3.93Å
805	G	81.4	Confident	71.6	Confident	13 Å²	13	49.7 Å²	49.7	13%	0.134	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	23.3	178.2	0	0	0	0	0	114.8	L801 K802 E803	L801-G805 PolarHBondContact O-N 3.38Å; K802-G805 WeakPolarHBondContact O-CA 3.47Å; K802-G805 PolarHBondContact O-N 3.47Å; E803-G805 PolarHBondContact O-N 3.21Å
806	L	81.6	Confident	69.5	Low	4 Å²	4	57 Å²	57	2%	0.021	30%	0.301	C	S	.	.			trans	-103.9	4.8	-172.2	-55	-179.7	0	0	0	114.1	P527 A528 L535 M590 R592 L801 V804	P527-L806 HydrophobicContact CG-CD1 4.03Å; P527-L806 HydrophobicContact CG-CD2 3.62Å; P527-L806 HydrophobicContact CG-CG 4.38Å; A528-L806 HydrophobicContact CB-CD1 3.7Å; L535-L806 HydrophobicContact CD1-CD1 4.34Å; L535-L806 HydrophobicContact CD2-CD1 4.3Å; M590-L806 HydrophobicContact CE-CD2 3.99Å; M590-L806 HydrophobicContact SD-CD2 4.03Å; R592-L806 PolarHBondContact NH2-O 2.84Å; L801-L806 HydrophobicContact CD2-CD1 4.43Å; L801-L806 PolarHBondContact O-N 2.95Å; V804-L806 HydrophobicContact CB-CD1 4.14Å; V804-L806 HydrophobicContact CB-CG 4.11Å; V804-L806 HydrophobicContact CG1-CD1 3.78Å; V804-L806 HydrophobicContact CG1-CG 3.93Å
807	S	75	Confident	67.5	Low	13 Å²	13	57.4 Å²	57.4	9%	0.091	30%	0.296	C	S	.	.	S	Bend	trans	-147.6	146.1	177.8	177.7	0	0	0	0	111.4
808	E	67.5	Low	65.3	Low	30 Å²	30	65.7 Å²	65.7	14%	0.14	34%	0.335	C	S	.	.			trans	-60.7	154.5	166.7	-62.5	-170.7	132.7	0	0	111.6	L594 S596 N810	L594-E808 HydrophobicContact CB-CG 4.37Å; L594-E808 HydrophobicContact CD1-CG 4.26Å; L594-E808 HydrophobicContact CD2-CG 4.22Å; S596-E808 WeakPolarHBondContact CB-OE1 3.36Å; S596-E808 PolarHBondContact OG-OE1 3.01Å; E808-N810 VanDerWaalsContact C-N 3.34Å; E808-N810 PolarHBondContact O-N 2.93Å
809	S	54.9	Low	63.5	Low	59 Å²	59	68 Å²	68	41%	0.413	35%	0.352	S	S	.	.	S	Bend	trans	-75.8	-8.2	-163.3	43	0	0	0	0	117.1	K802 L811	K802-S809 PolarHBondContact NZ-O 3.06Å; S809-L811 PolarHBondContact O-N 3.09Å
810	N	51.4	Low	61.7	Low	90 Å²	90	66.6 Å²	66.6	48%	0.481	34%	0.344	S	S	.	.			trans	-106.8	66	-147.6	-57.9	-16.1	0	0	0	113.9	R607 E808	R607-N810 PolarHBondContact NH1-O 3.43Å; E808-N810 VanDerWaalsContact C-N 3.34Å; E808-N810 PolarHBondContact O-N 2.93Å
811	L	53.1	Low	59.7	Low	25 Å²	25	72.2 Å²	72.2	13%	0.131	37%	0.368	C	S	.	.	S	Bend	trans	-114.7	-17.8	170	-118.1	-168.1	0	0	0	114.4	R607 W791 M798 S809	R607-L811 HydrophobicContact CB-CD2 4.12Å; W791-L811 HydrophobicContact CH2-CD2 4.08Å; W791-L811 HydrophobicContact CZ2-CD2 4.21Å; M798-L811 HydrophobicContact CB-CD1 4.22Å; M798-L811 HydrophobicContact CE-CD1 3.53Å; M798-L811 HydrophobicContact CE-CG 4.09Å; M798-L811 HydrophobicContact CG-CD1 4.42Å; M798-L811 HydrophobicContact SD-CD1 3.44Å; M798-L811 WeakPolarHBondContact SD-CD1 3.36Å; S809-L811 PolarHBondContact O-N 3.09Å
812	L	50.8	Low	57.7	Low	52 Å²	52	75.5 Å²	75.5	27%	0.272	39%	0.391	S	S	.	.	S	Bend	trans	-116.3	-18.9	-158.1	-75.5	167.7	0	0	0	116.2	N799 K814	N799-L812 WeakPolarHBondContact OD1-CD1 3.33Å; L812-K814 VanDerWaalsContact C-N 3.28Å; L812-K814 PolarHBondContact O-N 2.94Å
813	D	46.6	Very low	55.7	Low	139 Å²	139	81.6 Å²	81.6	74%	0.743	42%	0.418	S	S	*	.	S	Bend	trans	-78.3	-5.5	-166.6	-61.5	10.9	0	0	0	114.9
814	K	40.9	Very low	54.3	Low	207 Å²	207	79.4 Å²	79.4	90%	0.9	41%	0.41	S	S	*	.	S	Bend	trans	-144.9	6.2	-175.1	-68.9	-168.2	177.4	-179.2	0	116.3	L812	L812-K814 VanDerWaalsContact C-N 3.28Å; L812-K814 PolarHBondContact O-N 2.94Å
815	A	42.1	Very low	52.7	Low	34 Å²	34	84.1 Å²	84.1	28%	0.281	44%	0.44	S	S	.	.	S	Bend	trans	-94.3	126.3	174.3	0	0	0	0	0	109.9	N817	A815-N817 VanDerWaalsContact C-N 3.28Å; A815-N817 PolarHBondContact O-N 3.41Å
816	E	41.3	Very low	51.5	Low	174 Å²	174	87.3 Å²	87.3	81%	0.813	45%	0.454	S	S	*	.			trans	-73	78.8	-179	-66.8	172.5	163.3	0	0	111	E818 S819	E816-E818 PolarHBondContact O-N 3.02Å; E816-S819 PolarHBondContact O-N 2.9Å; E816-S819 PolarHBondContact O-OG 3.19Å; E816-S819 VanDerWaalsContact O-OG 3.08Å
817	N	42.5	Very low	50.4	Low	57 Å²	57	88.8 Å²	88.8	31%	0.305	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-61.5	-14.9	-173.3	-71.1	-46.6	0	0	0	114.5	Q795 A815 S819 H821	Q795-N817 PolarHBondContact NE2-OD1 3.43Å; A815-N817 VanDerWaalsContact C-N 3.28Å; A815-N817 PolarHBondContact O-N 3.41Å; N817-S819 PolarHBondContact O-N 3.34Å; N817-S819 VanDerWaalsContact O-N 3.12Å; N817-H821 PolarHBondContact O-CD2 3.15Å
818	E	41.5	Very low	49.6	Very low	190 Å²	190	96.9 Å²	96.9	89%	0.888	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-59.9	-23	178.9	-57.7	-165.2	148.6	0	0	113.1	E816	E816-E818 PolarHBondContact O-N 3.02Å
819	S	46.7	Very low	49.3	Very low	58 Å²	58	97.9 Å²	97.9	41%	0.406	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-84.1	-11.4	-171.1	63.5	0	0	0	0	115.7	K783 E816 N817	K783-S819 VanDerWaalsContact CE-O 3.27Å; K783-S819 WeakPolarHBondContact CE-O 3.49Å; K783-S819 PolarHBondContact NZ-O 3.47Å; E816-S819 PolarHBondContact O-N 2.9Å; E816-S819 PolarHBondContact O-OG 3.19Å; E816-S819 VanDerWaalsContact O-OG 3.08Å; N817-S819 PolarHBondContact O-N 3.34Å; N817-S819 VanDerWaalsContact O-N 3.12Å
820	F	48.3	Very low	49.7	Very low	25 Å²	25	95.5 Å²	95.5	11%	0.11	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-5.2	-178.6	-76.5	-89.4	0	0	0	115	T611 V781 K783 D788 S822	T611-F820 HydrophobicContact CG2-CZ 4.09Å; T611-F820 WeakPolarHBondContact OG1-CE2 3.38Å; V781-F820 HydrophobicContact CG2-CE1 4.37Å; V781-F820 HydrophobicContact CG2-CE2 4.28Å; V781-F820 HydrophobicContact CG2-CZ 3.7Å; K783-F820 HydrophobicContact CD-CE1 4.39Å; K783-F820 HydrophobicContact CD-CZ 4.38Å; K783-F820 HydrophobicContact CG-CE1 3.64Å; K783-F820 HydrophobicContact CG-CZ 3.84Å; D788-F820 VanDerWaalsContact OD1-CD1 3.29Å; D788-F820 WeakPolarHBondContact OD1-CD1 3.32Å; D788-F820 VanDerWaalsContact OD1-CE1 3.26Å; D788-F820 WeakPolarHBondContact OD1-CE1 3.3Å; F820-S822 VanDerWaalsContact C-N 3.28Å; F820-S822 PolarHBondContact O-N 3.49Å
821	H	45.1	Very low	50.3	Low	143 Å²	143	93.9 Å²	93.9	66%	0.662	47%	0.473	S	S	*	.			trans	-77.2	76.5	169.3	-80.7	-62.6	0	0	0	111.5	N817	N817-H821 PolarHBondContact O-CD2 3.15Å
822	S	45.6	Very low	50.9	Low	73 Å²	73	97.9 Å²	97.9	51%	0.51	49%	0.491	S	S	.	.			trans	-62.6	146.9	164.5	-176	0	0	0	0	110.3	F820 D824 Q827	F820-S822 VanDerWaalsContact C-N 3.28Å; F820-S822 PolarHBondContact O-N 3.49Å; S822-D824 VanDerWaalsContact C-N 3.3Å; S822-D824 PolarHBondContact OG-N 3.43Å; S822-Q827 PolarHBondContact O-OE1 2.86Å
823	K	45.4	Very low	51.6	Low	208 Å²	208	96.3 Å²	96.3	90%	0.904	48%	0.482	S	S	*	.			trans	-94.4	17.1	176.1	-64.8	-178.6	-179.7	175.5	0	112.3
824	D	54	Low	52.4	Low	71 Å²	71	89.8 Å²	89.8	38%	0.38	45%	0.447	S	S	.	.			trans	-74.2	120	-177.3	-174.1	-9.2	0	0	0	111.5	S822 N826 Q827	S822-D824 VanDerWaalsContact C-N 3.3Å; S822-D824 PolarHBondContact OG-N 3.43Å; D824-N826 PolarHBondContact O-N 2.79Å; D824-N826 VanDerWaalsContact OD1-CB 3.3Å; D824-N826 WeakPolarHBondContact OD1-CB 3.42Å; D824-N826 PolarHBondContact OD1-N 3.22Å; D824-N826 PolarHBondContact OD1-ND2 3.21Å; D824-Q827 HydrophobicContact CB-CB 4.44Å; D824-Q827 WeakPolarHBondContact O-CB 3.41Å; D824-Q827 PolarHBondContact O-N 3.09Å; D824-Q827 VanDerWaalsContact O-N 3.1Å
825	P	50.1	Low	53.6	Low	102 Å²	102	82.8 Å²	82.8	66%	0.662	42%	0.418	S	S	*	.	H	α-helix	trans	-59.1	-27.3	175.3	24.9	-34.6	0	0	0	113.4	Q827 R828	P825-Q827 VanDerWaalsContact C-N 3.28Å; P825-Q827 PolarHBondContact O-N 3.42Å; P825-R828 PolarHBondContact O-N 3.3Å
826	N	56.5	Low	54.7	Low	80 Å²	80	86.1 Å²	86.1	43%	0.428	42%	0.423	S	S	.	.	H	α-helix	trans	-67.7	-27.4	177.5	-58.5	-67.2	0	0	0	112.6	T633 D824 R828 S829 I830	T633-N826 HydrophobicContact CG2-CB 4.16Å; D824-N826 PolarHBondContact O-N 2.79Å; D824-N826 VanDerWaalsContact OD1-CB 3.3Å; D824-N826 WeakPolarHBondContact OD1-CB 3.42Å; D824-N826 PolarHBondContact OD1-N 3.22Å; D824-N826 PolarHBondContact OD1-ND2 3.21Å; N826-R828 PolarHBondContact O-N 3.43Å; N826-S829 PolarHBondContact O-N 2.94Å; N826-I830 PolarHBondContact O-N 2.9Å
827	Q	59	Low	55.5	Low	35 Å²	35	78 Å²	78	16%	0.164	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-31.6	-179.4	-163.5	-175.7	11.9	0	0	111.7	D788 S822 D824 P825 M831	D788-Q827 PolarHBondContact O-NE2 3.2Å; S822-Q827 PolarHBondContact O-OE1 2.86Å; D824-Q827 HydrophobicContact CB-CB 4.44Å; D824-Q827 WeakPolarHBondContact O-CB 3.41Å; D824-Q827 PolarHBondContact O-N 3.09Å; D824-Q827 VanDerWaalsContact O-N 3.1Å; P825-Q827 VanDerWaalsContact C-N 3.28Å; P825-Q827 PolarHBondContact O-N 3.42Å; Q827-M831 VanDerWaalsContact O-CB 3.26Å; Q827-M831 WeakPolarHBondContact O-CB 3.4Å; Q827-M831 PolarHBondContact O-N 3.27Å
828	R	58.6	Low	56.2	Low	182 Å²	182	76.1 Å²	76.1	69%	0.687	38%	0.375	S	S	*	.	H	α-helix	trans	-66	-48.1	174.8	-68.8	-174.3	179	179	-0.3	112.1	P825 N826 I830 M831 E832	P825-R828 PolarHBondContact O-N 3.3Å; N826-R828 PolarHBondContact O-N 3.43Å; R828-I830 PolarHBondContact O-N 3.35Å; R828-M831 PolarHBondContact O-N 3.13Å; R828-E832 WeakPolarHBondContact O-CG 3.39Å; R828-E832 PolarHBondContact O-N 2.93Å
829	S	60.4	Low	56.8	Low	52 Å²	52	68.1 Å²	68.1	36%	0.364	34%	0.34	S	S	.	.	H	α-helix	trans	-57.3	-48.6	179	-173.8	0	0	0	0	111.5	N826 M831 E832 M833	N826-S829 PolarHBondContact O-N 2.94Å; S829-M831 PolarHBondContact O-N 2.97Å; S829-E832 PolarHBondContact O-N 3.28Å; S829-M833 WeakPolarHBondContact O-CG 3.24Å; S829-M833 PolarHBondContact O-N 2.84Å
830	I	63.4	Low	56.9	Low	8 Å²	8	67.2 Å²	67.2	4%	0.041	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-41.8	177.6	-60.9	176.6	0	0	0	110.8	L632 T633 H789 N826 R828 E832 M833 F834	L632-I830 HydrophobicContact CB-CD1 4.26Å; L632-I830 HydrophobicContact CB-CG1 4.13Å; L632-I830 HydrophobicContact CD1-CG2 4.34Å; T633-I830 HydrophobicContact CG2-CD1 4.02Å; T633-I830 HydrophobicContact CG2-CG1 4.43Å; H789-I830 HydrophobicContact CB-CG2 4.36Å; H789-I830 WeakPolarHBondContact ND1-CG2 3.49Å; N826-I830 PolarHBondContact O-N 2.9Å; R828-I830 PolarHBondContact O-N 3.35Å; I830-E832 VanDerWaalsContact C-N 3.33Å; I830-E832 PolarHBondContact O-N 2.84Å; I830-M833 PolarHBondContact O-N 3.04Å; I830-F834 HydrophobicContact CG2-CD2 3.85Å; I830-F834 HydrophobicContact CG2-CE2 3.82Å; I830-F834 WeakPolarHBondContact O-CD2 3.39Å; I830-F834 PolarHBondContact O-N 2.79Å
831	M	63.5	Low	56.7	Low	56 Å²	56	70.7 Å²	70.7	28%	0.276	35%	0.346	S	S	.	.	H	α-helix	trans	-63.6	-37.7	176.4	-171.2	176.9	65.3	0	0	112.1	M793 Q827 R828 S829 F834 Q835	M793-M831 HydrophobicContact CE-CG 3.73Å; M793-M831 WeakPolarHBondContact CE-O 3.03Å; Q827-M831 VanDerWaalsContact O-CB 3.26Å; Q827-M831 WeakPolarHBondContact O-CB 3.4Å; Q827-M831 PolarHBondContact O-N 3.27Å; R828-M831 PolarHBondContact O-N 3.13Å; S829-M831 PolarHBondContact O-N 2.97Å; M831-F834 PolarHBondContact O-N 3.28Å; M831-Q835 VanDerWaalsContact O-CG 3.32Å; M831-Q835 WeakPolarHBondContact O-CG 3.24Å; M831-Q835 PolarHBondContact O-N 3.12Å
832	E	66.1	Low	56.6	Low	109 Å²	109	65 Å²	65	51%	0.509	32%	0.32	S	S	.	.	H	α-helix	trans	-66	-40.1	173.8	-75.1	174	-152.5	0	0	111.8	R828 S829 I830 Q835 R836	R828-E832 WeakPolarHBondContact O-CG 3.39Å; R828-E832 PolarHBondContact O-N 2.93Å; S829-E832 PolarHBondContact O-N 3.28Å; I830-E832 VanDerWaalsContact C-N 3.33Å; I830-E832 PolarHBondContact O-N 2.84Å; E832-Q835 CarbonylContact O-C 3.59Å; E832-Q835 PolarHBondContact O-N 3.36Å; E832-Q835 VanDerWaalsContact O-N 3.15Å; E832-R836 WeakPolarHBondContact O-CB 3.49Å; E832-R836 WeakPolarHBondContact O-CD 3.49Å; E832-R836 VanDerWaalsContact O-CG 3.27Å; E832-R836 WeakPolarHBondContact O-CG 3.11Å; E832-R836 PolarHBondContact O-N 3.25Å
833	M	65.1	Low	56.5	Low	20 Å²	20	63.6 Å²	63.6	10%	0.099	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-49.8	171.9	-69.9	-175.7	-179	0	0	111.8	L632 E642 S829 I830 Q835 R836 S837	L632-M833 HydrophobicContact CD2-SD 4.07Å; L632-M833 WeakPolarHBondContact O-CE 3.4Å; E642-M833 HydrophobicContact CG-CB 4.21Å; E642-M833 HydrophobicContact CG-CG 3.88Å; E642-M833 HydrophobicContact CG-SD 3.94Å; S829-M833 WeakPolarHBondContact O-CG 3.24Å; S829-M833 PolarHBondContact O-N 2.84Å; I830-M833 PolarHBondContact O-N 3.04Å; M833-Q835 PolarHBondContact O-N 2.92Å; M833-R836 PolarHBondContact O-N 2.86Å; M833-S837 WeakPolarHBondContact O-CB 3.38Å; M833-S837 PolarHBondContact O-N 2.97Å; M833-S837 PolarHBondContact O-OG 2.82Å
834	F	64.8	Low	56	Low	1 Å²	1	61.4 Å²	61.4	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-29.3	174.6	-86.3	-103.4	0	0	0	112.4	L632 L646 F649 A786 L790 M793 I830 M831 F838	L632-F834 HydrophobicContact CD1-CE2 4.45Å; L646-F834 HydrophobicContact CD1-CB 4.21Å; L646-F834 HydrophobicContact CD1-CD1 3.84Å; L646-F834 HydrophobicContact CD1-CD2 3.68Å; L646-F834 HydrophobicContact CD1-CE1 4.14Å; L646-F834 HydrophobicContact CD1-CE2 4.01Å; L646-F834 HydrophobicContact CD1-CG 3.6Å; L646-F834 HydrophobicContact CD1-CZ 4.23Å; L646-F834 HydrophobicContact CD2-CD1 4.06Å; L646-F834 HydrophobicContact CD2-CE1 3.66Å; L646-F834 HydrophobicContact CD2-CE2 4.43Å; L646-F834 HydrophobicContact CD2-CZ 3.88Å; L646-F834 HydrophobicContact CG-CD1 4.12Å; L646-F834 HydrophobicContact CG-CD2 3.98Å; L646-F834 HydrophobicContact CG-CE1 3.88Å; L646-F834 HydrophobicContact CG-CE2 3.76Å; L646-F834 HydrophobicContact CG-CG 4.17Å; L646-F834 HydrophobicContact CG-CZ 3.71Å; F649-F834 HydrophobicContact CD1-CE2 4.48Å; F649-F834 HydrophobicContact CD1-CZ 4.45Å; A786-F834 HydrophobicContact CB-CZ 4.15Å; L790-F834 HydrophobicContact CD1-CE1 4.28Å; L790-F834 HydrophobicContact CD2-CD1 3.66Å; L790-F834 HydrophobicContact CD2-CE1 3.65Å; L790-F834 HydrophobicContact CG-CD1 4.2Å; L790-F834 HydrophobicContact CG-CE1 3.81Å; M793-F834 HydrophobicContact CE-CB 3.24Å; M793-F834 HydrophobicContact CE-CG 4.37Å; M793-F834 HydrophobicContact SD-CB 4.12Å; I830-F834 HydrophobicContact CG2-CD2 3.85Å; I830-F834 HydrophobicContact CG2-CE2 3.82Å; I830-F834 WeakPolarHBondContact O-CD2 3.39Å; I830-F834 PolarHBondContact O-N 2.79Å; M831-F834 PolarHBondContact O-N 3.28Å; F834-F838 HydrophobicContact CD1-CD2 4.29Å; F834-F838 AromaticContact CD1-CE2 3.82Å; F834-F838 HydrophobicContact CD1-CE2 3.82Å; F834-F838 HydrophobicContact CE1-CE2 4.3Å; F834-F838 WeakPolarHBondContact O-CD2 3.26Å
835	Q	65.8	Low	55.3	Low	61 Å²	61	61.6 Å²	61.6	29%	0.285	30%	0.299	S	S	.	.	H	α-helix	trans	-75.8	-30.6	173.4	-72.9	179.6	18.9	0	0	113.2	R531 M793 M831 E832 M833	R531-Q835 PolarHBondContact NH2-O 3.4Å; M793-Q835 HydrophobicContact CE-CB 4.46Å; M793-Q835 HydrophobicContact CE-CG 3.54Å; M793-Q835 HydrophobicContact CG-CG 4.33Å; M793-Q835 HydrophobicContact SD-CG 3.84Å; M831-Q835 VanDerWaalsContact O-CG 3.32Å; M831-Q835 WeakPolarHBondContact O-CG 3.24Å; M831-Q835 PolarHBondContact O-N 3.12Å; E832-Q835 CarbonylContact O-C 3.59Å; E832-Q835 PolarHBondContact O-N 3.36Å; E832-Q835 VanDerWaalsContact O-N 3.15Å; M833-Q835 PolarHBondContact O-N 2.92Å
836	R	65.2	Low	55.2	Low	103 Å²	103	59 Å²	59	39%	0.389	28%	0.278	S	S	.	.	H	α-helix	trans	-83.5	-50.4	-179.4	-76.4	159.8	46.5	129	-3.8	112.9	E642 E832 M833 F838 S839	E642-R836 IonicContact OE1-CZ 2.7Å; E642-R836 IonicContact OE1-NE 3.67Å; E642-R836 PolarHBondContact OE1-NE 2.76Å; E642-R836 IonicContact OE1-NH2 3.67Å; E642-R836 IonicContact OE2-CZ 3.78Å; E642-R836 IonicContact OE2-NE 3.46Å; E642-R836 IonicContact OE2-NH2 3.22Å; E642-R836 PolarHBondContact OE2-NH2 3.4Å; E832-R836 WeakPolarHBondContact O-CB 3.49Å; E832-R836 WeakPolarHBondContact O-CD 3.49Å; E832-R836 VanDerWaalsContact O-CG 3.27Å; E832-R836 WeakPolarHBondContact O-CG 3.11Å; E832-R836 PolarHBondContact O-N 3.25Å; M833-R836 PolarHBondContact O-N 2.86Å; R836-F838 VanDerWaalsContact C-N 3.28Å; R836-F838 PolarHBondContact O-N 2.97Å; R836-S839 VanDerWaalsContact O-CB 3.3Å; R836-S839 WeakPolarHBondContact O-CB 3.11Å; R836-S839 PolarHBondContact O-N 2.96Å; R836-S839 PolarHBondContact O-OG 3.29Å
837	S	58.5	Low	54.5	Low	3 Å²	3	58.5 Å²	58.5	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-69.5	-22.1	-177.1	-59	0	0	0	0	113.7	E642 M833	E642-S837 PolarHBondContact OE1-OG 3.5Å; M833-S837 WeakPolarHBondContact O-CB 3.38Å; M833-S837 PolarHBondContact O-N 2.97Å; M833-S837 PolarHBondContact O-OG 2.82Å
838	F	57.3	Low	53.4	Low	18 Å²	18	61.7 Å²	61.7	8%	0.079	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	53.1	167.8	-57.9	-61.9	0	0	0	111.2	R531 L646 W754 F834 R836	R531-F838 PolarHBondContact NH2-O 3.18Å; R531-F838 VanDerWaalsContact NH2-O 3.16Å; L646-F838 HydrophobicContact CD1-CE2 4.01Å; L646-F838 HydrophobicContact CD2-CE2 3.53Å; L646-F838 HydrophobicContact CD2-CZ 3.54Å; L646-F838 HydrophobicContact CG-CE2 4.46Å; W754-F838 HydrophobicContact CB-CD2 4.02Å; W754-F838 HydrophobicContact CB-CE2 4.25Å; W754-F838 HydrophobicContact CB-CG 4.49Å; W754-F838 AromaticContact CD1-CD1 3.76Å; W754-F838 AromaticContact CD1-CD2 3.95Å; W754-F838 AromaticContact CD1-CG 3.55Å; W754-F838 AromaticContact CD2-CD1 3.98Å; W754-F838 HydrophobicContact CD2-CD1 3.98Å; W754-F838 HydrophobicContact CD2-CD2 4.09Å; W754-F838 AromaticContact CD2-CE1 3.75Å; W754-F838 HydrophobicContact CD2-CE1 3.75Å; W754-F838 AromaticContact CD2-CE2 3.85Å; W754-F838 HydrophobicContact CD2-CE2 3.85Å; W754-F838 HydrophobicContact CD2-CG 4.14Å; W754-F838 AromaticContact CD2-CZ 3.68Å; W754-F838 HydrophobicContact CD2-CZ 3.68Å; W754-F838 AromaticContact CE2-CD1 3.51Å; W754-F838 AromaticContact CE2-CE1 3.4Å; W754-F838 AromaticContact CE2-CZ 3.84Å; W754-F838 HydrophobicContact CE3-CE1 4.12Å; W754-F838 HydrophobicContact CE3-CE2 4.01Å; W754-F838 AromaticContact CE3-CZ 3.7Å; W754-F838 HydrophobicContact CE3-CZ 3.7Å; W754-F838 HydrophobicContact CG-CB 4.35Å; W754-F838 HydrophobicContact CG-CD1 4.13Å; W754-F838 AromaticContact CG-CD2 3.77Å; W754-F838 HydrophobicContact CG-CD2 3.77Å; W754-F838 HydrophobicContact CG-CE1 4.34Å; W754-F838 AromaticContact CG-CE2 3.97Å; W754-F838 HydrophobicContact CG-CE2 3.97Å; W754-F838 AromaticContact CG-CG 3.84Å; W754-F838 HydrophobicContact CG-CG 3.84Å; W754-F838 HydrophobicContact CG-CZ 4.26Å; W754-F838 AromaticContact CH2-CE1 3.84Å; W754-F838 HydrophobicContact CH2-CE1 3.84Å; W754-F838 HydrophobicContact CH2-CZ 4.03Å; W754-F838 AromaticContact CZ2-CD1 3.93Å; W754-F838 HydrophobicContact CZ2-CD1 3.93Å; W754-F838 AromaticContact CZ2-CE1 3.45Å; W754-F838 HydrophobicContact CZ2-CE1 3.45Å; W754-F838 VanDerWaalsContact CZ2-CE1 3.45Å; W754-F838 HydrophobicContact CZ2-CZ 4.03Å; W754-F838 HydrophobicContact CZ3-CE1 4.15Å; W754-F838 AromaticContact CZ3-CZ 3.88Å; W754-F838 HydrophobicContact CZ3-CZ 3.88Å; W754-F838 AromaticContact NE1-CD1 3.35Å; W754-F838 VanDerWaalsContact NE1-CD1 3.35Å; W754-F838 AromaticContact NE1-CE1 3.78Å; W754-F838 AromaticContact NE1-CG 3.67Å; F834-F838 HydrophobicContact CD1-CD2 4.29Å; F834-F838 AromaticContact CD1-CE2 3.82Å; F834-F838 HydrophobicContact CD1-CE2 3.82Å; F834-F838 HydrophobicContact CE1-CE2 4.3Å; F834-F838 WeakPolarHBondContact O-CD2 3.26Å; R836-F838 VanDerWaalsContact C-N 3.28Å; R836-F838 PolarHBondContact O-N 2.97Å
839	S	53.6	Low	52.5	Low	22 Å²	22	54.6 Å²	54.6	15%	0.154	28%	0.277	C	S	.	.	S	Bend	trans	-110.5	151.7	167.3	66.4	0	0	0	0	110.5	R836 E841 D842	R836-S839 VanDerWaalsContact O-CB 3.3Å; R836-S839 WeakPolarHBondContact O-CB 3.11Å; R836-S839 PolarHBondContact O-N 2.96Å; R836-S839 PolarHBondContact O-OG 3.29Å; S839-E841 PolarHBondContact O-N 3.3Å; S839-D842 PolarHBondContact O-N 3.03Å
840	E	48.9	Very low	51.8	Low	39 Å²	39	53.9 Å²	53.9	18%	0.182	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	2.9	-167.4	-51.8	-158.6	114.5	0	0	115.7	K500 N501 D842	K500-E840 WeakPolarHBondContact CD-OE1 3.46Å; K500-E840 WeakPolarHBondContact CE-OE1 3.46Å; K500-E840 WeakPolarHBondContact CG-OE1 3.46Å; K500-E840 IonicContact NZ-OE1 3.86Å; K500-E840 PolarHBondContact NZ-OE1 3.38Å; N501-E840 HydrophobicContact CB-CB 4.43Å; N501-E840 PolarHBondContact ND2-O 3.35Å; E840-D842 PolarHBondContact O-N 2.88Å
841	E	44	Very low	50.8	Low	98 Å²	98	60.6 Å²	60.6	46%	0.458	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-32.1	171	-60	-138	103.8	0	0	111.9	K503 K639 S839	K503-E841 IonicContact NZ-OE1 3.58Å; K503-E841 PolarHBondContact NZ-OE1 3.39Å; K639-E841 IonicContact NZ-OE2 3.49Å; S839-E841 PolarHBondContact O-N 3.3Å
842	D	43.5	Very low	49.6	Very low	24 Å²	24	59.2 Å²	59.2	13%	0.128	30%	0.298	C	S	.	.	S	Bend	trans	-116.4	17.6	-162.7	-44.5	-29.5	0	0	0	112.5	K639 K643 S839 E840 F844 D845 E846	K639-D842 IonicContact NZ-OD1 3.84Å; K639-D842 PolarHBondContact NZ-OD1 3.15Å; K639-D842 IonicContact NZ-OD2 2.97Å; K639-D842 PolarHBondContact NZ-OD2 3.03Å; K643-D842 PolarHBondContact NZ-O 3.16Å; S839-D842 PolarHBondContact O-N 3.03Å; E840-D842 PolarHBondContact O-N 2.88Å; D842-F844 PolarHBondContact O-N 3.27Å; D842-D845 PolarHBondContact O-N 2.85Å; D842-E846 PolarHBondContact O-N 2.98Å
843	D	41.9	Very low	48.3	Very low	44 Å²	44	54.9 Å²	54.9	24%	0.235	28%	0.281	C	S	.	.	H	α-helix	trans	-54.9	-25.9	175.8	-91.9	13.3	0	0	0	113	K500 N501	K500-D843 VanDerWaalsContact NZ-CG 3.34Å; K500-D843 IonicContact NZ-OD1 3.8Å; K500-D843 PolarHBondContact NZ-OD1 3.38Å; K500-D843 VanDerWaalsContact NZ-OD1 3.15Å; K500-D843 IonicContact NZ-OD2 3.9Å; K500-D843 PolarHBondContact NZ-OD2 3.47Å; N501-D843 PolarHBondContact ND2-OD2 3.02Å
844	F	35.2	Very low	47.1	Very low	161 Å²	161	57.7 Å²	57.7	71%	0.706	30%	0.296	S	S	*	.	H	α-helix	trans	-79.9	-35.7	-177.5	-169.9	-97.4	0	0	0	112	D842	D842-F844 PolarHBondContact O-N 3.27Å
845	D	40.4	Very low	45.9	Very low	75 Å²	75	63.9 Å²	63.9	40%	0.401	33%	0.329	S	S	.	.	H	α-helix	trans	-86.2	-22.8	-177.5	-48.9	-44.8	0	0	0	111.7	D842 A847 I848 L849	D842-D845 PolarHBondContact O-N 2.85Å; D845-A847 VanDerWaalsContact C-N 3.35Å; D845-A847 PolarHBondContact O-N 2.95Å; D845-I848 PolarHBondContact O-N 3.43Å; D845-L849 HydrophobicContact CB-CD1 3.96Å; D845-L849 HydrophobicContact CB-CG 4.48Å; D845-L849 WeakPolarHBondContact O-CB 3.42Å; D845-L849 VanDerWaalsContact O-CG 3.28Å; D845-L849 WeakPolarHBondContact O-CG 3.49Å; D845-L849 PolarHBondContact O-N 3.09Å
846	E	46.4	Very low	44.5	Very low	48 Å²	48	67.9 Å²	67.9	22%	0.224	34%	0.342	C	S	.	.	H	α-helix	trans	-54.6	-44.7	-179.1	-170.9	178.1	-116.9	0	0	112.8	W754 D842 M850	W754-E846 WeakPolarHBondContact CZ2-OE1 3.3Å; W754-E846 PolarHBondContact NE1-OE1 3.18Å; D842-E846 PolarHBondContact O-N 2.98Å; E846-M850 HydrophobicContact CG-CE 4.45Å; E846-M850 WeakPolarHBondContact O-CB 3.37Å; E846-M850 WeakPolarHBondContact O-CG 3.49Å; E846-M850 PolarHBondContact O-N 2.97Å; E846-M850 VanDerWaalsContact O-N 3.16Å
847	A	42.1	Very low	42.9	Very low	70 Å²	70	72 Å²	72	58%	0.579	36%	0.362	S	S	*	.	H	α-helix	trans	-67.2	-41.2	179.6	0	0	0	0	0	112.8	D845 E851	D845-A847 VanDerWaalsContact C-N 3.35Å; D845-A847 PolarHBondContact O-N 2.95Å; A847-E851 PolarHBondContact O-N 3.13Å
848	I	36.5	Very low	41.6	Very low	101 Å²	101	78.1 Å²	78.1	52%	0.518	40%	0.395	S	S	.	.	H	α-helix	trans	-74.3	-43.2	-175.9	-60.2	173.4	0	0	0	110.5	D845 M850 E851 A852	D845-I848 PolarHBondContact O-N 3.43Å; I848-M850 VanDerWaalsContact C-N 3.34Å; I848-M850 PolarHBondContact O-N 3.39Å; I848-E851 PolarHBondContact O-N 3.09Å; I848-A852 PolarHBondContact O-N 3.48Å; I848-A852 VanDerWaalsContact O-N 3.13Å
849	L	40	Very low	40.2	Very low	33 Å²	33	84 Å²	84	17%	0.173	42%	0.422	C	S	.	.	H	α-helix	trans	-65	-36.8	177.6	-69.9	169.2	0	0	0	112.1	M640 K643 D845 A853 F887	M640-L849 HydrophobicContact CE-CD2 4.47Å; K643-L849 HydrophobicContact CD-CD1 4.1Å; D845-L849 HydrophobicContact CB-CD1 3.96Å; D845-L849 HydrophobicContact CB-CG 4.48Å; D845-L849 WeakPolarHBondContact O-CB 3.42Å; D845-L849 VanDerWaalsContact O-CG 3.28Å; D845-L849 WeakPolarHBondContact O-CG 3.49Å; D845-L849 PolarHBondContact O-N 3.09Å; L849-A853 WeakPolarHBondContact O-CB 3.35Å; L849-A853 PolarHBondContact O-N 2.87Å; L849-F887 HydrophobicContact CD2-CE1 3.85Å; L849-F887 HydrophobicContact CD2-CZ 3.93Å
850	M	45.4	Very low	39	Very low	37 Å²	37	87.9 Å²	87.9	18%	0.182	45%	0.448	C	S	.	.	H	α-helix	trans	-76.6	-26.7	177.4	-69.3	-146.8	-61.4	0	0	113.8	L647 W754 E846 I848 N854	L647-M850 HydrophobicContact CD2-CG 4.34Å; L647-M850 HydrophobicContact CD2-SD 4.26Å; W754-M850 HydrophobicContact CH2-CE 3.97Å; W754-M850 HydrophobicContact CH2-SD 3.8Å; W754-M850 HydrophobicContact CZ2-CE 4.32Å; E846-M850 HydrophobicContact CG-CE 4.45Å; E846-M850 WeakPolarHBondContact O-CB 3.37Å; E846-M850 WeakPolarHBondContact O-CG 3.49Å; E846-M850 PolarHBondContact O-N 2.97Å; E846-M850 VanDerWaalsContact O-N 3.16Å; I848-M850 VanDerWaalsContact C-N 3.34Å; I848-M850 PolarHBondContact O-N 3.39Å; M850-N854 PolarHBondContact O-N 2.71Å; M850-N854 PolarHBondContact O-ND2 2.94Å
851	E	42.6	Very low	38.1	Very low	149 Å²	149	92.3 Å²	92.3	70%	0.696	48%	0.48	S	S	*	.	H	α-helix	trans	-65.4	-47.5	169.4	-153.7	162.5	-137.7	0	0	109.7	A847 I848 A853 N854 D855	A847-E851 PolarHBondContact O-N 3.13Å; I848-E851 PolarHBondContact O-N 3.09Å; E851-A853 PolarHBondContact O-N 3.2Å; E851-N854 PolarHBondContact O-N 2.94Å; E851-D855 PolarHBondContact O-N 2.96Å
852	A	38.8	Very low	37.3	Very low	28 Å²	28	96.8 Å²	96.8	23%	0.231	50%	0.5	C	S	.	.	H	α-helix	trans	-62.3	-35.1	174.9	0	0	0	0	0	114.2	I848 D855	I848-A852 PolarHBondContact O-N 3.48Å; I848-A852 VanDerWaalsContact O-N 3.13Å; A852-D855 PolarHBondContact O-N 3.02Å
853	A	38.5	Very low	36.7	Very low	18 Å²	18	100.1 Å²	100.1	15%	0.149	53%	0.531	C	S	.	.	H	α-helix	trans	-72.2	-24.4	178.2	0	0	0	0	0	113.8	L849 E851	L849-A853 WeakPolarHBondContact O-CB 3.35Å; L849-A853 PolarHBondContact O-N 2.87Å; E851-A853 PolarHBondContact O-N 3.2Å
854	N	40.2	Very low	36.1	Very low	78 Å²	78	102.7 Å²	102.7	42%	0.417	56%	0.559	S	S	.	*	H	α-helix	trans	-82.4	-16	175.7	-82.6	-92.3	0	0	0	113.1	M850 E851	M850-N854 PolarHBondContact O-N 2.71Å; M850-N854 PolarHBondContact O-ND2 2.94Å; E851-N854 PolarHBondContact O-N 2.94Å
855	D	39	Very low	35.9	Very low	131 Å²	131	101 Å²	101	70%	0.701	56%	0.564	S	S	*	*	S	Bend	trans	-88.9	-0.3	176.5	-90.4	-9.1	0	0	0	113.5	E851 A852 K857	E851-D855 PolarHBondContact O-N 2.96Å; A852-D855 PolarHBondContact O-N 3.02Å; D855-K857 PolarHBondContact O-N 3.07Å
856	W	37.2	Very low	35.3	Very low	146 Å²	146	101.5 Å²	101.5	55%	0.553	58%	0.579	S	S	*	*			trans	-62.9	131	175.4	-171.5	-66.1	0	0	0	111.1	D858 M883	W856-D858 PolarHBondContact NE1-OD1 3.08Å; W856-M883 HydrophobicContact CE3-CE 3.47Å; W856-M883 VanDerWaalsContact CE3-CE 3.47Å; W856-M883 HydrophobicContact CZ3-CE 3.58Å
857	K	30.5	Very low	34.8	Very low	189 Å²	189	105.7 Å²	105.7	82%	0.822	61%	0.61	S	S	*	*			trans	-129.9	129	167.3	-70.1	-174.7	178.7	-179.4	0	109.5	D855 E859	D855-K857 PolarHBondContact O-N 3.07Å; K857-E859 PolarHBondContact O-N 3.45Å
858	D	32.2	Very low	34.1	Very low	132 Å²	132	107.9 Å²	107.9	71%	0.706	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-68.5	125.4	171.9	-86.1	5.2	0	0	0	111.1	W856	W856-D858 PolarHBondContact NE1-OD1 3.08Å
859	E	27.6	Very low	33.7	Very low	140 Å²	140	108.6 Å²	108.6	65%	0.654	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-100.2	136.4	150.6	-75.5	-175.8	158.1	0	0	108.1	K857 K880	K857-E859 PolarHBondContact O-N 3.45Å; E859-K880 IonicContact OE1-NZ 2.65Å; E859-K880 PolarHBondContact OE1-NZ 3.15Å; E859-K880 IonicContact OE2-NZ 3.5Å; E859-K880 PolarHBondContact OE2-NZ 3.45Å
860	P	28.7	Very low	33.2	Very low	105 Å²	105	114 Å²	114	68%	0.682	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-67.4	151.3	177.2	30.2	-35.1	0	0	0	110.6	E862	P860-E862 PolarHBondContact O-N 3.29Å; P860-E862 VanDerWaalsContact O-N 3.15Å
861	P	29.5	Very low	32.3	Very low	132 Å²	132	115.4 Å²	115.4	86%	0.857	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-65.4	116.7	178	26.9	-33.9	0	0	0	110.7
862	E	27.9	Very low	31.6	Very low	191 Å²	191	115.2 Å²	115.2	89%	0.893	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-62.5	143.3	169.7	-76.6	-170.5	128.5	0	0	110.9	P860	P860-E862 PolarHBondContact O-N 3.29Å; P860-E862 VanDerWaalsContact O-N 3.15Å
863	A	30.8	Very low	31	Very low	94 Å²	94	119.7 Å²	119.7	78%	0.777	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-70.7	138.5	173.7	0	0	0	0	0	110.3	P865	A863-P865 WeakPolarHBondContact O-CD 3.32Å
864	A	28.1	Very low	30.5	Very low	98 Å²	98	129 Å²	129	81%	0.81	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-60.6	127.3	-176.9	0	0	0	0	0	112.1
865	P	30.5	Very low	29.8	Very low	126 Å²	126	129.2 Å²	129.2	82%	0.818	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-67.6	143.3	173.8	-19.7	32.5	0	0	0	112.3	A863	A863-P865 WeakPolarHBondContact O-CD 3.32Å
866	A	29.3	Very low	29.3	Very low	86 Å²	86	132.6 Å²	132.6	71%	0.711	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.8	153.2	168.5	0	0	0	0	0	111.2
867	P	34.5	Very low	29	Very low	135 Å²	135	131.7 Å²	131.7	88%	0.877	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-77.9	126.2	-175.6	30.4	-34.4	0	0	0	112.8
868	S	28.5	Very low	28.9	Very low	117 Å²	117	128.7 Å²	128.7	82%	0.818	79%	0.788	S	S	*	*			trans	-144.9	158.2	164.1	63.5	0	0	0	0	110.9
869	C	27.3	Very low	28.8	Very low	116 Å²	116	130.9 Å²	130.9	78%	0.784	79%	0.794	S	S	*	*			trans	-105.9	164.1	-159.6	-60.4	0	0	0	0	115.2
870	T	29.5	Very low	29.1	Very low	147 Å²	147	131 Å²	131	90%	0.902	79%	0.792	S	S	*	*			trans	77.8	150	161.1	75.5	0	0	0	0	118.6
871	G	27.3	Very low	29.3	Very low	65 Å²	65	133.8 Å²	133.8	67%	0.67	79%	0.793	S	S	*	*			trans	113.2	82.2	157	0	0	0	0	0	118.3
872	T	28.6	Very low	29.6	Very low	146 Å²	146	131.1 Å²	131.1	90%	0.896	78%	0.775	S	S	*	*			trans	26.4	125.8	146.2	44.1	0	0	0	0	121
873	S	25.7	Very low	30	Very low	121 Å²	121	124.9 Å²	124.9	85%	0.846	75%	0.746	S	S	*	*			trans	-75.7	147.9	179	47.8	0	0	0	0	115.7
874	F	27.6	Very low	30.2	Very low	213 Å²	213	128.4 Å²	128.4	93%	0.934	74%	0.744	S	S	*	*			trans	-129.6	132.1	157.6	-109.2	-90.1	0	0	0	108.5
875	S	26.6	Very low	30.5	Very low	83 Å²	83	127.8 Å²	127.8	58%	0.58	73%	0.727	S	S	*	*			trans	-77.6	139.8	-179.4	-171.9	0	0	0	0	112.4	D877	S875-D877 PolarHBondContact OG-OD2 3.29Å
876	K	28.1	Very low	30.7	Very low	203 Å²	203	127.9 Å²	127.9	88%	0.883	72%	0.715	S	S	*	*			trans	-135.8	98.4	149.2	-85.2	-170.4	174.4	178.5	0	108.8	T878	K876-T878 PolarHBondContact O-N 3.48Å
877	D	29.7	Very low	31	Very low	127 Å²	127	128.3 Å²	128.3	68%	0.679	70%	0.701	S	S	*	*			trans	-69.1	113.4	179	-70.5	-74.9	0	0	0	112.4	S875	S875-D877 PolarHBondContact OG-OD2 3.29Å
878	T	28.8	Very low	30.8	Very low	125 Å²	125	126.9 Å²	126.9	77%	0.767	69%	0.69	S	S	*	*			trans	-131.7	94.7	156.4	48.6	0	0	0	0	108.9	K876 K880	K876-T878 PolarHBondContact O-N 3.48Å; T878-K880 PolarHBondContact O-N 3.28Å
879	H	30.9	Very low	30.7	Very low	179 Å²	179	135.6 Å²	135.6	83%	0.829	71%	0.705	S	S	*	*			trans	-64.5	89.4	174.5	-84.7	-70.6	0	0	0	111.2	K881	H879-K881 PolarHBondContact O-N 3.33Å
880	K	33.1	Very low	30.9	Very low	142 Å²	142	136.6 Å²	136.6	62%	0.617	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-62.1	116.5	156.2	-71.7	-172.5	177.6	-177.8	0	107.3	E859 T878	E859-K880 IonicContact OE1-NZ 2.65Å; E859-K880 PolarHBondContact OE1-NZ 3.15Å; E859-K880 IonicContact OE2-NZ 3.5Å; E859-K880 PolarHBondContact OE2-NZ 3.45Å; T878-K880 PolarHBondContact O-N 3.28Å
881	K	32.2	Very low	31	Very low	163 Å²	163	136 Å²	136	71%	0.709	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-78.3	132.8	171.3	-67.7	-178.1	-179.2	178.6	0	109.6	H879	H879-K881 PolarHBondContact O-N 3.33Å
882	T	36.7	Very low	31.2	Very low	76 Å²	76	139.9 Å²	139.9	47%	0.466	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-94.2	165.1	168.3	71.9	0	0	0	0	110.2	K884 D885	T882-K884 PolarHBondContact O-N 2.84Å; T882-K884 PolarHBondContact OG1-N 2.8Å; T882-D885 WeakPolarHBondContact CA-OD2 3.45Å; T882-D885 WeakPolarHBondContact CB-OD2 3.33Å; T882-D885 PolarHBondContact N-OD2 3.41Å; T882-D885 WeakPolarHBondContact O-CB 3.46Å; T882-D885 PolarHBondContact O-N 2.73Å; T882-D885 PolarHBondContact OG1-OD2 2.73Å
883	M	36.6	Very low	31.3	Very low	61 Å²	61	139.6 Å²	139.6	30%	0.3	68%	0.679	S	S	.	*	G	3₁₀ helix	trans	-61.4	-27.1	177.3	-157.7	-171.9	-71.5	0	0	112.6	W856 D885 F886 F887	W856-M883 HydrophobicContact CE3-CE 3.47Å; W856-M883 VanDerWaalsContact CE3-CE 3.47Å; W856-M883 HydrophobicContact CZ3-CE 3.58Å; M883-D885 VanDerWaalsContact C-N 3.26Å; M883-D885 PolarHBondContact O-N 2.82Å; M883-F886 WeakPolarHBondContact O-CB 3.14Å; M883-F886 PolarHBondContact O-N 2.97Å; M883-F887 HydrophobicContact CG-CD2 4.25Å; M883-F887 HydrophobicContact CG-CE2 3.57Å; M883-F887 HydrophobicContact CG-CZ 4.1Å; M883-F887 VanDerWaalsContact O-CD2 3.3Å; M883-F887 WeakPolarHBondContact O-CD2 3.45Å; M883-F887 PolarHBondContact O-N 3.16Å; M883-F887 HydrophobicContact SD-CE2 3.64Å; M883-F887 HydrophobicContact SD-CZ 4.02Å
884	K	33.8	Very low	31.7	Very low	167 Å²	167	140.8 Å²	140.8	73%	0.726	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-64.1	-28.7	173.7	-71.6	-178.8	175.2	176.4	0	113.4	T882 F886 F887 T888	T882-K884 PolarHBondContact O-N 2.84Å; T882-K884 PolarHBondContact OG1-N 2.8Å; K884-F886 PolarHBondContact O-N 3.03Å; K884-F887 PolarHBondContact O-N 2.89Å; K884-T888 PolarHBondContact O-OG1 3.16Å
885	D	34.3	Very low	31.9	Very low	86 Å²	86	135.9 Å²	135.9	46%	0.46	65%	0.651	S	S	.	*	G	3₁₀ helix	trans	-77.3	-12	178.9	-53	-56.7	0	0	0	112.4	T882 M883	T882-D885 WeakPolarHBondContact CA-OD2 3.45Å; T882-D885 WeakPolarHBondContact CB-OD2 3.33Å; T882-D885 PolarHBondContact N-OD2 3.41Å; T882-D885 WeakPolarHBondContact O-CB 3.46Å; T882-D885 PolarHBondContact O-N 2.73Å; T882-D885 PolarHBondContact OG1-OD2 2.73Å; M883-D885 VanDerWaalsContact C-N 3.26Å; M883-D885 PolarHBondContact O-N 2.82Å
886	F	35.1	Very low	32.3	Very low	127 Å²	127	139.7 Å²	139.7	56%	0.557	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-36.2	167.2	-103.5	-86.4	0	0	0	112.2	M883 K884 T888	M883-F886 WeakPolarHBondContact O-CB 3.14Å; M883-F886 PolarHBondContact O-N 2.97Å; K884-F886 PolarHBondContact O-N 3.03Å; F886-T888 VanDerWaalsContact C-N 3.26Å; F886-T888 PolarHBondContact O-N 3.17Å
887	F	36	Very low	32.6	Very low	96 Å²	96	134.8 Å²	134.8	42%	0.421	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	13.5	-178.6	-61	-49.2	0	0	0	115.1	M640 L849 M883 K884	M640-F887 HydrophobicContact CE-CD1 3.62Å; M640-F887 HydrophobicContact CE-CD2 4.12Å; M640-F887 HydrophobicContact CE-CE1 3.36Å; M640-F887 HydrophobicContact CE-CE2 3.87Å; M640-F887 HydrophobicContact CE-CG 4.01Å; M640-F887 HydrophobicContact CE-CZ 3.5Å; M640-F887 VanDerWaalsContact CE-CZ 3.5Å; L849-F887 HydrophobicContact CD2-CE1 3.85Å; L849-F887 HydrophobicContact CD2-CZ 3.93Å; M883-F887 HydrophobicContact CG-CD2 4.25Å; M883-F887 HydrophobicContact CG-CE2 3.57Å; M883-F887 HydrophobicContact CG-CZ 4.1Å; M883-F887 VanDerWaalsContact O-CD2 3.3Å; M883-F887 WeakPolarHBondContact O-CD2 3.45Å; M883-F887 PolarHBondContact O-N 3.16Å; M883-F887 HydrophobicContact SD-CE2 3.64Å; M883-F887 HydrophobicContact SD-CZ 4.02Å; K884-F887 PolarHBondContact O-N 2.89Å
888	T	30.1	Very low	32.9	Very low	105 Å²	105	135.5 Å²	135.5	64%	0.644	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	25.5	-178.9	36.7	0	0	0	0	113.4	K884 F886	K884-T888 PolarHBondContact O-OG1 3.16Å; F886-T888 VanDerWaalsContact C-N 3.26Å; F886-T888 PolarHBondContact O-N 3.17Å
889	R	26.9	Very low	33.2	Very low	299 Å²	299	136.5 Å²	136.5	100%	1.128	62%	0.623	S	S	*	*			trans	-137.8	0	174.8	-76	-171	169.3	-158.5	-4.1	112.5

Retrieved 889 of 889 residues in 566.6 ms (Link to these results)

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