G4V9U9_SCHMA Loading...

Major vault protein

AlphaFold DB , UniProt , Accession G4V9U9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 870 aa.

						>G4V9U9_SCHMA|G4V9U9
MKSNPDSPIISISPRHYIHVLNLNTHVTSLVVGPKTYVCQQDEKIVLGPEELTVVPTMMYCVIRNPVITDKDGVPVVDKFGQVKVRMGDEEYRFAQDPFPLYPGETLKDIVRPLPVVLPNSALRLRAVSDFEDGNVRRIAGEEWLFEGPGTYYPRKEVEIVKCEQAKVILVNSALVMEATKDCVDRSGVPRVYGERWLVTTPGAYLPGVYEQIVDERKAITLTDRRAICVKAVKSHCDKFGKYRKAGEEWLITHEDAEYHICSALEEFVREVEVTILGVHQFCVVVNPWDENGVPQLGRKLLVRGEKSFFLRPGECLERGVQDAYILQNDEGLILRAKEQFVEDICGDAISEGESVKQKKCIRRPGDRWMLRGPIEYIPPVEVEVIDRRNVIPLDCNEGIYVRNTQTGQVRAVIGEAYMLNQDEELWEKKLPSEVVQLLESNIDPFADRGVRSIQDSVDRLDPTRVVTFRVPHNAAVQIYDYKNKRARVEFGPNLAMLGPDEQFTRLSLSGGKPKKPNVIKSLCLLLGPDFCTDVVIVETADHARLSLQLSYNWVFDVSPSCSAADAAKLFSVPDFVGDACKAIASRVRGTVASVQFDDFHKHSSRIIRASVFGLDEAGKVRDRLVFPQNNLHITSVDVQSVEPVDQRTRDSLQKSVQLAIEITTNSQEAAARHEAERLEQEARGRLERQRIEDEAAAEQARRNLLEIRVQLAALESNSQAKAEAESRAEANRISSQAAVEEAKLRAEALSIETNAELERLKLARAAEIAYIKEKNELALKYKADETEIEKSRFISMVNVLGADTLRAMATAESDNSLRMLNALGLQSTLITDGTTPVNLLTTAHGLIGSVFEGSSRKRASEVLGNVDGK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36	Very low	59.3	Low	241 Å²	241	106.2 Å²	106.2	100%	1.187	58%	0.582	S	S	*	*				0	132.1	0	-68.1	170.7	175.8	0	0	107	S3	M1-S3 PolarHBondContact O-N 2.94Å; M1-S3 VanDerWaalsContact O-N 3.11Å
2	K	43	Very low	61.6	Low	217 Å²	217	97.5 Å²	97.5	94%	0.943	54%	0.535	S	S	*	.			trans	-69.5	107	165.6	-74.3	-174.4	176.1	-175.9	0	106.4	N4	K2-N4 PolarHBondContact O-N 3.27Å
3	S	47.2	Very low	63.6	Low	50 Å²	50	94.2 Å²	94.2	35%	0.35	52%	0.523	S	S	.	.			trans	-56.2	123.3	170.1	42.7	0	0	0	0	107.6	M1 P5	M1-S3 PolarHBondContact O-N 2.94Å; M1-S3 VanDerWaalsContact O-N 3.11Å; S3-P5 WeakPolarHBondContact O-CD 3.36Å; S3-P5 VanDerWaalsContact O-N 3.14Å
4	N	49.3	Very low	65.3	Low	108 Å²	108	93.6 Å²	93.6	58%	0.578	53%	0.526	S	S	*	.			trans	-59.1	119.6	175.4	-165.5	31	0	0	0	107.1	K2 D6 S7	K2-N4 PolarHBondContact O-N 3.27Å; N4-D6 PolarHBondContact O-N 2.82Å; N4-S7 WeakPolarHBondContact O-CB 3.47Å; N4-S7 PolarHBondContact O-N 3.01Å
5	P	52.4	Low	66.8	Low	100 Å²	100	98.5 Å²	98.5	65%	0.649	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.6	-173.3	24.4	-33.4	0	0	0	112.5	S3 S7	S3-P5 WeakPolarHBondContact O-CD 3.36Å; S3-P5 VanDerWaalsContact O-N 3.14Å; P5-S7 VanDerWaalsContact C-N 3.3Å
6	D	53.5	Low	68.4	Low	141 Å²	141	95.1 Å²	95.1	75%	0.754	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	6.5	173	-55.5	-38.8	0	0	0	113.3	N4	N4-D6 PolarHBondContact O-N 2.82Å
7	S	60.1	Low	69.8	Low	45 Å²	45	90.1 Å²	90.1	32%	0.315	48%	0.484	S	S	.	.			trans	-71.3	123.7	167.3	178.7	0	0	0	0	108.9	N4 P5 I9	N4-S7 WeakPolarHBondContact O-CB 3.47Å; N4-S7 PolarHBondContact O-N 3.01Å; P5-S7 VanDerWaalsContact C-N 3.3Å; S7-I9 WeakPolarHBondContact CB-O 3.45Å; S7-I9 PolarHBondContact O-N 3.1Å; S7-I9 PolarHBondContact OG-N 3.47Å; S7-I9 PolarHBondContact OG-O 2.84Å
8	P	68.7	Low	70.9	Confident	83 Å²	83	85.1 Å²	85.1	54%	0.539	46%	0.457	S	S	.	.	S	Bend	trans	-66.4	-5.1	175.8	28.5	-35.2	0	0	0	112.9	V38 C39	P8-V38 CarbonylContact O-C 3.46Å; P8-V38 VanDerWaalsContact O-CA 3.28Å; P8-V38 WeakPolarHBondContact O-CA 3.18Å; P8-V38 WeakPolarHBondContact O-CG1 3.25Å; P8-C39 PolarHBondContact O-N 3.38Å
9	I	78.8	Confident	71.9	Confident	93 Å²	93	81.3 Å²	81.3	48%	0.477	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	125.5	177.6	-53.2	176.4	0	0	0	109	S7 T36 V38	S7-I9 WeakPolarHBondContact CB-O 3.45Å; S7-I9 PolarHBondContact O-N 3.1Å; S7-I9 PolarHBondContact OG-N 3.47Å; S7-I9 PolarHBondContact OG-O 2.84Å; I9-T36 HydrophobicContact CG2-CG2 3.48Å; I9-T36 VanDerWaalsContact CG2-CG2 3.48Å; I9-V38 HydrophobicContact CG1-CG1 4.32Å; I9-V38 HydrophobicContact CG1-CG2 4.28Å
10	I	79.6	Confident	72.8	Confident	8 Å²	8	77.4 Å²	77.4	4%	0.041	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.3	173.2	-160.8	165.9	0	0	0	110.5	I12 I18 T36 Y37 I45 P49	I10-I12 HydrophobicContact CG2-CG1 4.41Å; I10-I18 HydrophobicContact CG2-CD1 3.83Å; I10-T36 CarbonylContact O-C 3.57Å; I10-T36 WeakPolarHBondContact O-CA 3.37Å; I10-Y37 PolarHBondContact N-O 3.03Å; I10-Y37 PolarHBondContact O-N 2.92Å; I10-I45 HydrophobicContact CB-CD1 4.02Å; I10-I45 HydrophobicContact CD1-CD1 3.65Å; I10-I45 HydrophobicContact CG1-CD1 4.45Å; I10-I45 HydrophobicContact CG2-CD1 3.69Å; I10-P49 HydrophobicContact CD1-CG 3.81Å; I10-P49 HydrophobicContact CG1-CG 4.34Å
11	S	83.5	Confident	73.5	Confident	82 Å²	82	75.3 Å²	75.3	57%	0.573	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	108.8	175.1	-171.6	0	0	0	0	109.2	S13	S11-S13 PolarHBondContact O-N 3.08Å
12	I	86.8	Confident	75.9	Confident	2 Å²	2	65 Å²	65	1%	0.01	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	111.5	176	-45.6	163.7	0	0	0	107.2	I10 H16 I18 V31 P34 K35	I10-I12 HydrophobicContact CG2-CG1 4.41Å; I12-H16 HydrophobicContact CG2-CB 3.97Å; I12-H16 VanDerWaalsContact CG2-O 3.29Å; I12-H16 WeakPolarHBondContact CG2-O 3.44Å; I12-I18 HydrophobicContact CD1-CD1 3.71Å; I12-I18 HydrophobicContact CD1-CG1 3.69Å; I12-I18 HydrophobicContact CG1-CD1 4.04Å; I12-I18 HydrophobicContact CG1-CG1 4.17Å; I12-I18 HydrophobicContact CG1-CG2 4.35Å; I12-V31 HydrophobicContact CD1-CB 3.91Å; I12-V31 HydrophobicContact CD1-CG1 3.46Å; I12-V31 VanDerWaalsContact CD1-CG1 3.46Å; I12-P34 WeakPolarHBondContact O-CA 3.47Å; I12-K35 VanDerWaalsContact CB-O 3.27Å; I12-K35 WeakPolarHBondContact CB-O 3.45Å; I12-K35 WeakPolarHBondContact CG1-O 3.47Å; I12-K35 PolarHBondContact N-O 3.02Å; I12-K35 PolarHBondContact O-N 3.45Å; I12-K35 VanDerWaalsContact O-N 3.07Å
13	S	88.2	Confident	77.9	Confident	54 Å²	54	58.3 Å²	58.3	38%	0.378	33%	0.328	S	S	.	.			trans	-61.3	161	178.2	-68.6	0	0	0	0	112.7	S11 R15 H16	S11-S13 PolarHBondContact O-N 3.08Å; S13-R15 PolarHBondContact O-N 3.19Å; S13-H16 PolarHBondContact O-N 3.02Å; S13-H16 VanDerWaalsContact O-N 3.13Å
14	P	87.2	Confident	79.6	Confident	87 Å²	87	61.8 Å²	61.8	57%	0.565	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	141.4	163.8	-20.8	30.2	0	0	0	110.7	H16 P34	P14-H16 PolarHBondContact O-N 2.91Å; P14-H16 PolarHBondContact O-ND1 2.67Å; P14-P34 HydrophobicContact CG-CB 4.03Å
15	R	88.3	Confident	81.2	Confident	167 Å²	167	60.3 Å²	60.3	63%	0.63	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	27.5	-175.7	-58.4	-174.9	170.7	169.8	-4.1	115.3	S13 L52	S13-R15 PolarHBondContact O-N 3.19Å; R15-L52 HydrophobicContact CB-CD1 3.9Å; R15-L52 HydrophobicContact CB-CG 4.2Å; R15-L52 HydrophobicContact CG-CD1 4.09Å; R15-L52 WeakPolarHBondContact O-CG 3.47Å; R15-L52 PolarHBondContact O-N 3.5Å
16	H	92	Very high	82.6	Confident	44 Å²	44	62.1 Å²	62.1	20%	0.204	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	158.7	167.1	-68.6	59.1	0	0	0	110.8	I12 S13 P14 G33 P49 E50	I12-H16 HydrophobicContact CG2-CB 3.97Å; I12-H16 VanDerWaalsContact CG2-O 3.29Å; I12-H16 WeakPolarHBondContact CG2-O 3.44Å; S13-H16 PolarHBondContact O-N 3.02Å; S13-H16 VanDerWaalsContact O-N 3.13Å; P14-H16 PolarHBondContact O-N 2.91Å; P14-H16 PolarHBondContact O-ND1 2.67Å; H16-G33 PolarHBondContact O-N 3.24Å; H16-P49 HydrophobicContact CB-CB 4.35Å; H16-E50 CarbonylContact C-O 3.58Å; H16-E50 WeakPolarHBondContact CA-O 3.32Å; H16-E50 WeakPolarHBondContact CB-O 3.49Å
17	Y	91.9	Very high	84.1	Confident	9 Å²	9	55.9 Å²	55.9	4%	0.035	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	160.2	172.8	71.1	-82.4	0	0	0	111.9	H19 L30 V31 L47 P49 E50 E51 L52 P100 L101	Y17-H19 AromaticContact CD2-CD2 3.96Å; Y17-H19 AromaticContact CD2-NE2 3.85Å; Y17-H19 AromaticContact CE2-NE2 3.52Å; Y17-L30 HydrophobicContact CD2-CD1 3.37Å; Y17-L30 HydrophobicContact CE2-CD1 4.23Å; Y17-L30 HydrophobicContact CG-CD1 3.92Å; Y17-V31 CarbonylContact C-O 3.57Å; Y17-V31 VanDerWaalsContact CA-O 3.24Å; Y17-V31 WeakPolarHBondContact CA-O 3.37Å; Y17-V31 WeakPolarHBondContact CB-O 2.83Å; Y17-L47 HydrophobicContact CE2-CD2 3.91Å; Y17-P49 WeakPolarHBondContact O-CA 3.42Å; Y17-E50 HydrophobicContact CD1-CB 4.26Å; Y17-E50 WeakPolarHBondContact CD1-O 3.47Å; Y17-E50 HydrophobicContact CE1-CB 3.71Å; Y17-E50 HydrophobicContact CE2-CB 4.35Å; Y17-E50 PolarHBondContact N-O 2.9Å; Y17-E50 PolarHBondContact O-N 3.08Å; Y17-E51 WeakPolarHBondContact CE1-O 3.45Å; Y17-L52 HydrophobicContact CD1-CD2 3.97Å; Y17-P100 HydrophobicContact CD1-CB 3.79Å; Y17-P100 HydrophobicContact CD2-CB 4.16Å; Y17-P100 HydrophobicContact CE1-CB 4.21Å; Y17-P100 HydrophobicContact CG-CB 3.75Å; Y17-L101 WeakPolarHBondContact CE2-O 3.42Å
18	I	90.4	Very high	85.4	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	157.3	171.2	60.8	173.1	0	0	0	110.4	I10 I12 V20 V31 Y37 I45 L47 P49	I10-I18 HydrophobicContact CG2-CD1 3.83Å; I12-I18 HydrophobicContact CD1-CD1 3.71Å; I12-I18 HydrophobicContact CD1-CG1 3.69Å; I12-I18 HydrophobicContact CG1-CD1 4.04Å; I12-I18 HydrophobicContact CG1-CG1 4.17Å; I12-I18 HydrophobicContact CG1-CG2 4.35Å; I18-V20 HydrophobicContact CD1-CG2 3.66Å; I18-V20 HydrophobicContact CG1-CG2 4.03Å; I18-V31 HydrophobicContact CD1-CB 4.4Å; I18-V31 HydrophobicContact CG1-CB 3.84Å; I18-V31 HydrophobicContact CG1-CG2 4.37Å; I18-V31 PolarHBondContact N-O 3.41Å; I18-V31 PolarHBondContact O-N 3.21Å; I18-Y37 HydrophobicContact CD1-CD1 4.33Å; I18-Y37 HydrophobicContact CD1-CG 4.31Å; I18-I45 HydrophobicContact CB-CG2 4.32Å; I18-I45 HydrophobicContact CD1-CD1 4.27Å; I18-I45 HydrophobicContact CD1-CG1 4.41Å; I18-L47 CarbonylContact C-O 3.55Å; I18-L47 VanDerWaalsContact CA-O 3.25Å; I18-L47 WeakPolarHBondContact CA-O 3.48Å; I18-L47 WeakPolarHBondContact CB-O 3.41Å; I18-P49 HydrophobicContact CG2-CB 4.16Å; I18-P49 HydrophobicContact CG2-CG 4.02Å
19	H	90	Very high	86.2	Confident	14 Å²	14	53.7 Å²	53.7	7%	0.065	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129.7	164.8	-63.8	171.1	0	0	0	109.8	Y17 T28 S29 I45 V46 L47 L101 P103	Y17-H19 AromaticContact CD2-CD2 3.96Å; Y17-H19 AromaticContact CD2-NE2 3.85Å; Y17-H19 AromaticContact CE2-NE2 3.52Å; H19-T28 HydrophobicContact CB-CG2 3.73Å; H19-S29 CarbonylContact C-O 3.47Å; H19-S29 WeakPolarHBondContact CA-O 3.09Å; H19-I45 WeakPolarHBondContact O-CA 3.45Å; H19-V46 HydrophobicContact CB-CG2 4.14Å; H19-V46 WeakPolarHBondContact O-CG2 3.31Å; H19-V46 PolarHBondContact O-N 3.41Å; H19-L47 HydrophobicContact CB-CB 3.73Å; H19-L47 VanDerWaalsContact CE1-CD2 3.45Å; H19-L47 WeakPolarHBondContact CE1-CD2 3.37Å; H19-L47 PolarHBondContact N-O 3.16Å; H19-L47 WeakPolarHBondContact ND1-CD2 3.14Å; H19-L47 PolarHBondContact O-N 3.49Å; H19-L101 PolarHBondContact CE1-O 2.87Å; H19-L101 PolarHBondContact NE2-O 2.87Å; H19-P103 VanDerWaalsContact CE1-CA 3.5Å; H19-P103 WeakPolarHBondContact CE1-CA 3.34Å
20	V	88.9	Confident	86.7	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	115.3	-178.7	-175.4	0	0	0	0	109.1	I18 T28 S29 V31 Y37 E43 I45	I18-V20 HydrophobicContact CD1-CG2 3.66Å; I18-V20 HydrophobicContact CG1-CG2 4.03Å; V20-T28 CarbonylContact O-C 3.49Å; V20-T28 WeakPolarHBondContact O-CA 3.32Å; V20-S29 PolarHBondContact N-O 3.33Å; V20-S29 PolarHBondContact O-N 3.22Å; V20-V31 HydrophobicContact CG2-CG2 4.02Å; V20-Y37 HydrophobicContact CG1-CE1 4.05Å; V20-Y37 HydrophobicContact CG2-CD1 4.26Å; V20-Y37 HydrophobicContact CG2-CE1 3.9Å; V20-E43 HydrophobicContact CG1-CB 3.82Å; V20-E43 HydrophobicContact CG1-CG 4.13Å; V20-I45 HydrophobicContact CG2-CG1 4.47Å
21	L	87.5	Confident	87.1	Confident	34 Å²	34	51.5 Å²	51.5	18%	0.178	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	117.7	173	173.8	67.7	0	0	0	109.4	L23 H26 V27 T28 E43 K44 V46	L21-L23 HydrophobicContact CD2-CD2 4.23Å; L21-L23 HydrophobicContact CG-CD2 4.49Å; L21-H26 VanDerWaalsContact CD1-C 3.47Å; L21-H26 WeakPolarHBondContact CD1-O 3.47Å; L21-V27 WeakPolarHBondContact CA-O 3.4Å; L21-T28 WeakPolarHBondContact CD1-OG1 3.39Å; L21-E43 CarbonylContact O-C 3.57Å; L21-E43 WeakPolarHBondContact O-CA 3.38Å; L21-K44 PolarHBondContact N-O 3.14Å; L21-K44 PolarHBondContact O-N 3.15Å; L21-V46 HydrophobicContact CB-CG1 4.34Å; L21-V46 HydrophobicContact CB-CG2 3.7Å; L21-V46 HydrophobicContact CD2-CG1 4.43Å
22	N	86.6	Confident	87.4	Confident	26 Å²	26	50.6 Å²	50.6	14%	0.139	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	125.2	164.1	-177.5	-75.3	0	0	0	109.2	N24 T25 H26 V27 D42 E43	N22-N24 WeakPolarHBondContact OD1-CA 3.46Å; N22-N24 WeakPolarHBondContact OD1-CB 3.25Å; N22-N24 PolarHBondContact OD1-N 3.35Å; N22-T25 WeakPolarHBondContact CB-OG1 3.37Å; N22-T25 PolarHBondContact OD1-N 3.01Å; N22-T25 PolarHBondContact OD1-OG1 2.9Å; N22-H26 WeakPolarHBondContact O-CA 3.34Å; N22-H26 PolarHBondContact O-N 3.17Å; N22-V27 PolarHBondContact N-O 3.39Å; N22-D42 CarbonylContact C-O 3.57Å; N22-D42 WeakPolarHBondContact CA-O 3.25Å; N22-D42 PolarHBondContact ND2-O 3.38Å; N22-D42 PolarHBondContact ND2-OD2 3.16Å; N22-E43 HydrophobicContact CB-CG 4.47Å
23	L	84.1	Confident	87.3	Confident	76 Å²	76	51.2 Å²	51.2	40%	0.398	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-22.5	-174.3	-61.4	175.1	0	0	0	113.1	L21 D42 K44	L21-L23 HydrophobicContact CD2-CD2 4.23Å; L21-L23 HydrophobicContact CG-CD2 4.49Å; L23-D42 WeakPolarHBondContact CB-O 3.2Å; L23-D42 PolarHBondContact N-O 3.28Å; L23-K44 HydrophobicContact CD2-CB 4.17Å; L23-K44 HydrophobicContact CG-CB 4.47Å
24	N	84.2	Confident	87.3	Confident	123 Å²	123	53.5 Å²	53.5	66%	0.658	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-40	178	-71.4	-38.2	0	0	0	112	N22 D42	N22-N24 WeakPolarHBondContact OD1-CA 3.46Å; N22-N24 WeakPolarHBondContact OD1-CB 3.25Å; N22-N24 PolarHBondContact OD1-N 3.35Å; N24-D42 WeakPolarHBondContact ND2-CB 3.28Å; N24-D42 PolarHBondContact ND2-OD2 3.08Å
25	T	81.6	Confident	87.2	Confident	76 Å²	76	54.9 Å²	54.9	47%	0.466	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-13	-178.6	60.8	0	0	0	0	113.6	N22 V27	N22-T25 WeakPolarHBondContact CB-OG1 3.37Å; N22-T25 PolarHBondContact OD1-N 3.01Å; N22-T25 PolarHBondContact OD1-OG1 2.9Å; T25-V27 PolarHBondContact O-N 3.37Å; T25-V27 WeakPolarHBondContact OG1-CB 3.5Å; T25-V27 PolarHBondContact OG1-N 3.23Å
26	H	82.6	Confident	87	Confident	138 Å²	138	51 Å²	51	64%	0.639	28%	0.283	S	S	*	.			trans	56.2	20.8	-167.6	-65.4	-60.1	0	0	0	114.7	L21 N22	L21-H26 VanDerWaalsContact CD1-C 3.47Å; L21-H26 WeakPolarHBondContact CD1-O 3.47Å; N22-H26 WeakPolarHBondContact O-CA 3.34Å; N22-H26 PolarHBondContact O-N 3.17Å
27	V	85.4	Confident	86.6	Confident	10 Å²	10	50.7 Å²	50.7	6%	0.061	28%	0.28	C	S	.	.			trans	-88.1	128.1	179.4	174.4	0	0	0	0	110.4	L21 N22 T25 F80 Q82	L21-V27 WeakPolarHBondContact CA-O 3.4Å; N22-V27 PolarHBondContact N-O 3.39Å; T25-V27 PolarHBondContact O-N 3.37Å; T25-V27 WeakPolarHBondContact OG1-CB 3.5Å; T25-V27 PolarHBondContact OG1-N 3.23Å; V27-F80 HydrophobicContact CG2-CB 3.88Å; V27-F80 WeakPolarHBondContact CG2-O 3.48Å; V27-Q82 HydrophobicContact CG1-CB 4.37Å; V27-Q82 HydrophobicContact CG2-CB 4.41Å
28	T	87.6	Confident	86.3	Confident	27 Å²	27	53.9 Å²	53.9	17%	0.166	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	114.5	174.6	-53.3	0	0	0	0	110.1	H19 V20 L21 V46 Q82 P103	H19-T28 HydrophobicContact CB-CG2 3.73Å; V20-T28 CarbonylContact O-C 3.49Å; V20-T28 WeakPolarHBondContact O-CA 3.32Å; L21-T28 WeakPolarHBondContact CD1-OG1 3.39Å; T28-V46 HydrophobicContact CG2-CG2 3.85Å; T28-Q82 PolarHBondContact O-OE1 3.02Å; T28-P103 HydrophobicContact CG2-CB 3.81Å; T28-P103 HydrophobicContact CG2-CG 3.82Å; T28-P103 WeakPolarHBondContact O-CG 3.22Å
29	S	85.5	Confident	85.8	Confident	56 Å²	56	54.8 Å²	54.8	39%	0.392	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	146	-179.7	-61.5	0	0	0	0	111.9	H19 V20	H19-S29 CarbonylContact C-O 3.47Å; H19-S29 WeakPolarHBondContact CA-O 3.09Å; V20-S29 PolarHBondContact N-O 3.33Å; V20-S29 PolarHBondContact O-N 3.22Å
30	L	89	Confident	85.5	Confident	39 Å²	39	59.7 Å²	59.7	20%	0.204	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	132.1	171.7	174.4	66.3	0	0	0	110.5	Y17 V32 P100 Y102	Y17-L30 HydrophobicContact CD2-CD1 3.37Å; Y17-L30 HydrophobicContact CE2-CD1 4.23Å; Y17-L30 HydrophobicContact CG-CD1 3.92Å; L30-V32 HydrophobicContact CD1-CG2 4.36Å; L30-V32 HydrophobicContact CD2-CG2 4.12Å; L30-V32 HydrophobicContact CG-CG2 4.06Å; L30-P100 HydrophobicContact CD1-CB 4.03Å; L30-P100 HydrophobicContact CD2-CB 3.95Å; L30-P100 HydrophobicContact CD2-CG 3.66Å; L30-Y102 HydrophobicContact CB-CD1 4.35Å; L30-Y102 HydrophobicContact CB-CE1 4.46Å; L30-Y102 HydrophobicContact CD2-CD1 3.67Å; L30-Y102 HydrophobicContact CD2-CE1 3.39Å; L30-Y102 HydrophobicContact CD2-CE2 4.41Å; L30-Y102 HydrophobicContact CD2-CG 4.28Å
31	V	88.4	Confident	85.2	Confident	16 Å²	16	69.2 Å²	69.2	10%	0.097	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	119	170.5	-168.3	0	0	0	0	109.6	I12 Y17 I18 V20 K35 Y37	I12-V31 HydrophobicContact CD1-CB 3.91Å; I12-V31 HydrophobicContact CD1-CG1 3.46Å; I12-V31 VanDerWaalsContact CD1-CG1 3.46Å; Y17-V31 CarbonylContact C-O 3.57Å; Y17-V31 VanDerWaalsContact CA-O 3.24Å; Y17-V31 WeakPolarHBondContact CA-O 3.37Å; Y17-V31 WeakPolarHBondContact CB-O 2.83Å; I18-V31 HydrophobicContact CD1-CB 4.4Å; I18-V31 HydrophobicContact CG1-CB 3.84Å; I18-V31 HydrophobicContact CG1-CG2 4.37Å; I18-V31 PolarHBondContact N-O 3.41Å; I18-V31 PolarHBondContact O-N 3.21Å; V20-V31 HydrophobicContact CG2-CG2 4.02Å; V31-K35 HydrophobicContact CG1-CD 4.17Å; V31-Y37 HydrophobicContact CB-CD2 4.43Å; V31-Y37 HydrophobicContact CG1-CD2 3.85Å; V31-Y37 HydrophobicContact CG1-CE2 4.43Å; V31-Y37 HydrophobicContact CG2-CD2 3.96Å; V31-Y37 HydrophobicContact CG2-CE2 3.82Å
32	V	88.7	Confident	85	Confident	62 Å²	62	69.9 Å²	69.9	38%	0.376	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141	178.8	-171.2	0	0	0	0	109.9	L30 L52 P100	L30-V32 HydrophobicContact CD1-CG2 4.36Å; L30-V32 HydrophobicContact CD2-CG2 4.12Å; L30-V32 HydrophobicContact CG-CG2 4.06Å; V32-L52 HydrophobicContact CG1-CD2 4.29Å; V32-P100 HydrophobicContact CG2-CB 4.28Å; V32-P100 HydrophobicContact CG2-CG 4Å
33	G	86.2	Confident	85	Confident	15 Å²	15	70.6 Å²	70.6	16%	0.155	38%	0.38	C	S	.	.	S	Bend	trans	-83.6	172.7	175.7	0	0	0	0	0	114	H16	H16-G33 PolarHBondContact O-N 3.24Å
34	P	87.7	Confident	85.1	Confident	103 Å²	103	72.9 Å²	72.9	67%	0.669	39%	0.387	S	S	*	.	S	Bend	cis	-80.9	118	5.5	30.2	-32.5	0	0	0	112.5	I12 P14	I12-P34 WeakPolarHBondContact O-CA 3.47Å; P14-P34 HydrophobicContact CG-CB 4.03Å
35	K	84.5	Confident	85.2	Confident	115 Å²	115	68.5 Å²	68.5	50%	0.5	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	131.3	180	-171.7	175.5	-179.4	-177.4	0	110.6	I12 V31 Y37	I12-K35 VanDerWaalsContact CB-O 3.27Å; I12-K35 WeakPolarHBondContact CB-O 3.45Å; I12-K35 WeakPolarHBondContact CG1-O 3.47Å; I12-K35 PolarHBondContact N-O 3.02Å; I12-K35 PolarHBondContact O-N 3.45Å; I12-K35 VanDerWaalsContact O-N 3.07Å; V31-K35 HydrophobicContact CG1-CD 4.17Å; K35-Y37 PolarHBondContact O-N 2.82Å
36	T	85.1	Confident	85.4	Confident	87 Å²	87	68.6 Å²	68.6	53%	0.534	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	114.1	163.7	-50.1	0	0	0	0	107.8	I9 I10	I9-T36 HydrophobicContact CG2-CG2 3.48Å; I9-T36 VanDerWaalsContact CG2-CG2 3.48Å; I10-T36 CarbonylContact O-C 3.57Å; I10-T36 WeakPolarHBondContact O-CA 3.37Å
37	Y	83.5	Confident	85.5	Confident	36 Å²	36	65.1 Å²	65.1	14%	0.141	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.4	177.4	-167.6	-91.5	0	0	0	109.7	I10 I18 V20 V31 K35 E43	I10-Y37 PolarHBondContact N-O 3.03Å; I10-Y37 PolarHBondContact O-N 2.92Å; I18-Y37 HydrophobicContact CD1-CD1 4.33Å; I18-Y37 HydrophobicContact CD1-CG 4.31Å; V20-Y37 HydrophobicContact CG1-CE1 4.05Å; V20-Y37 HydrophobicContact CG2-CD1 4.26Å; V20-Y37 HydrophobicContact CG2-CE1 3.9Å; V31-Y37 HydrophobicContact CB-CD2 4.43Å; V31-Y37 HydrophobicContact CG1-CD2 3.85Å; V31-Y37 HydrophobicContact CG1-CE2 4.43Å; V31-Y37 HydrophobicContact CG2-CD2 3.96Å; V31-Y37 HydrophobicContact CG2-CE2 3.82Å; K35-Y37 PolarHBondContact O-N 2.82Å; Y37-E43 VanDerWaalsContact CE1-OE2 3.31Å; Y37-E43 WeakPolarHBondContact CE1-OE2 3.41Å; Y37-E43 PolarHBondContact OH-OE1 3.31Å; Y37-E43 PolarHBondContact OH-OE2 3.47Å
38	V	85.5	Confident	85.2	Confident	76 Å²	76	66.2 Å²	66.2	46%	0.461	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	112	175.8	-175	0	0	0	0	106.9	P8 I9 Q40	P8-V38 CarbonylContact O-C 3.46Å; P8-V38 VanDerWaalsContact O-CA 3.28Å; P8-V38 WeakPolarHBondContact O-CA 3.18Å; P8-V38 WeakPolarHBondContact O-CG1 3.25Å; I9-V38 HydrophobicContact CG1-CG1 4.32Å; I9-V38 HydrophobicContact CG1-CG2 4.28Å; V38-Q40 PolarHBondContact O-N 3.33Å
39	C	79.4	Confident	85.2	Confident	20 Å²	20	67.1 Å²	67.1	14%	0.135	37%	0.369	C	S	.	.			trans	-74.4	121.1	-179.1	-144.5	0	0	0	0	108.6	P8 E43	P8-C39 PolarHBondContact O-N 3.38Å; C39-E43 VanDerWaalsContact SG-CB 3.54Å; C39-E43 PolarHBondContact SG-O 3.45Å
40	Q	84.3	Confident	85.4	Confident	116 Å²	116	69.1 Å²	69.1	54%	0.542	37%	0.372	S	S	.	.			trans	-68.8	166.2	176.1	-61.9	-65.7	-18.2	0	0	111.5	V38 D42 E43	V38-Q40 PolarHBondContact O-N 3.33Å; Q40-D42 WeakPolarHBondContact CB-OD1 3.49Å; Q40-D42 PolarHBondContact O-N 3.46Å; Q40-E43 HydrophobicContact CB-CB 4.34Å; Q40-E43 HydrophobicContact CB-CG 4.02Å; Q40-E43 PolarHBondContact N-OE2 3.12Å; Q40-E43 PolarHBondContact O-N 2.89Å
41	Q	81.1	Confident	85.4	Confident	202 Å²	202	73.9 Å²	73.9	94%	0.944	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.2	177.5	-77	-173.9	-27.7	0	0	113.3
42	D	84.7	Confident	85.6	Confident	48 Å²	48	74.2 Å²	74.2	26%	0.257	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	19	175.3	67.9	-43.4	0	0	0	113.2	N22 L23 N24 Q40	N22-D42 CarbonylContact C-O 3.57Å; N22-D42 WeakPolarHBondContact CA-O 3.25Å; N22-D42 PolarHBondContact ND2-O 3.38Å; N22-D42 PolarHBondContact ND2-OD2 3.16Å; L23-D42 WeakPolarHBondContact CB-O 3.2Å; L23-D42 PolarHBondContact N-O 3.28Å; N24-D42 WeakPolarHBondContact ND2-CB 3.28Å; N24-D42 PolarHBondContact ND2-OD2 3.08Å; Q40-D42 WeakPolarHBondContact CB-OD1 3.49Å; Q40-D42 PolarHBondContact O-N 3.46Å
43	E	86.3	Confident	85.7	Confident	42 Å²	42	72 Å²	72	20%	0.196	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	144.9	177.7	-70	-179	163.4	0	0	112.1	V20 L21 N22 Y37 C39 Q40	V20-E43 HydrophobicContact CG1-CB 3.82Å; V20-E43 HydrophobicContact CG1-CG 4.13Å; L21-E43 CarbonylContact O-C 3.57Å; L21-E43 WeakPolarHBondContact O-CA 3.38Å; N22-E43 HydrophobicContact CB-CG 4.47Å; Y37-E43 VanDerWaalsContact CE1-OE2 3.31Å; Y37-E43 WeakPolarHBondContact CE1-OE2 3.41Å; Y37-E43 PolarHBondContact OH-OE1 3.31Å; Y37-E43 PolarHBondContact OH-OE2 3.47Å; C39-E43 VanDerWaalsContact SG-CB 3.54Å; C39-E43 PolarHBondContact SG-O 3.45Å; Q40-E43 HydrophobicContact CB-CB 4.34Å; Q40-E43 HydrophobicContact CB-CG 4.02Å; Q40-E43 PolarHBondContact N-OE2 3.12Å; Q40-E43 PolarHBondContact O-N 2.89Å
44	K	85.3	Confident	85.9	Confident	124 Å²	124	75.1 Å²	75.1	54%	0.539	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	129.9	176.9	-179.5	175.8	179.9	178.5	0	111	L21 L23 V46	L21-K44 PolarHBondContact N-O 3.14Å; L21-K44 PolarHBondContact O-N 3.15Å; L23-K44 HydrophobicContact CD2-CB 4.17Å; L23-K44 HydrophobicContact CG-CB 4.47Å; K44-V46 PolarHBondContact O-N 3.48Å
45	I	85.5	Confident	86.2	Confident	30 Å²	30	70.5 Å²	70.5	15%	0.154	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.5	171.4	-54.5	174.2	0	0	0	108.9	I10 I18 H19 V20	I10-I45 HydrophobicContact CB-CD1 4.02Å; I10-I45 HydrophobicContact CD1-CD1 3.65Å; I10-I45 HydrophobicContact CG1-CD1 4.45Å; I10-I45 HydrophobicContact CG2-CD1 3.69Å; I18-I45 HydrophobicContact CB-CG2 4.32Å; I18-I45 HydrophobicContact CD1-CD1 4.27Å; I18-I45 HydrophobicContact CD1-CG1 4.41Å; H19-I45 WeakPolarHBondContact O-CA 3.45Å; V20-I45 HydrophobicContact CG2-CG1 4.47Å
46	V	86.1	Confident	86.6	Confident	79 Å²	79	67.9 Å²	67.9	48%	0.479	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-27.2	-179.4	-101.7	0	0	0	0	113.2	H19 L21 T28 K44	H19-V46 HydrophobicContact CB-CG2 4.14Å; H19-V46 WeakPolarHBondContact O-CG2 3.31Å; H19-V46 PolarHBondContact O-N 3.41Å; L21-V46 HydrophobicContact CB-CG1 4.34Å; L21-V46 HydrophobicContact CB-CG2 3.7Å; L21-V46 HydrophobicContact CD2-CG1 4.43Å; T28-V46 HydrophobicContact CG2-CG2 3.85Å; K44-V46 PolarHBondContact O-N 3.48Å
47	L	85.8	Confident	86.9	Confident	65 Å²	65	69.4 Å²	69.4	34%	0.34	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	143.5	176.1	-166.1	79.4	0	0	0	110.3	Y17 I18 H19 E50	Y17-L47 HydrophobicContact CE2-CD2 3.91Å; I18-L47 CarbonylContact C-O 3.55Å; I18-L47 VanDerWaalsContact CA-O 3.25Å; I18-L47 WeakPolarHBondContact CA-O 3.48Å; I18-L47 WeakPolarHBondContact CB-O 3.41Å; H19-L47 HydrophobicContact CB-CB 3.73Å; H19-L47 VanDerWaalsContact CE1-CD2 3.45Å; H19-L47 WeakPolarHBondContact CE1-CD2 3.37Å; H19-L47 PolarHBondContact N-O 3.16Å; H19-L47 WeakPolarHBondContact ND1-CD2 3.14Å; H19-L47 PolarHBondContact O-N 3.49Å; L47-E50 HydrophobicContact CD2-CG 4.36Å; L47-E50 HydrophobicContact CG-CG 4.18Å
48	G	79.6	Confident	87.2	Confident	33 Å²	33	72.7 Å²	72.7	34%	0.34	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	91.8	-177.5	168.3	0	0	0	0	0	116.1	E50	G48-E50 VanDerWaalsContact CA-N 3.28Å
49	P	86.1	Confident	87.7	Confident	46 Å²	46	72.3 Å²	72.3	30%	0.299	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-67.7	120.2	8.7	-19.1	33.4	0	0	0	113.2	I10 H16 Y17 I18	I10-P49 HydrophobicContact CD1-CG 3.81Å; I10-P49 HydrophobicContact CG1-CG 4.34Å; H16-P49 HydrophobicContact CB-CB 4.35Å; Y17-P49 WeakPolarHBondContact O-CA 3.42Å; I18-P49 HydrophobicContact CG2-CB 4.16Å; I18-P49 HydrophobicContact CG2-CG 4.02Å
50	E	89.4	Confident	88.4	Confident	98 Å²	98	72.5 Å²	72.5	46%	0.458	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	150.8	174.6	-80	-60.6	162.4	0	0	110.4	H16 Y17 L47 G48	H16-E50 CarbonylContact C-O 3.58Å; H16-E50 WeakPolarHBondContact CA-O 3.32Å; H16-E50 WeakPolarHBondContact CB-O 3.49Å; Y17-E50 HydrophobicContact CD1-CB 4.26Å; Y17-E50 WeakPolarHBondContact CD1-O 3.47Å; Y17-E50 HydrophobicContact CE1-CB 3.71Å; Y17-E50 HydrophobicContact CE2-CB 4.35Å; Y17-E50 PolarHBondContact N-O 2.9Å; Y17-E50 PolarHBondContact O-N 3.08Å; L47-E50 HydrophobicContact CD2-CG 4.36Å; L47-E50 HydrophobicContact CG-CG 4.18Å; G48-E50 VanDerWaalsContact CA-N 3.28Å
51	E	90.4	Very high	88.8	Confident	138 Å²	138	67 Å²	67	65%	0.645	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	146.3	175	-70.5	-169.6	167.6	0	0	111.8	Y17 T53	Y17-E51 WeakPolarHBondContact CE1-O 3.45Å; E51-T53 PolarHBondContact O-N 3.1Å
52	L	91.6	Very high	89.4	Confident	23 Å²	23	58.1 Å²	58.1	12%	0.12	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-60.8	137.1	169.9	-63.4	177.6	0	0	0	110.4	R15 Y17 V32 V54 P98 F99 P100	R15-L52 HydrophobicContact CB-CD1 3.9Å; R15-L52 HydrophobicContact CB-CG 4.2Å; R15-L52 HydrophobicContact CG-CD1 4.09Å; R15-L52 WeakPolarHBondContact O-CG 3.47Å; R15-L52 PolarHBondContact O-N 3.5Å; Y17-L52 HydrophobicContact CD1-CD2 3.97Å; V32-L52 HydrophobicContact CG1-CD2 4.29Å; L52-V54 PolarHBondContact O-N 3.2Å; L52-P98 HydrophobicContact CB-CB 3.79Å; L52-P98 HydrophobicContact CD1-CB 4.13Å; L52-F99 CarbonylContact C-O 3.41Å; L52-P100 HydrophobicContact CD2-CB 3.66Å; L52-P100 HydrophobicContact CD2-CG 4.18Å; L52-P100 VanDerWaalsContact CD2-N 3.33Å
53	T	91	Very high	89.8	Confident	15 Å²	15	55.8 Å²	55.8	9%	0.092	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	121.9	176.5	-60.8	0	0	0	0	109.6	E51 V55 P98 F99 L107	E51-T53 PolarHBondContact O-N 3.1Å; T53-V55 HydrophobicContact CG2-CG2 4.4Å; T53-P98 WeakPolarHBondContact O-CA 3.41Å; T53-F99 HydrophobicContact CG2-CE1 4.18Å; T53-F99 HydrophobicContact CG2-CE2 3.94Å; T53-F99 HydrophobicContact CG2-CZ 3.58Å; T53-F99 PolarHBondContact N-O 3.23Å; T53-F99 PolarHBondContact O-N 3.08Å; T53-F99 VanDerWaalsContact O-N 3.15Å; T53-L107 HydrophobicContact CG2-CD1 4.03Å; T53-L107 HydrophobicContact CG2-CD2 4.3Å
54	V	91.6	Very high	90.1	Very high	81 Å²	81	59 Å²	59	49%	0.491	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126.3	176.8	-176	0	0	0	0	109.2	L52 P98	L52-V54 PolarHBondContact O-N 3.2Å; V54-P98 HydrophobicContact CG2-CB 4.11Å; V54-P98 HydrophobicContact CG2-CG 4.08Å
55	V	92.6	Very high	90.4	Very high	6 Å²	6	54.6 Å²	54.6	4%	0.036	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	105.9	173.2	-174.6	0	0	0	0	108.7	T53 M59 C61 F94 A95 F99 V111	T53-V55 HydrophobicContact CG2-CG2 4.4Å; V55-M59 HydrophobicContact CG1-CB 4.39Å; V55-M59 WeakPolarHBondContact CG1-O 3.32Å; V55-C61 HydrophobicContact CG2-CB 4.29Å; V55-C61 VanDerWaalsContact CG2-SG 3.57Å; V55-F94 VanDerWaalsContact CG1-C 3.48Å; V55-F94 WeakPolarHBondContact CG1-O 3.4Å; V55-A95 WeakPolarHBondContact O-CA 3.44Å; V55-F99 HydrophobicContact CG2-CE1 3.9Å; V55-F99 HydrophobicContact CG2-CZ 4.24Å; V55-V111 HydrophobicContact CG1-CG1 4.44Å
56	P	92.7	Very high	90.7	Very high	60 Å²	60	53.2 Å²	53.2	39%	0.39	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	163.6	178.7	-22.9	35.2	0	0	0	113.8	M59 A95	P56-M59 HydrophobicContact CB-CG 4.3Å; P56-M59 HydrophobicContact CB-SD 4.06Å; P56-M59 HydrophobicContact CG-SD 3.88Å; P56-M59 WeakPolarHBondContact O-CB 3.44Å; P56-M59 PolarHBondContact O-N 3.38Å; P56-A95 WeakPolarHBondContact O-CB 3.45Å
57	T	92.1	Very high	90.8	Very high	119 Å²	119	49.7 Å²	49.7	73%	0.73	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.5	140.2	170.4	-43.2	0	0	0	0	111.3	M59	T57-M59 PolarHBondContact O-N 3.16Å
58	M	91.1	Very high	90.9	Very high	105 Å²	105	49.3 Å²	49.3	52%	0.517	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.4	19.3	-173.2	-62.9	-64.7	-175.9	0	0	115.2	L114 T151	M58-L114 PolarHBondContact O-N 3.34Å; M58-L114 HydrophobicContact SD-CD1 4.2Å; M58-T151 HydrophobicContact SD-CG2 4.18Å
59	M	94.1	Very high	91.1	Very high	68 Å²	68	51 Å²	51	34%	0.335	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	165	171.1	-57.5	-168.3	171.6	0	0	112	V55 P56 T57 V111 R112	V55-M59 HydrophobicContact CG1-CB 4.39Å; V55-M59 WeakPolarHBondContact CG1-O 3.32Å; P56-M59 HydrophobicContact CB-CG 4.3Å; P56-M59 HydrophobicContact CB-SD 4.06Å; P56-M59 HydrophobicContact CG-SD 3.88Å; P56-M59 WeakPolarHBondContact O-CB 3.44Å; P56-M59 PolarHBondContact O-N 3.38Å; T57-M59 PolarHBondContact O-N 3.16Å; M59-V111 HydrophobicContact CB-CG1 3.68Å; M59-V111 HydrophobicContact CG-CG1 4.41Å; M59-V111 HydrophobicContact SD-CG1 3.93Å; M59-R112 CarbonylContact C-O 3.46Å; M59-R112 VanDerWaalsContact CA-O 3.25Å; M59-R112 WeakPolarHBondContact CA-O 3.44Å; M59-R112 WeakPolarHBondContact CB-O 3.46Å
60	Y	94.2	Very high	90.9	Very high	24 Å²	24	53.5 Å²	53.5	9%	0.094	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	160.9	174.4	76.2	-75.3	0	0	0	110.7	V62 Y92 R93 R112 P113 L114 P154	Y60-V62 HydrophobicContact CD2-CG2 4.11Å; Y60-V62 HydrophobicContact CE2-CG2 3.82Å; Y60-Y92 AromaticContact CD2-CD1 3.86Å; Y60-Y92 HydrophobicContact CD2-CD1 3.86Å; Y60-Y92 HydrophobicContact CD2-CE1 4.34Å; Y60-Y92 AromaticContact CE2-CD1 3.91Å; Y60-Y92 HydrophobicContact CE2-CD1 3.91Å; Y60-Y92 AromaticContact CE2-CE1 3.9Å; Y60-Y92 HydrophobicContact CE2-CE1 3.9Å; Y60-R93 WeakPolarHBondContact CA-O 3.41Å; Y60-R112 HydrophobicContact CD1-CB 4.25Å; Y60-R112 VanDerWaalsContact CD1-O 3.29Å; Y60-R112 WeakPolarHBondContact CD1-O 3.14Å; Y60-R112 HydrophobicContact CE1-CB 3.69Å; Y60-R112 PolarHBondContact N-O 3.15Å; Y60-R112 PolarHBondContact O-N 3.26Å; Y60-P113 WeakPolarHBondContact CE1-O 3.35Å; Y60-L114 HydrophobicContact CD1-CD2 3.75Å; Y60-L114 HydrophobicContact CG-CD2 4.22Å; Y60-P154 HydrophobicContact CD1-CG 4.46Å; Y60-P154 HydrophobicContact CE1-CG 3.96Å; Y60-P154 HydrophobicContact CE2-CB 4.19Å; Y60-P154 HydrophobicContact CE2-CG 4.19Å
61	C	93.3	Very high	90.3	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	162.6	166.9	69.4	0	0	0	0	110.2	V55 Y92 R93 L107 V111	V55-C61 HydrophobicContact CG2-CB 4.29Å; V55-C61 VanDerWaalsContact CG2-SG 3.57Å; C61-Y92 WeakPolarHBondContact O-CA 3.1Å; C61-R93 PolarHBondContact N-O 3.42Å; C61-R93 PolarHBondContact O-N 3.18Å; C61-L107 HydrophobicContact CB-CD2 3.73Å; C61-V111 HydrophobicContact CB-CG2 4.23Å
62	V	93.4	Very high	89.7	Confident	15 Å²	15	58.8 Å²	58.8	9%	0.091	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.8	177.3	-174.7	0	0	0	0	108.8	Y60 E90 E91 Y92 K108	Y60-V62 HydrophobicContact CD2-CG2 4.11Å; Y60-V62 HydrophobicContact CE2-CG2 3.82Å; V62-E90 HydrophobicContact CG1-CB 3.96Å; V62-E90 HydrophobicContact CG1-CG 4.42Å; V62-E91 WeakPolarHBondContact CA-O 3.41Å; V62-Y92 HydrophobicContact CB-CE2 4.46Å; V62-Y92 HydrophobicContact CG1-CD2 4.03Å; V62-Y92 HydrophobicContact CG1-CE2 3.69Å; V62-Y92 HydrophobicContact CG2-CD1 3.75Å; V62-Y92 HydrophobicContact CG2-CD2 4.14Å; V62-Y92 HydrophobicContact CG2-CE1 3.54Å; V62-Y92 HydrophobicContact CG2-CE2 3.91Å; V62-Y92 HydrophobicContact CG2-CG 4.06Å; V62-K108 HydrophobicContact CB-CB 4.06Å; V62-K108 HydrophobicContact CB-CD 4.06Å; V62-K108 HydrophobicContact CG1-CB 4.18Å; V62-K108 HydrophobicContact CG1-CD 3.7Å; V62-K108 WeakPolarHBondContact O-CB 3.5Å; V62-K108 PolarHBondContact O-N 3.28Å
63	I	93	Very high	88.7	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.6	-177.2	-61.7	171.1	0	0	0	108.3	E90 E91 R93 F99 L101 E105 T106 L107	I63-E90 CarbonylContact O-C 3.54Å; I63-E90 VanDerWaalsContact O-CA 3.28Å; I63-E90 WeakPolarHBondContact O-CA 3.48Å; I63-E91 PolarHBondContact N-O 3.38Å; I63-E91 PolarHBondContact O-N 3.4Å; I63-R93 HydrophobicContact CD1-CB 4.46Å; I63-R93 VanDerWaalsContact CD1-CD 3.47Å; I63-R93 HydrophobicContact CD1-CG 3.88Å; I63-R93 VanDerWaalsContact CD1-CZ 3.41Å; I63-F99 HydrophobicContact CD1-CE2 3.47Å; I63-F99 VanDerWaalsContact CD1-CE2 3.47Å; I63-F99 HydrophobicContact CD1-CZ 3.82Å; I63-L101 HydrophobicContact CD1-CD2 4.08Å; I63-L101 HydrophobicContact CG1-CD2 4.34Å; I63-L101 HydrophobicContact CG2-CD2 4.37Å; I63-E105 HydrophobicContact CG2-CB 3.97Å; I63-E105 HydrophobicContact CG2-CG 4.06Å; I63-T106 CarbonylContact C-O 3.56Å; I63-T106 WeakPolarHBondContact CA-O 3.49Å; I63-L107 HydrophobicContact CG1-CD2 4.29Å
64	R	92.3	Very high	88.3	Confident	109 Å²	109	63.5 Å²	63.5	41%	0.411	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	146.3	174.1	-82.2	170.6	168.6	177.2	-5.8	111	E90 E105 T106 K108	R64-E90 HydrophobicContact CG-CG 3.91Å; R64-E90 IonicContact CZ-OE1 3.61Å; R64-E90 IonicContact NE-OE1 3.93Å; R64-E90 PolarHBondContact NE-OE1 3.41Å; R64-E90 IonicContact NH2-OE1 3.54Å; R64-E105 WeakPolarHBondContact O-CA 3.5Å; R64-T106 PolarHBondContact N-O 2.74Å; R64-T106 PolarHBondContact O-N 2.96Å; R64-T106 VanDerWaalsContact O-N 3.1Å; R64-K108 HydrophobicContact CG-CB 4.21Å
65	N	92.1	Very high	87.8	Confident	32 Å²	32	61 Å²	61	17%	0.171	33%	0.33	C	S	.	.	S	Bend	trans	54.6	51	-175.9	-47.1	-41.5	0	0	0	112.4	V85 R86 G88 D89 G104 E105	N65-V85 HydrophobicContact CB-CB 4.27Å; N65-V85 HydrophobicContact CB-CG2 4.42Å; N65-V85 WeakPolarHBondContact O-CB 3.25Å; N65-V85 WeakPolarHBondContact O-CG1 3.41Å; N65-R86 WeakPolarHBondContact CA-O 3.38Å; N65-G88 PolarHBondContact OD1-N 3.43Å; N65-D89 PolarHBondContact N-O 2.78Å; N65-G104 WeakPolarHBondContact CB-O 3.48Å; N65-G104 PolarHBondContact ND2-O 3.44Å; N65-E105 WeakPolarHBondContact O-CG 3.29Å
66	P	91.3	Very high	87.4	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-58.5	146.2	-175.7	26.6	-36	0	0	0	112	R86 D89 E91	P66-R86 HydrophobicContact CG-CB 4.24Å; P66-R86 PolarHBondContact O-N 3.08Å; P66-D89 WeakPolarHBondContact CD-O 3.39Å; P66-D89 HydrophobicContact CG-CB 4.15Å; P66-E91 HydrophobicContact CB-CB 3.58Å; P66-E91 HydrophobicContact CB-CG 4.45Å; P66-E91 WeakPolarHBondContact CB-OE2 3.28Å; P66-E91 HydrophobicContact CG-CB 3.88Å
67	V	90	Very high	87	Confident	5 Å²	5	63.7 Å²	63.7	3%	0.03	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-62.4	143.3	179.4	68.2	0	0	0	0	112.3	T69 P75 V83 R86 Y102 E105	V67-T69 HydrophobicContact CG1-CG2 4.1Å; V67-P75 HydrophobicContact CG2-CB 3.82Å; V67-P75 HydrophobicContact CG2-CG 4.34Å; V67-V83 HydrophobicContact CG2-CG1 3.32Å; V67-R86 PolarHBondContact O-NH1 3.49Å; V67-Y102 HydrophobicContact CB-CD2 3.96Å; V67-Y102 HydrophobicContact CB-CG 4.15Å; V67-Y102 HydrophobicContact CG1-CD2 3.71Å; V67-Y102 HydrophobicContact CG1-CE2 4.04Å; V67-Y102 HydrophobicContact CG1-CG 4.38Å; V67-Y102 HydrophobicContact CG2-CD1 4.48Å; V67-Y102 HydrophobicContact CG2-CD2 4.2Å; V67-Y102 HydrophobicContact CG2-CG 4.08Å; V67-E105 WeakPolarHBondContact CG1-OE1 3.39Å; V67-E105 PolarHBondContact N-OE1 2.98Å
68	I	87.3	Confident	86.4	Confident	57 Å²	57	60.7 Å²	60.7	29%	0.292	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-82.7	116.6	169.5	-59.6	-179.5	0	0	0	107.9	P75 V76 K84 R86	I68-P75 WeakPolarHBondContact O-CA 3.34Å; I68-V76 HydrophobicContact CB-CB 4.48Å; I68-V76 HydrophobicContact CG2-CB 4.11Å; I68-V76 HydrophobicContact CG2-CG2 3.97Å; I68-V76 PolarHBondContact O-N 3.29Å; I68-K84 HydrophobicContact CB-CB 4.34Å; I68-K84 HydrophobicContact CD1-CB 3.94Å; I68-K84 HydrophobicContact CG1-CB 4.35Å; I68-K84 PolarHBondContact N-O 3.11Å; I68-R86 HydrophobicContact CD1-CG 4.11Å; I68-R86 HydrophobicContact CG1-CG 3.57Å
69	T	83.8	Confident	85.7	Confident	70 Å²	70	65.4 Å²	65.4	43%	0.429	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-103.5	151.6	173.4	48.1	0	0	0	0	111.6	V67 G73 V74	V67-T69 HydrophobicContact CG1-CG2 4.1Å; T69-G73 VanDerWaalsContact CG2-O 3.27Å; T69-G73 WeakPolarHBondContact CG2-O 3.45Å; T69-V74 CarbonylContact C-O 3.52Å; T69-V74 WeakPolarHBondContact CA-O 3.4Å
70	D	81.6	Confident	84.8	Confident	98 Å²	98	69.7 Å²	69.7	52%	0.524	36%	0.359	S	S	.	.			trans	-84	178.9	164.1	-157.8	-5.4	0	0	0	110.4	D72 G73 V74 V76	D70-D72 PolarHBondContact O-N 3.13Å; D70-D72 VanDerWaalsContact O-N 3.11Å; D70-G73 PolarHBondContact O-N 3.14Å; D70-V74 PolarHBondContact N-O 2.98Å; D70-V76 HydrophobicContact CB-CG2 4.19Å
71	K	77.5	Confident	83.9	Confident	200 Å²	200	70.1 Å²	70.1	87%	0.87	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-31.2	-176	-65.4	179.1	-178.8	178.4	0	114.6	G73	K71-G73 VanDerWaalsContact C-N 3.26Å; K71-G73 PolarHBondContact O-N 2.75Å
72	D	77.1	Confident	83.5	Confident	147 Å²	147	72.3 Å²	72.3	79%	0.786	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	9.3	178.7	-59.3	-42.1	0	0	0	113.2	D70 V74	D70-D72 PolarHBondContact O-N 3.13Å; D70-D72 VanDerWaalsContact O-N 3.11Å; D72-V74 HydrophobicContact CB-CG2 4.23Å; D72-V74 PolarHBondContact O-N 2.7Å
73	G	71.1	Confident	83	Confident	47 Å²	47	72.5 Å²	72.5	49%	0.485	38%	0.382	S	S	.	.	S	Bend	trans	75.6	2.5	-177.2	0	0	0	0	0	114.5	T69 D70 K71	T69-G73 VanDerWaalsContact CG2-O 3.27Å; T69-G73 WeakPolarHBondContact CG2-O 3.45Å; D70-G73 PolarHBondContact O-N 3.14Å; K71-G73 VanDerWaalsContact C-N 3.26Å; K71-G73 PolarHBondContact O-N 2.75Å
74	V	81.4	Confident	82.8	Confident	90 Å²	90	77 Å²	77	55%	0.545	40%	0.402	S	S	.	.			trans	-78.4	133.8	-179.7	-176.2	0	0	0	0	110.3	T69 D70 D72	T69-V74 CarbonylContact C-O 3.52Å; T69-V74 WeakPolarHBondContact CA-O 3.4Å; D70-V74 PolarHBondContact N-O 2.98Å; D72-V74 HydrophobicContact CB-CG2 4.23Å; D72-V74 PolarHBondContact O-N 2.7Å
75	P	81.5	Confident	82.6	Confident	29 Å²	29	73.8 Å²	73.8	19%	0.188	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-61.6	133.6	177.5	-22.4	31.7	0	0	0	113.7	V67 I68 V77 V83 Y102	V67-P75 HydrophobicContact CG2-CB 3.82Å; V67-P75 HydrophobicContact CG2-CG 4.34Å; I68-P75 WeakPolarHBondContact O-CA 3.34Å; P75-V77 PolarHBondContact O-N 3.31Å; P75-V83 HydrophobicContact CB-CG1 3.64Å; P75-Y102 HydrophobicContact CB-CE1 4.21Å; P75-Y102 HydrophobicContact CG-CD1 4.2Å; P75-Y102 HydrophobicContact CG-CE1 3.37Å; P75-Y102 HydrophobicContact CG-CE2 4.18Å; P75-Y102 VanDerWaalsContact CG-OH 3.29Å; P75-Y102 WeakPolarHBondContact CG-OH 3.46Å
76	V	84.8	Confident	82.4	Confident	46 Å²	46	76.5 Å²	76.5	28%	0.279	40%	0.402	S	S	.	.			trans	-79.1	114.8	175.2	-179	0	0	0	0	109.6	I68 D70 K84	I68-V76 HydrophobicContact CB-CB 4.48Å; I68-V76 HydrophobicContact CG2-CB 4.11Å; I68-V76 HydrophobicContact CG2-CG2 3.97Å; I68-V76 PolarHBondContact O-N 3.29Å; D70-V76 HydrophobicContact CB-CG2 4.19Å; V76-K84 HydrophobicContact CG1-CD 4.23Å; V76-K84 PolarHBondContact O-N 3.41Å
77	V	83.3	Confident	82.1	Confident	76 Å²	76	84 Å²	84	46%	0.461	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-87.5	159	172.9	-65.7	0	0	0	0	112.3	P75 G81 Q82 V83	P75-V77 PolarHBondContact O-N 3.31Å; V77-G81 WeakPolarHBondContact CG1-O 3.32Å; V77-Q82 CarbonylContact C-O 3.58Å; V77-Q82 WeakPolarHBondContact CA-O 3.43Å; V77-V83 HydrophobicContact CG1-CG2 4.24Å
78	D	79.9	Confident	81.9	Confident	56 Å²	56	87 Å²	87	30%	0.299	47%	0.471	S	S	.	.			trans	-87.6	-169.7	171.4	82.7	-7.4	0	0	0	112.7	F80 G81 Q82 K84	D78-F80 PolarHBondContact O-N 3.24Å; D78-F80 WeakPolarHBondContact OD1-CA 3.43Å; D78-F80 PolarHBondContact OD1-N 3.48Å; D78-G81 PolarHBondContact O-N 3.43Å; D78-G81 PolarHBondContact OD1-N 3.46Å; D78-Q82 PolarHBondContact N-O 3.42Å; D78-Q82 PolarHBondContact OD1-N 3.31Å; D78-K84 HydrophobicContact CB-CG 4.37Å
79	K	77	Confident	82	Confident	204 Å²	204	85.9 Å²	85.9	89%	0.887	47%	0.465	S	S	*	.	S	Bend	trans	-67.6	-18.2	-178.9	-68	-175.5	178.2	-179.1	0	114.1
80	F	75	Confident	82.3	Confident	158 Å²	158	84.3 Å²	84.3	69%	0.693	45%	0.453	S	S	*	.	S	Bend	trans	-99.2	-17	-179.9	-55.6	-72.8	0	0	0	111.6	V27 D78	V27-F80 HydrophobicContact CG2-CB 3.88Å; V27-F80 WeakPolarHBondContact CG2-O 3.48Å; D78-F80 PolarHBondContact O-N 3.24Å; D78-F80 WeakPolarHBondContact OD1-CA 3.43Å; D78-F80 PolarHBondContact OD1-N 3.48Å
81	G	75.9	Confident	82.7	Confident	32 Å²	32	82.2 Å²	82.2	33%	0.33	44%	0.44	S	S	.	.	S	Bend	trans	105.7	2	-176.7	0	0	0	0	0	113.3	V77 D78	V77-G81 WeakPolarHBondContact CG1-O 3.32Å; D78-G81 PolarHBondContact O-N 3.43Å; D78-G81 PolarHBondContact OD1-N 3.46Å
82	Q	83.9	Confident	83.4	Confident	47 Å²	47	75.1 Å²	75.1	22%	0.22	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-73.7	132.6	177.7	-175.8	58.1	44.5	0	0	110.2	V27 T28 V77 D78	V27-Q82 HydrophobicContact CG1-CB 4.37Å; V27-Q82 HydrophobicContact CG2-CB 4.41Å; T28-Q82 PolarHBondContact O-OE1 3.02Å; V77-Q82 CarbonylContact C-O 3.58Å; V77-Q82 WeakPolarHBondContact CA-O 3.43Å; D78-Q82 PolarHBondContact N-O 3.42Å; D78-Q82 PolarHBondContact OD1-N 3.31Å
83	V	84.2	Confident	84.1	Confident	19 Å²	19	69.1 Å²	69.1	12%	0.115	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-68.3	132.3	177.6	-171.5	0	0	0	0	110.2	V67 P75 V77 Y102	V67-V83 HydrophobicContact CG2-CG1 3.32Å; P75-V83 HydrophobicContact CB-CG1 3.64Å; V77-V83 HydrophobicContact CG1-CG2 4.24Å; V83-Y102 HydrophobicContact CG1-CD1 4.33Å; V83-Y102 HydrophobicContact CG2-CD1 4.42Å
84	K	87.4	Confident	85.2	Confident	96 Å²	96	70 Å²	70	42%	0.417	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-84	135.2	177.8	-61.9	180	-175.6	170.1	0	111.5	I68 V76 D78	I68-K84 HydrophobicContact CB-CB 4.34Å; I68-K84 HydrophobicContact CD1-CB 3.94Å; I68-K84 HydrophobicContact CG1-CB 4.35Å; I68-K84 PolarHBondContact N-O 3.11Å; V76-K84 HydrophobicContact CG1-CD 4.23Å; V76-K84 PolarHBondContact O-N 3.41Å; D78-K84 HydrophobicContact CB-CG 4.37Å
85	V	87.9	Confident	85.7	Confident	41 Å²	41	68.2 Å²	68.2	25%	0.248	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-115.5	148	176	-68.6	0	0	0	0	111.2	N65 M87	N65-V85 HydrophobicContact CB-CB 4.27Å; N65-V85 HydrophobicContact CB-CG2 4.42Å; N65-V85 WeakPolarHBondContact O-CB 3.25Å; N65-V85 WeakPolarHBondContact O-CG1 3.41Å; V85-M87 VanDerWaalsContact C-N 3.31Å; V85-M87 PolarHBondContact O-N 3.43Å
86	R	87.9	Confident	86.1	Confident	89 Å²	89	71.4 Å²	71.4	34%	0.336	37%	0.372	S	S	.	.			trans	-79.5	80.9	170.4	-61.6	-164.8	-67.1	-83.9	-5.3	109.2	N65 P66 V67 I68 G88 D89 E91	N65-R86 WeakPolarHBondContact CA-O 3.38Å; P66-R86 HydrophobicContact CG-CB 4.24Å; P66-R86 PolarHBondContact O-N 3.08Å; V67-R86 PolarHBondContact O-NH1 3.49Å; I68-R86 HydrophobicContact CD1-CG 4.11Å; I68-R86 HydrophobicContact CG1-CG 3.57Å; R86-G88 PolarHBondContact O-N 3.28Å; R86-D89 HydrophobicContact CB-CB 3.6Å; R86-D89 IonicContact CZ-OD2 3.55Å; R86-D89 IonicContact NE-OD2 3.49Å; R86-D89 PolarHBondContact NE-OD2 3.38Å; R86-D89 IonicContact NH2-OD2 3.75Å; R86-D89 VanDerWaalsContact O-CB 3.29Å; R86-D89 WeakPolarHBondContact O-CB 3.07Å; R86-D89 PolarHBondContact O-N 3.46Å; R86-E91 IonicContact NH2-OE2 3.16Å
87	M	85.7	Confident	86.3	Confident	156 Å²	156	76 Å²	76	77%	0.768	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	125.1	-176.9	-168.9	66.6	168.3	0	0	111.8	V85 D89	V85-M87 VanDerWaalsContact C-N 3.31Å; V85-M87 PolarHBondContact O-N 3.43Å; M87-D89 VanDerWaalsContact C-N 3.27Å; M87-D89 PolarHBondContact O-N 2.9Å
88	G	84.6	Confident	86.7	Confident	69 Å²	69	74 Å²	74	71%	0.711	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	-6.7	-177.5	0	0	0	0	0	115.7	N65 R86	N65-G88 PolarHBondContact OD1-N 3.43Å; R86-G88 PolarHBondContact O-N 3.28Å
89	D	89.6	Confident	87.2	Confident	34 Å²	34	72.2 Å²	72.2	18%	0.182	37%	0.373	C	S	.	.			trans	-81.6	160.8	173	-165.6	27.4	0	0	0	111.1	N65 P66 R86 M87 K156	N65-D89 PolarHBondContact N-O 2.78Å; P66-D89 WeakPolarHBondContact CD-O 3.39Å; P66-D89 HydrophobicContact CG-CB 4.15Å; R86-D89 HydrophobicContact CB-CB 3.6Å; R86-D89 IonicContact CZ-OD2 3.55Å; R86-D89 IonicContact NE-OD2 3.49Å; R86-D89 PolarHBondContact NE-OD2 3.38Å; R86-D89 IonicContact NH2-OD2 3.75Å; R86-D89 VanDerWaalsContact O-CB 3.29Å; R86-D89 WeakPolarHBondContact O-CB 3.07Å; R86-D89 PolarHBondContact O-N 3.46Å; M87-D89 VanDerWaalsContact C-N 3.27Å; M87-D89 PolarHBondContact O-N 2.9Å; D89-K156 VanDerWaalsContact CG-NZ 3.28Å; D89-K156 IonicContact OD1-NZ 3.98Å; D89-K156 PolarHBondContact OD1-NZ 3.48Å; D89-K156 IonicContact OD2-NZ 2.79Å; D89-K156 PolarHBondContact OD2-NZ 3.28Å; D89-K156 VanDerWaalsContact OD2-NZ 3.1Å
90	E	90.6	Very high	87.9	Confident	36 Å²	36	63.4 Å²	63.4	17%	0.168	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139.1	176.2	-64.6	-169.7	164.8	0	0	110.7	V62 I63 R64 K108 K156	V62-E90 HydrophobicContact CG1-CB 3.96Å; V62-E90 HydrophobicContact CG1-CG 4.42Å; I63-E90 CarbonylContact O-C 3.54Å; I63-E90 VanDerWaalsContact O-CA 3.28Å; I63-E90 WeakPolarHBondContact O-CA 3.48Å; R64-E90 HydrophobicContact CG-CG 3.91Å; R64-E90 IonicContact CZ-OE1 3.61Å; R64-E90 IonicContact NE-OE1 3.93Å; R64-E90 PolarHBondContact NE-OE1 3.41Å; R64-E90 IonicContact NH2-OE1 3.54Å; E90-K108 VanDerWaalsContact OE1-CD 3.28Å; E90-K108 WeakPolarHBondContact OE1-CD 3.29Å; E90-K108 VanDerWaalsContact OE1-CE 3.27Å; E90-K108 WeakPolarHBondContact OE1-CE 3.35Å; E90-K108 IonicContact OE1-NZ 2.83Å; E90-K108 PolarHBondContact OE1-NZ 2.95Å; E90-K108 IonicContact OE2-NZ 2.77Å; E90-K108 PolarHBondContact OE2-NZ 2.93Å; E90-K156 WeakPolarHBondContact O-CD 3.38Å
91	E	91	Very high	88.6	Confident	55 Å²	55	56.7 Å²	56.7	26%	0.257	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.6	177.3	-171.6	-171.6	150.3	0	0	110	V62 I63 P66 R86 R93	V62-E91 WeakPolarHBondContact CA-O 3.41Å; I63-E91 PolarHBondContact N-O 3.38Å; I63-E91 PolarHBondContact O-N 3.4Å; P66-E91 HydrophobicContact CB-CB 3.58Å; P66-E91 HydrophobicContact CB-CG 4.45Å; P66-E91 WeakPolarHBondContact CB-OE2 3.28Å; P66-E91 HydrophobicContact CG-CB 3.88Å; R86-E91 IonicContact NH2-OE2 3.16Å; E91-R93 VanDerWaalsContact CD-NE 3.29Å; E91-R93 HydrophobicContact CG-CG 4.22Å; E91-R93 WeakPolarHBondContact OE1-CG 3.45Å; E91-R93 IonicContact OE1-CZ 2.76Å; E91-R93 IonicContact OE1-NE 3.78Å; E91-R93 PolarHBondContact OE1-NE 3.09Å; E91-R93 IonicContact OE1-NH2 3.71Å; E91-R93 PolarHBondContact OE1-NH2 3.18Å; E91-R93 IonicContact OE2-CZ 2.83Å; E91-R93 IonicContact OE2-NE 3.82Å; E91-R93 IonicContact OE2-NH2 2.74Å; E91-R93 PolarHBondContact OE2-NH2 3.17Å
92	Y	91.9	Very high	89.3	Confident	51 Å²	51	57.7 Å²	57.7	20%	0.2	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	107.8	179.3	-76.3	-121.5	0	0	0	107.8	Y60 C61 V62 P154 K156	Y60-Y92 AromaticContact CD2-CD1 3.86Å; Y60-Y92 HydrophobicContact CD2-CD1 3.86Å; Y60-Y92 HydrophobicContact CD2-CE1 4.34Å; Y60-Y92 AromaticContact CE2-CD1 3.91Å; Y60-Y92 HydrophobicContact CE2-CD1 3.91Å; Y60-Y92 AromaticContact CE2-CE1 3.9Å; Y60-Y92 HydrophobicContact CE2-CE1 3.9Å; C61-Y92 WeakPolarHBondContact O-CA 3.1Å; V62-Y92 HydrophobicContact CB-CE2 4.46Å; V62-Y92 HydrophobicContact CG1-CD2 4.03Å; V62-Y92 HydrophobicContact CG1-CE2 3.69Å; V62-Y92 HydrophobicContact CG2-CD1 3.75Å; V62-Y92 HydrophobicContact CG2-CD2 4.14Å; V62-Y92 HydrophobicContact CG2-CE1 3.54Å; V62-Y92 HydrophobicContact CG2-CE2 3.91Å; V62-Y92 HydrophobicContact CG2-CG 4.06Å; Y92-P154 HydrophobicContact CD1-CB 3.86Å; Y92-P154 VanDerWaalsContact CD1-O 3.31Å; Y92-P154 WeakPolarHBondContact CD1-O 3.45Å; Y92-P154 HydrophobicContact CE1-CB 3.66Å; Y92-K156 HydrophobicContact CD2-CB 3.96Å; Y92-K156 VanDerWaalsContact CE2-CA 3.45Å; Y92-K156 HydrophobicContact CE2-CB 3.68Å
93	R	91.8	Very high	89.4	Confident	20 Å²	20	56.1 Å²	56.1	8%	0.075	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.3	177.7	-62.2	-164.9	-174.8	138.7	15.4	109.7	Y60 C61 I63 E91 F99 E105	Y60-R93 WeakPolarHBondContact CA-O 3.41Å; C61-R93 PolarHBondContact N-O 3.42Å; C61-R93 PolarHBondContact O-N 3.18Å; I63-R93 HydrophobicContact CD1-CB 4.46Å; I63-R93 VanDerWaalsContact CD1-CD 3.47Å; I63-R93 HydrophobicContact CD1-CG 3.88Å; I63-R93 VanDerWaalsContact CD1-CZ 3.41Å; E91-R93 VanDerWaalsContact CD-NE 3.29Å; E91-R93 HydrophobicContact CG-CG 4.22Å; E91-R93 WeakPolarHBondContact OE1-CG 3.45Å; E91-R93 IonicContact OE1-CZ 2.76Å; E91-R93 IonicContact OE1-NE 3.78Å; E91-R93 PolarHBondContact OE1-NE 3.09Å; E91-R93 IonicContact OE1-NH2 3.71Å; E91-R93 PolarHBondContact OE1-NH2 3.18Å; E91-R93 IonicContact OE2-CZ 2.83Å; E91-R93 IonicContact OE2-NE 3.82Å; E91-R93 IonicContact OE2-NH2 2.74Å; E91-R93 PolarHBondContact OE2-NH2 3.17Å; R93-F99 HydrophobicContact CB-CE1 4.37Å; R93-F99 HydrophobicContact CB-CZ 4.22Å; R93-E105 IonicContact CZ-OE1 2.85Å; R93-E105 IonicContact NH1-OE1 2.65Å; R93-E105 IonicContact NH1-OE2 2.7Å; R93-E105 IonicContact NH2-OE1 3.79Å; R93-E105 PolarHBondContact NH2-OE1 2.98Å
94	F	93.6	Very high	89.5	Confident	66 Å²	66	57.2 Å²	57.2	29%	0.289	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-169.2	179.7	-54	-72.9	0	0	0	110.7	V55 Q96 L114 Y153 P154	V55-F94 VanDerWaalsContact CG1-C 3.48Å; V55-F94 WeakPolarHBondContact CG1-O 3.4Å; F94-Q96 PolarHBondContact O-N 3.14Å; F94-Q96 VanDerWaalsContact O-N 3.14Å; F94-L114 HydrophobicContact CD1-CD2 4.15Å; F94-L114 HydrophobicContact CE1-CD2 4.19Å; F94-Y153 AromaticContact CD1-CD1 3.76Å; F94-Y153 HydrophobicContact CD1-CD1 3.76Å; F94-Y153 HydrophobicContact CD1-CE1 4.29Å; F94-Y153 AromaticContact CE1-CD1 3.72Å; F94-Y153 HydrophobicContact CE1-CD1 3.72Å; F94-Y153 HydrophobicContact CE1-CG 4.45Å; F94-Y153 HydrophobicContact CG-CD1 4.28Å; F94-Y153 HydrophobicContact CZ-CD1 4.19Å; F94-P154 WeakPolarHBondContact CZ-O 3.35Å
95	A	91.5	Very high	89.7	Confident	52 Å²	52	53 Å²	53	43%	0.43	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	115.2	177.3	0	0	0	0	0	112	V55 P56	V55-A95 WeakPolarHBondContact O-CA 3.44Å; P56-A95 WeakPolarHBondContact O-CB 3.45Å
96	Q	90.7	Very high	89.8	Confident	97 Å²	97	54.4 Å²	54.4	45%	0.453	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	177.6	-178.4	67.7	179.9	21	0	0	110.3	F94 F99	F94-Q96 PolarHBondContact O-N 3.14Å; F94-Q96 VanDerWaalsContact O-N 3.14Å; Q96-F99 HydrophobicContact CG-CD1 4.06Å; Q96-F99 HydrophobicContact CG-CE1 4.2Å
97	D	89.2	Confident	89.9	Confident	142 Å²	142	53.4 Å²	53.4	76%	0.759	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.2	143.4	176.1	-76.4	-40.1	0	0	0	112.2	F99	D97-F99 PolarHBondContact O-N 2.55Å
98	P	91.2	Very high	90	Very high	34 Å²	34	50 Å²	50	22%	0.221	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	130.6	-179.3	-26.2	35.1	0	0	0	112.4	L52 T53 V54	L52-P98 HydrophobicContact CB-CB 3.79Å; L52-P98 HydrophobicContact CD1-CB 4.13Å; T53-P98 WeakPolarHBondContact O-CA 3.41Å; V54-P98 HydrophobicContact CG2-CB 4.11Å; V54-P98 HydrophobicContact CG2-CG 4.08Å
99	F	90.9	Very high	90	Very high	18 Å²	18	49.9 Å²	49.9	8%	0.079	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	150.3	-170.6	60	-91.5	0	0	0	112.6	L52 T53 V55 I63 R93 Q96 D97 L101	L52-F99 CarbonylContact C-O 3.41Å; T53-F99 HydrophobicContact CG2-CE1 4.18Å; T53-F99 HydrophobicContact CG2-CE2 3.94Å; T53-F99 HydrophobicContact CG2-CZ 3.58Å; T53-F99 PolarHBondContact N-O 3.23Å; T53-F99 PolarHBondContact O-N 3.08Å; T53-F99 VanDerWaalsContact O-N 3.15Å; V55-F99 HydrophobicContact CG2-CE1 3.9Å; V55-F99 HydrophobicContact CG2-CZ 4.24Å; I63-F99 HydrophobicContact CD1-CE2 3.47Å; I63-F99 VanDerWaalsContact CD1-CE2 3.47Å; I63-F99 HydrophobicContact CD1-CZ 3.82Å; R93-F99 HydrophobicContact CB-CE1 4.37Å; R93-F99 HydrophobicContact CB-CZ 4.22Å; Q96-F99 HydrophobicContact CG-CD1 4.06Å; Q96-F99 HydrophobicContact CG-CE1 4.2Å; D97-F99 PolarHBondContact O-N 2.55Å; F99-L101 HydrophobicContact CE2-CD2 4.12Å
100	P	91.5	Very high	90	Very high	20 Å²	20	54.5 Å²	54.5	13%	0.13	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-80.4	157.5	174.1	33.3	-33.2	0	0	0	110.3	Y17 L30 V32 L52	Y17-P100 HydrophobicContact CD1-CB 3.79Å; Y17-P100 HydrophobicContact CD2-CB 4.16Å; Y17-P100 HydrophobicContact CE1-CB 4.21Å; Y17-P100 HydrophobicContact CG-CB 3.75Å; L30-P100 HydrophobicContact CD1-CB 4.03Å; L30-P100 HydrophobicContact CD2-CB 3.95Å; L30-P100 HydrophobicContact CD2-CG 3.66Å; V32-P100 HydrophobicContact CG2-CB 4.28Å; V32-P100 HydrophobicContact CG2-CG 4Å; L52-P100 HydrophobicContact CD2-CB 3.66Å; L52-P100 HydrophobicContact CD2-CG 4.18Å; L52-P100 VanDerWaalsContact CD2-N 3.33Å
101	L	90.1	Very high	90	Very high	16 Å²	16	55 Å²	55	8%	0.084	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-88.3	130.7	163.6	-59.2	177.8	0	0	0	108.9	Y17 H19 I63 F99 E105 L107	Y17-L101 WeakPolarHBondContact CE2-O 3.42Å; H19-L101 PolarHBondContact CE1-O 2.87Å; H19-L101 PolarHBondContact NE2-O 2.87Å; I63-L101 HydrophobicContact CD1-CD2 4.08Å; I63-L101 HydrophobicContact CG1-CD2 4.34Å; I63-L101 HydrophobicContact CG2-CD2 4.37Å; F99-L101 HydrophobicContact CE2-CD2 4.12Å; L101-E105 WeakPolarHBondContact CA-OE2 3.39Å; L101-E105 HydrophobicContact CB-CB 4.08Å; L101-E105 HydrophobicContact CD2-CB 4.37Å; L101-L107 HydrophobicContact CD1-CD1 4.26Å; L101-L107 HydrophobicContact CD1-CG 4.13Å
102	Y	90.2	Very high	90.1	Very high	54 Å²	54	58.3 Å²	58.3	21%	0.212	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-72	157.9	174.7	-76.6	-86.1	0	0	0	111.7	L30 V67 P75 V83 G104 E105	L30-Y102 HydrophobicContact CB-CD1 4.35Å; L30-Y102 HydrophobicContact CB-CE1 4.46Å; L30-Y102 HydrophobicContact CD2-CD1 3.67Å; L30-Y102 HydrophobicContact CD2-CE1 3.39Å; L30-Y102 HydrophobicContact CD2-CE2 4.41Å; L30-Y102 HydrophobicContact CD2-CG 4.28Å; V67-Y102 HydrophobicContact CB-CD2 3.96Å; V67-Y102 HydrophobicContact CB-CG 4.15Å; V67-Y102 HydrophobicContact CG1-CD2 3.71Å; V67-Y102 HydrophobicContact CG1-CE2 4.04Å; V67-Y102 HydrophobicContact CG1-CG 4.38Å; V67-Y102 HydrophobicContact CG2-CD1 4.48Å; V67-Y102 HydrophobicContact CG2-CD2 4.2Å; V67-Y102 HydrophobicContact CG2-CG 4.08Å; P75-Y102 HydrophobicContact CB-CE1 4.21Å; P75-Y102 HydrophobicContact CG-CD1 4.2Å; P75-Y102 HydrophobicContact CG-CE1 3.37Å; P75-Y102 HydrophobicContact CG-CE2 4.18Å; P75-Y102 VanDerWaalsContact CG-OH 3.29Å; P75-Y102 WeakPolarHBondContact CG-OH 3.46Å; V83-Y102 HydrophobicContact CG1-CD1 4.33Å; V83-Y102 HydrophobicContact CG2-CD1 4.42Å; Y102-G104 PolarHBondContact O-N 3.35Å; Y102-E105 PolarHBondContact N-OE2 3.29Å; Y102-E105 WeakPolarHBondContact O-CB 3.34Å; Y102-E105 PolarHBondContact O-N 3.03Å
103	P	86.4	Confident	90.2	Very high	13 Å²	13	60 Å²	60	8%	0.084	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	112.1	174.4	-26.9	35.7	0	0	0	111.8	H19 T28	H19-P103 VanDerWaalsContact CE1-CA 3.5Å; H19-P103 WeakPolarHBondContact CE1-CA 3.34Å; T28-P103 HydrophobicContact CG2-CB 3.81Å; T28-P103 HydrophobicContact CG2-CG 3.82Å; T28-P103 WeakPolarHBondContact O-CG 3.22Å
104	G	86.3	Confident	90.2	Very high	42 Å²	42	59.6 Å²	59.6	43%	0.433	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.1	-22.5	-175.7	0	0	0	0	0	114.8	N65 Y102	N65-G104 WeakPolarHBondContact CB-O 3.48Å; N65-G104 PolarHBondContact ND2-O 3.44Å; Y102-G104 PolarHBondContact O-N 3.35Å
105	E	91.3	Very high	90.2	Very high	9 Å²	9	58.1 Å²	58.1	4%	0.042	32%	0.319	C	S	.	.			trans	-70.1	140.5	170.4	-72.7	-171.6	145.9	0	0	110.5	I63 R64 N65 V67 R93 L101 Y102	I63-E105 HydrophobicContact CG2-CB 3.97Å; I63-E105 HydrophobicContact CG2-CG 4.06Å; R64-E105 WeakPolarHBondContact O-CA 3.5Å; N65-E105 WeakPolarHBondContact O-CG 3.29Å; V67-E105 WeakPolarHBondContact CG1-OE1 3.39Å; V67-E105 PolarHBondContact N-OE1 2.98Å; R93-E105 IonicContact CZ-OE1 2.85Å; R93-E105 IonicContact NH1-OE1 2.65Å; R93-E105 IonicContact NH1-OE2 2.7Å; R93-E105 IonicContact NH2-OE1 3.79Å; R93-E105 PolarHBondContact NH2-OE1 2.98Å; L101-E105 WeakPolarHBondContact CA-OE2 3.39Å; L101-E105 HydrophobicContact CB-CB 4.08Å; L101-E105 HydrophobicContact CD2-CB 4.37Å; Y102-E105 PolarHBondContact N-OE2 3.29Å; Y102-E105 WeakPolarHBondContact O-CB 3.34Å; Y102-E105 PolarHBondContact O-N 3.03Å
106	T	89.6	Confident	90.2	Very high	70 Å²	70	60.5 Å²	60.5	43%	0.429	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	141.1	174.1	47.8	0	0	0	0	110.8	I63 R64 K108	I63-T106 CarbonylContact C-O 3.56Å; I63-T106 WeakPolarHBondContact CA-O 3.49Å; R64-T106 PolarHBondContact N-O 2.74Å; R64-T106 PolarHBondContact O-N 2.96Å; R64-T106 VanDerWaalsContact O-N 3.1Å; T106-K108 PolarHBondContact O-N 2.9Å
107	L	89.5	Confident	90.4	Very high	67 Å²	67	56.1 Å²	56.1	35%	0.351	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	124.3	167.4	-83.9	160.3	0	0	0	109.1	T53 C61 I63 L101 D109	T53-L107 HydrophobicContact CG2-CD1 4.03Å; T53-L107 HydrophobicContact CG2-CD2 4.3Å; C61-L107 HydrophobicContact CB-CD2 3.73Å; I63-L107 HydrophobicContact CG1-CD2 4.29Å; L101-L107 HydrophobicContact CD1-CD1 4.26Å; L101-L107 HydrophobicContact CD1-CG 4.13Å; L107-D109 VanDerWaalsContact C-N 3.3Å
108	K	87.5	Confident	90.6	Very high	84 Å²	84	54.8 Å²	54.8	37%	0.365	30%	0.3	S	S	.	.	S	Bend	trans	-65.8	-35.7	178	178.5	176.6	-175.4	167	0	112	V62 R64 E90 T106	V62-K108 HydrophobicContact CB-CB 4.06Å; V62-K108 HydrophobicContact CB-CD 4.06Å; V62-K108 HydrophobicContact CG1-CB 4.18Å; V62-K108 HydrophobicContact CG1-CD 3.7Å; V62-K108 WeakPolarHBondContact O-CB 3.5Å; V62-K108 PolarHBondContact O-N 3.28Å; R64-K108 HydrophobicContact CG-CB 4.21Å; E90-K108 VanDerWaalsContact OE1-CD 3.28Å; E90-K108 WeakPolarHBondContact OE1-CD 3.29Å; E90-K108 VanDerWaalsContact OE1-CE 3.27Å; E90-K108 WeakPolarHBondContact OE1-CE 3.35Å; E90-K108 IonicContact OE1-NZ 2.83Å; E90-K108 PolarHBondContact OE1-NZ 2.95Å; E90-K108 IonicContact OE2-NZ 2.77Å; E90-K108 PolarHBondContact OE2-NZ 2.93Å; T106-K108 PolarHBondContact O-N 2.9Å
109	D	85.6	Confident	90.6	Very high	68 Å²	68	56.9 Å²	56.9	36%	0.364	31%	0.314	S	S	.	.	S	Bend	trans	-162.1	175.2	-174.3	-161.9	1.9	0	0	0	109.7	L107 R112	L107-D109 VanDerWaalsContact C-N 3.3Å; D109-R112 IonicContact OD2-CZ 3.49Å; D109-R112 IonicContact OD2-NE 2.68Å; D109-R112 PolarHBondContact OD2-NE 2.79Å; D109-R112 IonicContact OD2-NH2 3.78Å; D109-R112 PolarHBondContact OD2-NH2 3.19Å
110	I	89.7	Confident	90.6	Very high	131 Å²	131	60.9 Å²	60.9	67%	0.672	34%	0.336	S	S	*	.	S	Bend	trans	-60.2	158	171.9	63	171.8	0	0	0	112.2	R112	I110-R112 PolarHBondContact O-N 3.23Å
111	V	90.5	Very high	90.7	Very high	47 Å²	47	60.5 Å²	60.5	29%	0.285	33%	0.334	S	S	.	.			trans	-60.4	126.6	172.9	-179	0	0	0	0	109.5	V55 M59 C61	V55-V111 HydrophobicContact CG1-CG1 4.44Å; M59-V111 HydrophobicContact CB-CG1 3.68Å; M59-V111 HydrophobicContact CG-CG1 4.41Å; M59-V111 HydrophobicContact SD-CG1 3.93Å; C61-V111 HydrophobicContact CB-CG2 4.23Å
112	R	92.6	Very high	90.9	Very high	123 Å²	123	59.7 Å²	59.7	46%	0.464	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	147.4	-174.7	-73.3	176.4	175.8	-142.4	-0.8	111.4	M59 Y60 D109 I110	M59-R112 CarbonylContact C-O 3.46Å; M59-R112 VanDerWaalsContact CA-O 3.25Å; M59-R112 WeakPolarHBondContact CA-O 3.44Å; M59-R112 WeakPolarHBondContact CB-O 3.46Å; Y60-R112 HydrophobicContact CD1-CB 4.25Å; Y60-R112 VanDerWaalsContact CD1-O 3.29Å; Y60-R112 WeakPolarHBondContact CD1-O 3.14Å; Y60-R112 HydrophobicContact CE1-CB 3.69Å; Y60-R112 PolarHBondContact N-O 3.15Å; Y60-R112 PolarHBondContact O-N 3.26Å; D109-R112 IonicContact OD2-CZ 3.49Å; D109-R112 IonicContact OD2-NE 2.68Å; D109-R112 PolarHBondContact OD2-NE 2.79Å; D109-R112 IonicContact OD2-NH2 3.78Å; D109-R112 PolarHBondContact OD2-NH2 3.19Å; I110-R112 PolarHBondContact O-N 3.23Å
113	P	93.8	Very high	91.1	Very high	88 Å²	88	57.9 Å²	57.9	57%	0.571	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	148.2	171.1	30.1	-34.9	0	0	0	111.4	Y60	Y60-P113 WeakPolarHBondContact CE1-O 3.35Å
114	L	93.6	Very high	91.5	Very high	11 Å²	11	58.9 Å²	58.9	6%	0.058	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-66.3	134.7	170.4	-67.3	175.7	0	0	0	110.3	M58 Y60 F94 V116 T151 Y153	M58-L114 PolarHBondContact O-N 3.34Å; M58-L114 HydrophobicContact SD-CD1 4.2Å; Y60-L114 HydrophobicContact CD1-CD2 3.75Å; Y60-L114 HydrophobicContact CG-CD2 4.22Å; F94-L114 HydrophobicContact CD1-CD2 4.15Å; F94-L114 HydrophobicContact CE1-CD2 4.19Å; L114-V116 PolarHBondContact O-N 2.97Å; L114-T151 HydrophobicContact CB-CG2 3.51Å; L114-T151 HydrophobicContact CD1-CG2 3.87Å; L114-T151 HydrophobicContact CG-CG2 4.33Å; L114-Y153 HydrophobicContact CD1-CD1 3.96Å; L114-Y153 HydrophobicContact CD1-CE1 3.5Å; L114-Y153 HydrophobicContact CD1-CE2 4.11Å; L114-Y153 HydrophobicContact CD1-CG 4.45Å; L114-Y153 HydrophobicContact CD2-CD1 4.18Å; L114-Y153 HydrophobicContact CD2-CG 4.48Å
115	P	92	Very high	91.9	Very high	34 Å²	34	57 Å²	57	22%	0.221	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-63.8	120.3	177.3	-23.1	34.3	0	0	0	112.2	L123 Y152 P154 I160	P115-L123 HydrophobicContact CB-CD1 3.71Å; P115-L123 HydrophobicContact CG-CD1 4.49Å; P115-Y152 HydrophobicContact CG-CD1 4.41Å; P115-Y152 PolarHBondContact O-N 3.02Å; P115-P154 HydrophobicContact CG-CG 4.45Å; P115-I160 HydrophobicContact CG-CD1 3.91Å
116	V	92.3	Very high	92.1	Very high	102 Å²	102	59.9 Å²	59.9	62%	0.618	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	123.7	173	-179.1	0	0	0	0	109.1	L114	L114-V116 PolarHBondContact O-N 2.97Å
117	V	93.7	Very high	92.2	Very high	6 Å²	6	56.6 Å²	56.6	4%	0.036	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	128.7	-179.9	-169.2	0	0	0	0	108.8	S121 L123 F146 P149 G150	V117-S121 WeakPolarHBondContact CG1-O 3.4Å; V117-L123 HydrophobicContact CG2-CD1 3.54Å; V117-L123 HydrophobicContact CG2-CG 3.6Å; V117-F146 HydrophobicContact CB-CD1 4.32Å; V117-F146 HydrophobicContact CB-CE1 4.28Å; V117-F146 HydrophobicContact CG2-CD1 3.75Å; V117-F146 HydrophobicContact CG2-CE1 3.88Å; V117-P149 WeakPolarHBondContact O-CA 3.42Å; V117-G150 PolarHBondContact N-O 3.47Å; V117-G150 PolarHBondContact O-N 3.38Å; V117-G150 VanDerWaalsContact O-N 3.07Å
118	L	93.3	Very high	92.3	Very high	113 Å²	113	57.7 Å²	57.7	59%	0.592	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-85.7	161.9	-175	-62.7	178.5	0	0	0	110.9	S121 G148	L118-S121 PolarHBondContact N-OG 3.32Å; L118-S121 PolarHBondContact O-N 2.95Å; L118-S121 PolarHBondContact O-OG 3.49Å; L118-S121 VanDerWaalsContact O-OG 3.08Å; L118-G148 WeakPolarHBondContact O-CA 3.41Å
119	P	91.8	Very high	92.4	Very high	79 Å²	79	56.1 Å²	56.1	51%	0.513	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	144	166.1	-22	32.5	0	0	0	110.8	S121 P149	P119-S121 PolarHBondContact O-N 2.69Å; P119-P149 HydrophobicContact CG-CB 4.02Å; P119-P149 HydrophobicContact CG-CG 4.28Å
120	N	91.7	Very high	92.6	Very high	101 Å²	101	58.3 Å²	58.3	54%	0.54	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	19.2	-177.5	-54	-31.6	0	0	0	114.8	A166 A204	N120-A166 HydrophobicContact CB-CB 3.87Å; N120-A166 WeakPolarHBondContact O-CB 3.43Å; N120-A166 PolarHBondContact O-N 2.83Å; N120-A204 HydrophobicContact CB-CB 4.38Å
121	S	93.5	Very high	92.7	Very high	12 Å²	12	53.2 Å²	53.2	8%	0.084	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	162.5	166.4	70.8	0	0	0	0	111.9	V117 L118 P119 G148 E164	V117-S121 WeakPolarHBondContact CG1-O 3.4Å; L118-S121 PolarHBondContact N-OG 3.32Å; L118-S121 PolarHBondContact O-N 2.95Å; L118-S121 PolarHBondContact O-OG 3.49Å; L118-S121 VanDerWaalsContact O-OG 3.08Å; P119-S121 PolarHBondContact O-N 2.69Å; S121-G148 PolarHBondContact O-N 3.45Å; S121-E164 CarbonylContact C-O 3.53Å; S121-E164 VanDerWaalsContact CA-O 3.23Å; S121-E164 WeakPolarHBondContact CA-O 3.45Å; S121-E164 VanDerWaalsContact CB-O 3.26Å; S121-E164 WeakPolarHBondContact CB-O 3.39Å
122	A	94.5	Very high	92.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	153.1	174.6	0	0	0	0	0	111.8	L145 F146 E147 C163 E164 L206	A122-L145 HydrophobicContact CB-CB 3.97Å; A122-L145 HydrophobicContact CB-CD1 4.35Å; A122-L145 HydrophobicContact CB-CD2 4.05Å; A122-L145 HydrophobicContact CB-CG 4.33Å; A122-F146 CarbonylContact C-O 3.57Å; A122-F146 WeakPolarHBondContact CA-O 3.49Å; A122-F146 WeakPolarHBondContact CB-O 3.44Å; A122-E147 HydrophobicContact CB-CG 4.24Å; A122-C163 CarbonylContact O-C 3.59Å; A122-C163 WeakPolarHBondContact O-CA 3.35Å; A122-E164 PolarHBondContact N-O 3.15Å; A122-E164 PolarHBondContact O-N 3.5Å; A122-L206 HydrophobicContact CB-CD2 3.89Å
123	L	94.8	Very high	92.1	Very high	16 Å²	16	52.8 Å²	52.8	8%	0.084	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	125	161.1	-67.8	172.4	0	0	0	109.1	P115 V117 L125 L145 F146 Y152 I160 C163	P115-L123 HydrophobicContact CB-CD1 3.71Å; P115-L123 HydrophobicContact CG-CD1 4.49Å; V117-L123 HydrophobicContact CG2-CD1 3.54Å; V117-L123 HydrophobicContact CG2-CG 3.6Å; L123-L125 HydrophobicContact CB-CD2 4.16Å; L123-L125 PolarHBondContact O-N 2.79Å; L123-L145 WeakPolarHBondContact O-CA 3.49Å; L123-F146 HydrophobicContact CB-CB 4.48Å; L123-F146 PolarHBondContact N-O 3.33Å; L123-F146 PolarHBondContact O-N 3.07Å; L123-Y152 HydrophobicContact CD1-CD1 4.12Å; L123-Y152 HydrophobicContact CD1-CG 4.15Å; L123-I160 HydrophobicContact CD2-CG2 3.94Å; L123-C163 HydrophobicContact CD2-CB 4.22Å
124	R	94.4	Very high	91.4	Very high	34 Å²	34	51.5 Å²	51.5	13%	0.128	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	115.1	167.5	-171.3	-179.1	-172.5	114.3	4.9	108.1	E143 L145 V161 K162 E164 V209	R124-E143 IonicContact CZ-OE2 3.03Å; R124-E143 IonicContact NE-OE2 3.18Å; R124-E143 PolarHBondContact NE-OE2 3.25Å; R124-E143 IonicContact NH2-OE2 3.38Å; R124-E143 PolarHBondContact NH2-OE2 3.31Å; R124-L145 HydrophobicContact CB-CD2 4.08Å; R124-L145 HydrophobicContact CG-CD2 4.37Å; R124-V161 HydrophobicContact CB-CB 4.43Å; R124-V161 HydrophobicContact CG-CB 4.32Å; R124-V161 WeakPolarHBondContact O-CB 3.44Å; R124-V161 PolarHBondContact O-N 3.4Å; R124-K162 HydrophobicContact CB-CG 4.05Å; R124-K162 PolarHBondContact N-O 3.27Å; R124-E164 HydrophobicContact CB-CG 4.25Å; R124-E164 IonicContact NH1-OE1 3.06Å; R124-E164 PolarHBondContact NH1-OE1 3.39Å; R124-E164 VanDerWaalsContact NH1-OE1 3.13Å; R124-V209 PolarHBondContact NH1-O 2.92Å; R124-V209 PolarHBondContact NH2-O 3.2Å
125	L	94.5	Very high	90.9	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	149.7	-177.9	-59.8	179.3	0	0	0	109.6	L123 E143 W144 F146 Y152 V158 E159 I160	L123-L125 HydrophobicContact CB-CD2 4.16Å; L123-L125 PolarHBondContact O-N 2.79Å; L125-E143 CarbonylContact O-C 3.58Å; L125-E143 WeakPolarHBondContact O-CA 3.48Å; L125-E143 WeakPolarHBondContact O-CB 3.39Å; L125-W144 HydrophobicContact CB-CD2 4.08Å; L125-W144 HydrophobicContact CB-CE3 4.46Å; L125-W144 HydrophobicContact CB-CH2 4.37Å; L125-W144 HydrophobicContact CB-CZ2 4Å; L125-W144 HydrophobicContact CD1-CZ2 4.09Å; L125-W144 PolarHBondContact N-O 3.39Å; L125-W144 PolarHBondContact O-N 2.98Å; L125-F146 HydrophobicContact CD1-CB 3.79Å; L125-F146 HydrophobicContact CG-CB 4.43Å; L125-Y152 HydrophobicContact CD1-CD2 4.07Å; L125-Y152 HydrophobicContact CD1-CE2 3.4Å; L125-Y152 HydrophobicContact CD2-CD1 4.41Å; L125-Y152 HydrophobicContact CD2-CE1 3.81Å; L125-Y152 HydrophobicContact CD2-CE2 4.2Å; L125-Y152 HydrophobicContact CG-CE2 4.46Å; L125-V158 HydrophobicContact CB-CG1 3.79Å; L125-V158 HydrophobicContact CD1-CG1 4.29Å; L125-V158 HydrophobicContact CD2-CG1 4.2Å; L125-V158 HydrophobicContact CG-CG1 4.31Å; L125-E159 CarbonylContact C-O 3.51Å; L125-E159 WeakPolarHBondContact CA-O 3.22Å; L125-I160 HydrophobicContact CD2-CB 4.34Å; L125-I160 HydrophobicContact CD2-CG1 3.8Å
126	R	94.4	Very high	90.6	Very high	71 Å²	71	60.9 Å²	60.9	27%	0.268	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	131.7	174.5	176.8	164.9	55.1	-135.6	8.2	110.4	E142 E143 V158 E159 V161	R126-E142 CarbonylContact C-O 3.6Å; R126-E142 WeakPolarHBondContact CA-O 3.35Å; R126-E143 HydrophobicContact CB-CG 3.93Å; R126-E143 HydrophobicContact CG-CG 4.05Å; R126-E143 IonicContact CZ-OE1 2.6Å; R126-E143 IonicContact NH1-OE1 3.15Å; R126-E143 PolarHBondContact NH1-OE1 3.2Å; R126-V158 WeakPolarHBondContact O-CA 3.42Å; R126-E159 HydrophobicContact CB-CB 4.46Å; R126-E159 IonicContact CZ-OE2 2.63Å; R126-E159 PolarHBondContact N-O 3.11Å; R126-E159 IonicContact NE-OE2 2.76Å; R126-E159 PolarHBondContact NE-OE2 2.7Å; R126-E159 IonicContact NH2-OE1 2.76Å; R126-E159 PolarHBondContact NH2-OE1 3.02Å; R126-E159 VanDerWaalsContact NH2-OE1 3.16Å; R126-E159 IonicContact NH2-OE2 3.1Å; R126-E159 PolarHBondContact NH2-OE2 3.46Å; R126-E159 PolarHBondContact O-N 3.13Å; R126-V161 HydrophobicContact CB-CG2 3.56Å
127	A	92.9	Very high	90.5	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.008	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	130.1	170.3	0	0	0	0	0	110	F131 R138 I139 G141 E142 W144 E157	A127-F131 HydrophobicContact CB-CD1 4.49Å; A127-F131 HydrophobicContact CB-CE1 4.09Å; A127-R138 HydrophobicContact CB-CB 4.23Å; A127-I139 VanDerWaalsContact CB-O 3.29Å; A127-I139 WeakPolarHBondContact CB-O 3.42Å; A127-G141 PolarHBondContact O-N 2.98Å; A127-E142 PolarHBondContact N-O 3.46Å; A127-W144 HydrophobicContact CB-CH2 4.32Å; A127-W144 HydrophobicContact CB-CZ3 3.89Å; A127-E157 CarbonylContact C-O 3.59Å; A127-E157 WeakPolarHBondContact CA-O 3.43Å
128	V	91.4	Very high	90.3	Very high	89 Å²	89	66.9 Å²	66.9	54%	0.539	36%	0.356	S	S	.	.	S	Bend	trans	-92.9	-27.9	175.6	-171.9	0	0	0	0	110.8	E157 E159	V128-E157 PolarHBondContact N-O 3.11Å; V128-E159 HydrophobicContact CG2-CB 3.75Å
129	S	89	Confident	90.2	Very high	51 Å²	51	66.6 Å²	66.6	36%	0.357	35%	0.354	S	S	.	.	S	Bend	trans	-141.7	156.6	177.4	56.1	0	0	0	0	110.1	F131	S129-F131 WeakPolarHBondContact O-CD1 3.32Å; S129-F131 PolarHBondContact O-N 3.43Å
130	D	90.6	Very high	90.1	Very high	114 Å²	114	65.2 Å²	65.2	61%	0.61	35%	0.349	S	S	*	.			trans	-62.1	130.3	175.1	-63	-3.7	0	0	0	111	R138 I139 A140	D130-R138 WeakPolarHBondContact CA-O 3.4Å; D130-I139 WeakPolarHBondContact OD1-CA 3.37Å; D130-A140 PolarHBondContact OD1-N 3Å
131	F	90.7	Very high	89.9	Confident	25 Å²	25	62.4 Å²	62.4	11%	0.11	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	167.3	177.8	80	-75.5	0	0	0	113	A127 S129 D133 R138 W144 E157 V158	A127-F131 HydrophobicContact CB-CD1 4.49Å; A127-F131 HydrophobicContact CB-CE1 4.09Å; S129-F131 WeakPolarHBondContact O-CD1 3.32Å; S129-F131 PolarHBondContact O-N 3.43Å; F131-D133 HydrophobicContact CD2-CB 4.33Å; F131-D133 HydrophobicContact CE2-CB 3.53Å; F131-D133 HydrophobicContact CZ-CB 3.93Å; F131-R138 HydrophobicContact CD1-CB 3.79Å; F131-R138 HydrophobicContact CD1-CG 4.44Å; F131-R138 HydrophobicContact CE1-CB 3.51Å; F131-R138 HydrophobicContact CE1-CG 3.8Å; F131-R138 HydrophobicContact CZ-CB 4.11Å; F131-R138 HydrophobicContact CZ-CG 3.88Å; F131-R138 PolarHBondContact N-O 3.49Å; F131-R138 PolarHBondContact O-N 3.17Å; F131-W144 AromaticContact CE1-CH2 3.89Å; F131-W144 HydrophobicContact CE1-CH2 3.89Å; F131-W144 AromaticContact CZ-CH2 3.83Å; F131-W144 HydrophobicContact CZ-CH2 3.83Å; F131-W144 HydrophobicContact CZ-CZ2 4.14Å; F131-E157 HydrophobicContact CB-CB 4.1Å; F131-E157 HydrophobicContact CB-CG 3.91Å; F131-E157 HydrophobicContact CD1-CB 3.62Å; F131-E157 HydrophobicContact CD1-CG 4.39Å; F131-E157 HydrophobicContact CD2-CB 4.32Å; F131-E157 HydrophobicContact CE1-CB 4.08Å; F131-E157 HydrophobicContact CG-CB 3.76Å; F131-E157 HydrophobicContact CG-CG 4.07Å; F131-V158 HydrophobicContact CE1-CG2 3.65Å; F131-V158 HydrophobicContact CE2-CG2 4.16Å; F131-V158 HydrophobicContact CZ-CG2 3.34Å
132	E	88.3	Confident	89.7	Confident	113 Å²	113	64.2 Å²	64.2	53%	0.528	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	109.5	175.3	-74.6	174.8	-180	0	0	110.1	G134 R137	E132-G134 PolarHBondContact O-N 3.3Å; E132-R137 HydrophobicContact CG-CG 3.65Å; E132-R137 IonicContact OE1-CZ 3.16Å; E132-R137 IonicContact OE1-NE 3.48Å; E132-R137 PolarHBondContact OE1-NE 3.27Å; E132-R137 IonicContact OE1-NH2 2.71Å; E132-R137 PolarHBondContact OE1-NH2 3.19Å
133	D	81.9	Confident	89.6	Confident	47 Å²	47	65.7 Å²	65.7	25%	0.251	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	83.2	173.7	-161.1	21.4	0	0	0	109.9	F131 N135 V136 R138 R155	F131-D133 HydrophobicContact CD2-CB 4.33Å; F131-D133 HydrophobicContact CE2-CB 3.53Å; F131-D133 HydrophobicContact CZ-CB 3.93Å; D133-N135 PolarHBondContact O-N 3.07Å; D133-N135 VanDerWaalsContact O-N 3.07Å; D133-V136 PolarHBondContact N-O 2.98Å; D133-V136 PolarHBondContact O-N 3.38Å; D133-V136 VanDerWaalsContact O-N 3.09Å; D133-R138 HydrophobicContact CB-CG 4.05Å; D133-R155 IonicContact OD1-CZ 3.67Å; D133-R155 IonicContact OD1-NH1 3.71Å; D133-R155 PolarHBondContact OD1-NH1 3.49Å; D133-R155 IonicContact OD1-NH2 2.69Å; D133-R155 PolarHBondContact OD1-NH2 3.4Å
134	G	80.7	Confident	89.5	Confident	62 Å²	62	66 Å²	66	64%	0.639	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	-107.5	-171.6	0	0	0	0	0	110.5	E132	E132-G134 PolarHBondContact O-N 3.3Å
135	N	81.9	Confident	89.5	Confident	176 Å²	176	65.7 Å²	65.7	94%	0.941	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	0.1	178.2	-67.4	-11	0	0	0	113.5	D133	D133-N135 PolarHBondContact O-N 3.07Å; D133-N135 VanDerWaalsContact O-N 3.07Å
136	V	86.3	Confident	89.4	Confident	66 Å²	66	68.5 Å²	68.5	40%	0.4	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	117.6	-177.1	-175.6	0	0	0	0	109.8	D133 R138	D133-V136 PolarHBondContact N-O 2.98Å; D133-V136 PolarHBondContact O-N 3.38Å; D133-V136 VanDerWaalsContact O-N 3.09Å; V136-R138 PolarHBondContact O-N 3.02Å
137	R	89.6	Confident	89.3	Confident	191 Å²	191	69.5 Å²	69.5	72%	0.721	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	117.5	165.3	-85.6	-176.2	174.6	-171	-4.5	109.3	E132	E132-R137 HydrophobicContact CG-CG 3.65Å; E132-R137 IonicContact OE1-CZ 3.16Å; E132-R137 IonicContact OE1-NE 3.48Å; E132-R137 PolarHBondContact OE1-NE 3.27Å; E132-R137 IonicContact OE1-NH2 2.71Å; E132-R137 PolarHBondContact OE1-NH2 3.19Å
138	R	89.9	Confident	89.2	Confident	42 Å²	42	70.3 Å²	70.3	16%	0.158	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	134.5	172.3	-62.1	-62.9	-171.9	-177.3	1.7	109.5	A127 D130 F131 D133 V136 E142 W144	A127-R138 HydrophobicContact CB-CB 4.23Å; D130-R138 WeakPolarHBondContact CA-O 3.4Å; F131-R138 HydrophobicContact CD1-CB 3.79Å; F131-R138 HydrophobicContact CD1-CG 4.44Å; F131-R138 HydrophobicContact CE1-CB 3.51Å; F131-R138 HydrophobicContact CE1-CG 3.8Å; F131-R138 HydrophobicContact CZ-CB 4.11Å; F131-R138 HydrophobicContact CZ-CG 3.88Å; F131-R138 PolarHBondContact N-O 3.49Å; F131-R138 PolarHBondContact O-N 3.17Å; D133-R138 HydrophobicContact CB-CG 4.05Å; V136-R138 PolarHBondContact O-N 3.02Å; R138-E142 VanDerWaalsContact CA-OE2 3.28Å; R138-E142 WeakPolarHBondContact CA-OE2 3.49Å; R138-E142 VanDerWaalsContact CD-OE1 3.22Å; R138-E142 WeakPolarHBondContact CD-OE1 3.44Å; R138-E142 IonicContact CZ-OE1 3.85Å; R138-E142 IonicContact NE-OE1 3.71Å; R138-E142 IonicContact NH1-OE1 2.88Å; R138-E142 PolarHBondContact NH1-OE1 3.25Å; R138-W144 HydrophobicContact CB-CZ3 4.49Å; R138-W144 HydrophobicContact CG-CH2 4.16Å; R138-W144 HydrophobicContact CG-CZ3 4.15Å
139	I	91.1	Very high	89.2	Confident	108 Å²	108	71.1 Å²	71.1	55%	0.554	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-101.8	144.6	178.2	-57	172	0	0	0	109.3	A127 D130 G141 E142	A127-I139 VanDerWaalsContact CB-O 3.29Å; A127-I139 WeakPolarHBondContact CB-O 3.42Å; D130-I139 WeakPolarHBondContact OD1-CA 3.37Å; I139-G141 PolarHBondContact O-N 3.02Å; I139-E142 PolarHBondContact N-OE2 2.96Å; I139-E142 WeakPolarHBondContact O-CB 3.28Å; I139-E142 PolarHBondContact O-N 3.36Å
140	A	89.5	Confident	89.4	Confident	50 Å²	50	69.9 Å²	69.9	41%	0.413	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	128.4	176.3	0	0	0	0	0	112	D130	D130-A140 PolarHBondContact OD1-N 3Å
141	G	87.3	Confident	89.5	Confident	42 Å²	42	66.4 Å²	66.4	43%	0.433	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	-5.6	-174.2	0	0	0	0	0	115.4	A127 I139	A127-G141 PolarHBondContact O-N 2.98Å; I139-G141 PolarHBondContact O-N 3.02Å
142	E	91	Very high	89.6	Confident	50 Å²	50	66 Å²	66	23%	0.234	37%	0.371	C	S	.	.			trans	-68.5	134.5	171.5	-171.2	-172.6	150.3	0	0	110.7	R126 A127 R138 I139	R126-E142 CarbonylContact C-O 3.6Å; R126-E142 WeakPolarHBondContact CA-O 3.35Å; A127-E142 PolarHBondContact N-O 3.46Å; R138-E142 VanDerWaalsContact CA-OE2 3.28Å; R138-E142 WeakPolarHBondContact CA-OE2 3.49Å; R138-E142 VanDerWaalsContact CD-OE1 3.22Å; R138-E142 WeakPolarHBondContact CD-OE1 3.44Å; R138-E142 IonicContact CZ-OE1 3.85Å; R138-E142 IonicContact NE-OE1 3.71Å; R138-E142 IonicContact NH1-OE1 2.88Å; R138-E142 PolarHBondContact NH1-OE1 3.25Å; I139-E142 PolarHBondContact N-OE2 2.96Å; I139-E142 WeakPolarHBondContact O-CB 3.28Å; I139-E142 PolarHBondContact O-N 3.36Å
143	E	92.6	Very high	89.8	Confident	31 Å²	31	66 Å²	66	15%	0.145	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.6	177.4	-61.3	-168	160.1	0	0	111.6	R124 L125 R126 V209	R124-E143 IonicContact CZ-OE2 3.03Å; R124-E143 IonicContact NE-OE2 3.18Å; R124-E143 PolarHBondContact NE-OE2 3.25Å; R124-E143 IonicContact NH2-OE2 3.38Å; R124-E143 PolarHBondContact NH2-OE2 3.31Å; L125-E143 CarbonylContact O-C 3.58Å; L125-E143 WeakPolarHBondContact O-CA 3.48Å; L125-E143 WeakPolarHBondContact O-CB 3.39Å; R126-E143 HydrophobicContact CB-CG 3.93Å; R126-E143 HydrophobicContact CG-CG 4.05Å; R126-E143 IonicContact CZ-OE1 2.6Å; R126-E143 IonicContact NH1-OE1 3.15Å; R126-E143 PolarHBondContact NH1-OE1 3.2Å; E143-V209 HydrophobicContact CB-CG1 3.54Å
144	W	92.5	Very high	90.3	Very high	23 Å²	23	64 Å²	64	9%	0.087	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	169.3	175	70.8	101.9	0	0	0	112.2	L125 A127 F131 R138 V158	L125-W144 HydrophobicContact CB-CD2 4.08Å; L125-W144 HydrophobicContact CB-CE3 4.46Å; L125-W144 HydrophobicContact CB-CH2 4.37Å; L125-W144 HydrophobicContact CB-CZ2 4Å; L125-W144 HydrophobicContact CD1-CZ2 4.09Å; L125-W144 PolarHBondContact N-O 3.39Å; L125-W144 PolarHBondContact O-N 2.98Å; A127-W144 HydrophobicContact CB-CH2 4.32Å; A127-W144 HydrophobicContact CB-CZ3 3.89Å; F131-W144 AromaticContact CE1-CH2 3.89Å; F131-W144 HydrophobicContact CE1-CH2 3.89Å; F131-W144 AromaticContact CZ-CH2 3.83Å; F131-W144 HydrophobicContact CZ-CH2 3.83Å; F131-W144 HydrophobicContact CZ-CZ2 4.14Å; R138-W144 HydrophobicContact CB-CZ3 4.49Å; R138-W144 HydrophobicContact CG-CH2 4.16Å; R138-W144 HydrophobicContact CG-CZ3 4.15Å; W144-V158 HydrophobicContact CH2-CB 4.4Å; W144-V158 HydrophobicContact CH2-CG1 3.66Å; W144-V158 HydrophobicContact CH2-CG2 3.85Å; W144-V158 HydrophobicContact CZ2-CG1 3.79Å; W144-V158 HydrophobicContact CZ2-CG2 4.1Å
145	L	93	Very high	90.8	Very high	26 Å²	26	65.9 Å²	65.9	14%	0.136	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	134.3	174.9	-63	-179.9	0	0	0	110.4	A122 L123 R124 E147 E164 P207 V209	A122-L145 HydrophobicContact CB-CB 3.97Å; A122-L145 HydrophobicContact CB-CD1 4.35Å; A122-L145 HydrophobicContact CB-CD2 4.05Å; A122-L145 HydrophobicContact CB-CG 4.33Å; L123-L145 WeakPolarHBondContact O-CA 3.49Å; R124-L145 HydrophobicContact CB-CD2 4.08Å; R124-L145 HydrophobicContact CG-CD2 4.37Å; L145-E147 HydrophobicContact CB-CG 4.12Å; L145-E164 HydrophobicContact CD2-CG 4.06Å; L145-P207 WeakPolarHBondContact CD1-O 3.47Å; L145-V209 HydrophobicContact CD2-CG2 4.45Å; L145-V209 HydrophobicContact CG-CG2 3.91Å
146	F	93.3	Very high	91.1	Very high	60 Å²	60	61.4 Å²	61.4	26%	0.263	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	100.7	158.5	178.8	-88.3	0	0	0	107.5	V117 A122 L123 L125 Y152	V117-F146 HydrophobicContact CB-CD1 4.32Å; V117-F146 HydrophobicContact CB-CE1 4.28Å; V117-F146 HydrophobicContact CG2-CD1 3.75Å; V117-F146 HydrophobicContact CG2-CE1 3.88Å; A122-F146 CarbonylContact C-O 3.57Å; A122-F146 WeakPolarHBondContact CA-O 3.49Å; A122-F146 WeakPolarHBondContact CB-O 3.44Å; L123-F146 HydrophobicContact CB-CB 4.48Å; L123-F146 PolarHBondContact N-O 3.33Å; L123-F146 PolarHBondContact O-N 3.07Å; L125-F146 HydrophobicContact CD1-CB 3.79Å; L125-F146 HydrophobicContact CG-CB 4.43Å; F146-Y152 HydrophobicContact CB-CD2 4.41Å; F146-Y152 HydrophobicContact CD1-CD2 4.33Å; F146-Y152 AromaticContact CD2-CD2 3.84Å; F146-Y152 HydrophobicContact CD2-CD2 3.84Å; F146-Y152 HydrophobicContact CE2-CD2 4.14Å; F146-Y152 AromaticContact CG-CD2 3.94Å; F146-Y152 HydrophobicContact CG-CD2 3.94Å
147	E	92.4	Very high	91.4	Very high	92 Å²	92	60.3 Å²	60.3	43%	0.43	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	136.4	-176.2	-57.5	-171.8	-175.6	0	0	111.2	A122 L145 R186 L206	A122-E147 HydrophobicContact CB-CG 4.24Å; L145-E147 HydrophobicContact CB-CG 4.12Å; E147-R186 IonicContact OE1-CZ 3.69Å; E147-R186 VanDerWaalsContact OE1-CZ 3.3Å; E147-R186 IonicContact OE1-NH1 3.93Å; E147-R186 PolarHBondContact OE1-NH1 3.28Å; E147-R186 IonicContact OE1-NH2 2.78Å; E147-R186 PolarHBondContact OE1-NH2 3.4Å; E147-R186 IonicContact OE2-CZ 2.69Å; E147-R186 IonicContact OE2-NH1 3.75Å; E147-R186 PolarHBondContact OE2-NH1 2.86Å; E147-R186 IonicContact OE2-NH2 3.22Å; E147-L206 HydrophobicContact CG-CD2 4.15Å
148	G	90.2	Very high	91.6	Very high	19 Å²	19	51.7 Å²	51.7	20%	0.196	28%	0.276	C	S	.	.	S	Bend	trans	-82.8	167.4	174.9	0	0	0	0	0	113.4	L118 S121	L118-G148 WeakPolarHBondContact O-CA 3.41Å; S121-G148 PolarHBondContact O-N 3.45Å
149	P	92.2	Very high	91.8	Very high	105 Å²	105	53.7 Å²	53.7	68%	0.682	29%	0.287	S	S	*	.	S	Bend	cis	-80.1	130.4	5.8	29.6	-33.2	0	0	0	113.6	V117 P119	V117-P149 WeakPolarHBondContact O-CA 3.42Å; P119-P149 HydrophobicContact CG-CB 4.02Å; P119-P149 HydrophobicContact CG-CG 4.28Å
150	G	91.9	Very high	91.8	Very high	25 Å²	25	51.6 Å²	51.6	26%	0.258	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	157.5	177.1	0	0	0	0	0	113.9	V117	V117-G150 PolarHBondContact N-O 3.47Å; V117-G150 PolarHBondContact O-N 3.38Å; V117-G150 VanDerWaalsContact O-N 3.07Å
151	T	92.4	Very high	91.9	Very high	41 Å²	41	51.7 Å²	51.7	25%	0.252	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.5	171.8	-56.8	0	0	0	0	109.1	M58 L114 Y153	M58-T151 HydrophobicContact SD-CG2 4.18Å; L114-T151 HydrophobicContact CB-CG2 3.51Å; L114-T151 HydrophobicContact CD1-CG2 3.87Å; L114-T151 HydrophobicContact CG-CG2 4.33Å; T151-Y153 HydrophobicContact CG2-CE2 4.22Å
152	Y	93.8	Very high	92.1	Very high	16 Å²	16	54.4 Å²	54.4	6%	0.063	27%	0.271	C	S	.	.			trans	-82.3	137.5	176.6	-179.7	-115	0	0	0	110.8	P115 L123 L125 F146 P154 V158 I160	P115-Y152 HydrophobicContact CG-CD1 4.41Å; P115-Y152 PolarHBondContact O-N 3.02Å; L123-Y152 HydrophobicContact CD1-CD1 4.12Å; L123-Y152 HydrophobicContact CD1-CG 4.15Å; L125-Y152 HydrophobicContact CD1-CD2 4.07Å; L125-Y152 HydrophobicContact CD1-CE2 3.4Å; L125-Y152 HydrophobicContact CD2-CD1 4.41Å; L125-Y152 HydrophobicContact CD2-CE1 3.81Å; L125-Y152 HydrophobicContact CD2-CE2 4.2Å; L125-Y152 HydrophobicContact CG-CE2 4.46Å; F146-Y152 HydrophobicContact CB-CD2 4.41Å; F146-Y152 HydrophobicContact CD1-CD2 4.33Å; F146-Y152 AromaticContact CD2-CD2 3.84Å; F146-Y152 HydrophobicContact CD2-CD2 3.84Å; F146-Y152 HydrophobicContact CE2-CD2 4.14Å; F146-Y152 AromaticContact CG-CD2 3.94Å; F146-Y152 HydrophobicContact CG-CD2 3.94Å; Y152-P154 HydrophobicContact CD1-CG 4.08Å; Y152-P154 HydrophobicContact CE1-CB 4.18Å; Y152-P154 HydrophobicContact CE1-CG 4.08Å; Y152-P154 WeakPolarHBondContact O-CD 3.44Å; Y152-V158 WeakPolarHBondContact OH-CB 3.48Å; Y152-V158 VanDerWaalsContact OH-CG1 3.26Å; Y152-V158 WeakPolarHBondContact OH-CG1 3.23Å; Y152-I160 HydrophobicContact CD1-CD1 3.87Å; Y152-I160 HydrophobicContact CD1-CG1 4.26Å; Y152-I160 HydrophobicContact CE1-CD1 3.83Å; Y152-I160 HydrophobicContact CE1-CG1 3.82Å
153	Y	92.8	Very high	92.1	Very high	114 Å²	114	55.5 Å²	55.5	45%	0.447	28%	0.283	S	S	.	.			trans	-107.3	103.6	175.7	-76.8	-104.1	0	0	0	108.9	F94 L114 T151	F94-Y153 AromaticContact CD1-CD1 3.76Å; F94-Y153 HydrophobicContact CD1-CD1 3.76Å; F94-Y153 HydrophobicContact CD1-CE1 4.29Å; F94-Y153 AromaticContact CE1-CD1 3.72Å; F94-Y153 HydrophobicContact CE1-CD1 3.72Å; F94-Y153 HydrophobicContact CE1-CG 4.45Å; F94-Y153 HydrophobicContact CG-CD1 4.28Å; F94-Y153 HydrophobicContact CZ-CD1 4.19Å; L114-Y153 HydrophobicContact CD1-CD1 3.96Å; L114-Y153 HydrophobicContact CD1-CE1 3.5Å; L114-Y153 HydrophobicContact CD1-CE2 4.11Å; L114-Y153 HydrophobicContact CD1-CG 4.45Å; L114-Y153 HydrophobicContact CD2-CD1 4.18Å; L114-Y153 HydrophobicContact CD2-CG 4.48Å; T151-Y153 HydrophobicContact CG2-CE2 4.22Å
154	P	92.4	Very high	92	Very high	6 Å²	6	55.6 Å²	55.6	4%	0.039	28%	0.284	C	S	.	.			trans	-62.4	148.4	-177.6	-25.1	37.1	0	0	0	112.7	Y60 Y92 F94 P115 Y152	Y60-P154 HydrophobicContact CD1-CG 4.46Å; Y60-P154 HydrophobicContact CE1-CG 3.96Å; Y60-P154 HydrophobicContact CE2-CB 4.19Å; Y60-P154 HydrophobicContact CE2-CG 4.19Å; Y92-P154 HydrophobicContact CD1-CB 3.86Å; Y92-P154 VanDerWaalsContact CD1-O 3.31Å; Y92-P154 WeakPolarHBondContact CD1-O 3.45Å; Y92-P154 HydrophobicContact CE1-CB 3.66Å; F94-P154 WeakPolarHBondContact CZ-O 3.35Å; P115-P154 HydrophobicContact CG-CG 4.45Å; Y152-P154 HydrophobicContact CD1-CG 4.08Å; Y152-P154 HydrophobicContact CE1-CB 4.18Å; Y152-P154 HydrophobicContact CE1-CG 4.08Å; Y152-P154 WeakPolarHBondContact O-CD 3.44Å
155	R	90.7	Very high	92	Very high	101 Å²	101	61.9 Å²	61.9	38%	0.381	31%	0.314	S	S	.	.			trans	-130.4	165.3	176.6	-58.2	-170.2	-175.5	166.9	14.5	110.4	D133 E157 V158	D133-R155 IonicContact OD1-CZ 3.67Å; D133-R155 IonicContact OD1-NH1 3.71Å; D133-R155 PolarHBondContact OD1-NH1 3.49Å; D133-R155 IonicContact OD1-NH2 2.69Å; D133-R155 PolarHBondContact OD1-NH2 3.4Å; R155-E157 VanDerWaalsContact C-N 3.32Å; R155-E157 WeakPolarHBondContact CB-OE2 3.31Å; R155-V158 HydrophobicContact CB-CG2 4.37Å; R155-V158 PolarHBondContact O-N 3.36Å
156	K	89.4	Confident	92	Very high	82 Å²	82	61.8 Å²	61.8	36%	0.357	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-28.3	179.2	68.7	-177.1	-165.7	171.1	0	112.8	D89 E90 Y92 V158	D89-K156 VanDerWaalsContact CG-NZ 3.28Å; D89-K156 IonicContact OD1-NZ 3.98Å; D89-K156 PolarHBondContact OD1-NZ 3.48Å; D89-K156 IonicContact OD2-NZ 2.79Å; D89-K156 PolarHBondContact OD2-NZ 3.28Å; D89-K156 VanDerWaalsContact OD2-NZ 3.1Å; E90-K156 WeakPolarHBondContact O-CD 3.38Å; Y92-K156 HydrophobicContact CD2-CB 3.96Å; Y92-K156 VanDerWaalsContact CE2-CA 3.45Å; Y92-K156 HydrophobicContact CE2-CB 3.68Å; K156-V158 VanDerWaalsContact C-N 3.26Å; K156-V158 PolarHBondContact O-N 3.31Å
157	E	91.9	Very high	91.9	Very high	42 Å²	42	62.5 Å²	62.5	20%	0.196	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-5.3	-179.2	-52.9	81.7	-175.8	0	0	112.7	A127 V128 F131 R155	A127-E157 CarbonylContact C-O 3.59Å; A127-E157 WeakPolarHBondContact CA-O 3.43Å; V128-E157 PolarHBondContact N-O 3.11Å; F131-E157 HydrophobicContact CB-CB 4.1Å; F131-E157 HydrophobicContact CB-CG 3.91Å; F131-E157 HydrophobicContact CD1-CB 3.62Å; F131-E157 HydrophobicContact CD1-CG 4.39Å; F131-E157 HydrophobicContact CD2-CB 4.32Å; F131-E157 HydrophobicContact CE1-CB 4.08Å; F131-E157 HydrophobicContact CG-CB 3.76Å; F131-E157 HydrophobicContact CG-CG 4.07Å; R155-E157 VanDerWaalsContact C-N 3.32Å; R155-E157 WeakPolarHBondContact CB-OE2 3.31Å
158	V	93.4	Very high	91.9	Very high	11 Å²	11	62.6 Å²	62.6	7%	0.067	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	122.8	-169.5	-167.5	0	0	0	0	112.8	L125 R126 F131 W144 Y152 R155 K156	L125-V158 HydrophobicContact CB-CG1 3.79Å; L125-V158 HydrophobicContact CD1-CG1 4.29Å; L125-V158 HydrophobicContact CD2-CG1 4.2Å; L125-V158 HydrophobicContact CG-CG1 4.31Å; R126-V158 WeakPolarHBondContact O-CA 3.42Å; F131-V158 HydrophobicContact CE1-CG2 3.65Å; F131-V158 HydrophobicContact CE2-CG2 4.16Å; F131-V158 HydrophobicContact CZ-CG2 3.34Å; W144-V158 HydrophobicContact CH2-CB 4.4Å; W144-V158 HydrophobicContact CH2-CG1 3.66Å; W144-V158 HydrophobicContact CH2-CG2 3.85Å; W144-V158 HydrophobicContact CZ2-CG1 3.79Å; W144-V158 HydrophobicContact CZ2-CG2 4.1Å; Y152-V158 WeakPolarHBondContact OH-CB 3.48Å; Y152-V158 VanDerWaalsContact OH-CG1 3.26Å; Y152-V158 WeakPolarHBondContact OH-CG1 3.23Å; R155-V158 HydrophobicContact CB-CG2 4.37Å; R155-V158 PolarHBondContact O-N 3.36Å; K156-V158 VanDerWaalsContact C-N 3.26Å; K156-V158 PolarHBondContact O-N 3.31Å
159	E	93.1	Very high	91.9	Very high	83 Å²	83	61.8 Å²	61.8	39%	0.388	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.8	173.8	-175.6	-175	-172.3	0	0	110.7	L125 R126 V128	L125-E159 CarbonylContact C-O 3.51Å; L125-E159 WeakPolarHBondContact CA-O 3.22Å; R126-E159 HydrophobicContact CB-CB 4.46Å; R126-E159 IonicContact CZ-OE2 2.63Å; R126-E159 PolarHBondContact N-O 3.11Å; R126-E159 IonicContact NE-OE2 2.76Å; R126-E159 PolarHBondContact NE-OE2 2.7Å; R126-E159 IonicContact NH2-OE1 2.76Å; R126-E159 PolarHBondContact NH2-OE1 3.02Å; R126-E159 VanDerWaalsContact NH2-OE1 3.16Å; R126-E159 IonicContact NH2-OE2 3.1Å; R126-E159 PolarHBondContact NH2-OE2 3.46Å; R126-E159 PolarHBondContact O-N 3.13Å; V128-E159 HydrophobicContact CG2-CB 3.75Å
160	I	92	Very high	91.9	Very high	65 Å²	65	62.4 Å²	62.4	33%	0.333	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	110.1	170.4	-56.1	172.2	0	0	0	107.9	P115 L123 L125 Y152	P115-I160 HydrophobicContact CG-CD1 3.91Å; L123-I160 HydrophobicContact CD2-CG2 3.94Å; L125-I160 HydrophobicContact CD2-CB 4.34Å; L125-I160 HydrophobicContact CD2-CG1 3.8Å; Y152-I160 HydrophobicContact CD1-CD1 3.87Å; Y152-I160 HydrophobicContact CD1-CG1 4.26Å; Y152-I160 HydrophobicContact CE1-CD1 3.83Å; Y152-I160 HydrophobicContact CE1-CG1 3.82Å
161	V	91.6	Very high	91.7	Very high	52 Å²	52	66.4 Å²	66.4	32%	0.315	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-52.9	-175.2	-175.1	0	0	0	0	111.5	R124 R126	R124-V161 HydrophobicContact CB-CB 4.43Å; R124-V161 HydrophobicContact CG-CB 4.32Å; R124-V161 WeakPolarHBondContact O-CB 3.44Å; R124-V161 PolarHBondContact O-N 3.4Å; R126-V161 HydrophobicContact CB-CG2 3.56Å
162	K	91.8	Very high	91.5	Very high	98 Å²	98	68 Å²	68	43%	0.426	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	170	177.7	56.7	168.7	172.3	144.1	0	112.3	R124 E164	R124-K162 HydrophobicContact CB-CG 4.05Å; R124-K162 PolarHBondContact N-O 3.27Å; K162-E164 VanDerWaalsContact CE-CD 3.44Å; K162-E164 WeakPolarHBondContact CE-OE1 3.41Å; K162-E164 WeakPolarHBondContact CE-OE2 3.46Å; K162-E164 IonicContact NZ-OE1 2.94Å; K162-E164 PolarHBondContact NZ-OE1 3.34Å; K162-E164 IonicContact NZ-OE2 3.8Å; K162-E164 PolarHBondContact NZ-OE2 3.18Å
163	C	91.1	Very high	91.5	Very high	73 Å²	73	68.2 Å²	68.2	49%	0.493	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129.7	166.6	-171.2	0	0	0	0	109.5	A122 L123	A122-C163 CarbonylContact O-C 3.59Å; A122-C163 WeakPolarHBondContact O-CA 3.35Å; L123-C163 HydrophobicContact CD2-CB 4.22Å
164	E	91	Very high	91.4	Very high	34 Å²	34	62.9 Å²	62.9	16%	0.159	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	144.7	174	-55.4	-76.9	-155.5	0	0	109.1	S121 A122 R124 L145 K162 L206	S121-E164 CarbonylContact C-O 3.53Å; S121-E164 VanDerWaalsContact CA-O 3.23Å; S121-E164 WeakPolarHBondContact CA-O 3.45Å; S121-E164 VanDerWaalsContact CB-O 3.26Å; S121-E164 WeakPolarHBondContact CB-O 3.39Å; A122-E164 PolarHBondContact N-O 3.15Å; A122-E164 PolarHBondContact O-N 3.5Å; R124-E164 HydrophobicContact CB-CG 4.25Å; R124-E164 IonicContact NH1-OE1 3.06Å; R124-E164 PolarHBondContact NH1-OE1 3.39Å; R124-E164 VanDerWaalsContact NH1-OE1 3.13Å; L145-E164 HydrophobicContact CD2-CG 4.06Å; K162-E164 VanDerWaalsContact CE-CD 3.44Å; K162-E164 WeakPolarHBondContact CE-OE1 3.41Å; K162-E164 WeakPolarHBondContact CE-OE2 3.46Å; K162-E164 IonicContact NZ-OE1 2.94Å; K162-E164 PolarHBondContact NZ-OE1 3.34Å; K162-E164 IonicContact NZ-OE2 3.8Å; K162-E164 PolarHBondContact NZ-OE2 3.18Å; E164-L206 HydrophobicContact CB-CD1 4.26Å
165	Q	92.2	Very high	91.4	Very high	155 Å²	155	62.8 Å²	62.8	72%	0.724	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	146.3	175.7	-67.7	-175.9	-2.8	0	0	110.6
166	A	92.5	Very high	91.5	Very high	24 Å²	24	58.2 Å²	58.2	20%	0.198	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-70.7	141.9	176.6	0	0	0	0	0	112.1	N120 A204 Y205 L206	N120-A166 HydrophobicContact CB-CB 3.87Å; N120-A166 WeakPolarHBondContact O-CB 3.43Å; N120-A166 PolarHBondContact O-N 2.83Å; A166-A204 HydrophobicContact CB-CB 3.95Å; A166-Y205 CarbonylContact C-O 3.52Å; A166-Y205 VanDerWaalsContact CA-O 3.31Å; A166-Y205 WeakPolarHBondContact CA-O 3.33Å; A166-L206 HydrophobicContact CB-CB 3.93Å; A166-L206 HydrophobicContact CB-CD1 4.26Å
167	K	91.3	Very high	91.7	Very high	75 Å²	75	54.3 Å²	54.3	33%	0.326	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.5	172.6	-175.9	70.2	178.6	-162.1	0	109.3	L175 Y205 I213 E216	K167-L175 HydrophobicContact CB-CD1 3.97Å; K167-L175 HydrophobicContact CG-CD1 3.85Å; K167-L175 HydrophobicContact CG-CD2 4.03Å; K167-Y205 PolarHBondContact N-O 3.26Å; K167-Y205 PolarHBondContact O-N 3.27Å; K167-I213 HydrophobicContact CB-CD1 3.81Å; K167-I213 HydrophobicContact CG-CD1 4.11Å; K167-E216 WeakPolarHBondContact CE-OE1 3.48Å; K167-E216 IonicContact NZ-OE1 2.73Å; K167-E216 PolarHBondContact NZ-OE1 3.38Å; K167-E216 IonicContact NZ-OE2 2.75Å
168	V	91.3	Very high	91.8	Very high	93 Å²	93	54.4 Å²	54.4	56%	0.564	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.7	178.2	-178.9	0	0	0	0	110.2	L170 G203	V168-L170 HydrophobicContact CG1-CD2 4.25Å; V168-G203 WeakPolarHBondContact CA-O 3.43Å
169	I	91.7	Very high	91.8	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.015	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121	170.9	-47.9	-172.1	0	0	0	107.9	S173 L175 V199 P202 G203 Y205	I169-S173 WeakPolarHBondContact CG2-O 3.23Å; I169-L175 HydrophobicContact CD1-CB 4.41Å; I169-L175 HydrophobicContact CD1-CD1 3.77Å; I169-L175 HydrophobicContact CD1-CG 3.76Å; I169-L175 HydrophobicContact CG1-CD1 3.81Å; I169-L175 HydrophobicContact CG1-CG 3.84Å; I169-V199 HydrophobicContact CD1-CB 4.21Å; I169-V199 HydrophobicContact CD1-CG1 3.64Å; I169-P202 WeakPolarHBondContact O-CA 3.36Å; I169-G203 PolarHBondContact N-O 3.06Å; I169-G203 PolarHBondContact O-N 3.39Å; I169-Y205 HydrophobicContact CD1-CG 4.24Å
170	L	90.8	Very high	91.7	Very high	118 Å²	118	52.1 Å²	52.1	62%	0.618	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-84.3	160.4	175.8	-59.5	176.8	0	0	0	110.7	V168 N172 S173	V168-L170 HydrophobicContact CG1-CD2 4.25Å; L170-N172 PolarHBondContact O-N 3.42Å; L170-S173 WeakPolarHBondContact CA-OG 3.47Å; L170-S173 PolarHBondContact N-OG 3.48Å; L170-S173 PolarHBondContact O-N 3.43Å; L170-S173 VanDerWaalsContact O-N 3.1Å; L170-S173 PolarHBondContact O-OG 3.14Å
171	V	89.1	Confident	91.6	Very high	109 Å²	109	54.4 Å²	54.4	66%	0.661	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	140.2	167.1	-176.7	0	0	0	0	109.3	S173 P202	V171-S173 PolarHBondContact O-N 3.01Å; V171-P202 HydrophobicContact CG2-CB 4.28Å; V171-P202 HydrophobicContact CG2-CG 4.28Å
172	N	88.6	Confident	91.6	Very high	73 Å²	73	57.1 Å²	57.1	39%	0.39	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	26.3	-176.2	-60.7	-11.6	0	0	0	114.3	L170 A219	L170-N172 PolarHBondContact O-N 3.42Å; N172-A219 HydrophobicContact CB-CB 3.85Å; N172-A219 WeakPolarHBondContact O-CB 3.46Å; N172-A219 PolarHBondContact O-N 2.92Å
173	S	92.1	Very high	91.5	Very high	22 Å²	22	53.5 Å²	53.5	15%	0.154	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	165.6	168.1	73.7	0	0	0	0	111.3	I169 L170 V171 R217	I169-S173 WeakPolarHBondContact CG2-O 3.23Å; L170-S173 WeakPolarHBondContact CA-OG 3.47Å; L170-S173 PolarHBondContact N-OG 3.48Å; L170-S173 PolarHBondContact O-N 3.43Å; L170-S173 VanDerWaalsContact O-N 3.1Å; L170-S173 PolarHBondContact O-OG 3.14Å; V171-S173 PolarHBondContact O-N 3.01Å; S173-R217 CarbonylContact C-O 3.56Å; S173-R217 WeakPolarHBondContact CA-O 3.29Å; S173-R217 WeakPolarHBondContact CB-O 3.31Å
174	A	92	Very high	91.4	Very high	2 Å²	2	54.8 Å²	54.8	2%	0.017	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	152.5	-177.6	0	0	0	0	0	111.6	L198 V199 T200 R217 I261	A174-L198 HydrophobicContact CB-CD1 3.66Å; A174-L198 HydrophobicContact CB-CD2 4Å; A174-L198 HydrophobicContact CB-CG 3.69Å; A174-V199 CarbonylContact C-O 3.5Å; A174-V199 WeakPolarHBondContact CA-O 3.34Å; A174-V199 VanDerWaalsContact CB-O 3.3Å; A174-V199 WeakPolarHBondContact CB-O 3.47Å; A174-T200 HydrophobicContact CB-CG2 3.89Å; A174-R217 PolarHBondContact N-O 3.11Å; A174-R217 PolarHBondContact O-N 3.15Å; A174-I261 HydrophobicContact CB-CD1 4.37Å; A174-I261 HydrophobicContact CB-CG2 4.08Å
175	L	93	Very high	91.3	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.021	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.8	171.5	-57.5	179.2	0	0	0	109.7	K167 I169 M177 L198 V199 Y205 I213 E216	K167-L175 HydrophobicContact CB-CD1 3.97Å; K167-L175 HydrophobicContact CG-CD1 3.85Å; K167-L175 HydrophobicContact CG-CD2 4.03Å; I169-L175 HydrophobicContact CD1-CB 4.41Å; I169-L175 HydrophobicContact CD1-CD1 3.77Å; I169-L175 HydrophobicContact CD1-CG 3.76Å; I169-L175 HydrophobicContact CG1-CD1 3.81Å; I169-L175 HydrophobicContact CG1-CG 3.84Å; L175-M177 HydrophobicContact CB-SD 3.86Å; L175-M177 HydrophobicContact CD1-SD 4.42Å; L175-L198 WeakPolarHBondContact O-CA 3.44Å; L175-V199 PolarHBondContact N-O 3.03Å; L175-V199 PolarHBondContact O-N 3.48Å; L175-Y205 HydrophobicContact CD1-CD1 4.39Å; L175-I213 HydrophobicContact CD1-CD1 4.12Å; L175-I213 HydrophobicContact CD1-CG1 4.37Å; L175-I213 HydrophobicContact CD2-CG2 4.28Å; L175-E216 HydrophobicContact CD2-CG 3.79Å
176	V	92.6	Very high	91	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.024	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	117	164	-175.7	0	0	0	0	107.4	R196 W197 L198 V214 D215 R217 A264	V176-R196 HydrophobicContact CG1-CB 4.36Å; V176-W197 WeakPolarHBondContact CA-O 3.18Å; V176-L198 HydrophobicContact CG2-CD1 3.86Å; V176-V214 PolarHBondContact O-N 3.34Å; V176-D215 HydrophobicContact CB-CB 3.91Å; V176-D215 HydrophobicContact CG2-CB 3.89Å; V176-D215 PolarHBondContact N-O 2.91Å; V176-R217 HydrophobicContact CG2-CG 3.9Å; V176-A264 HydrophobicContact CG1-CB 4.15Å
177	M	93	Very high	90.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	151.6	177.4	-54.7	-55	-64.5	0	0	109.9	L175 R196 W197 V199 Y205 P207 E211 Q212 I213	L175-M177 HydrophobicContact CB-SD 3.86Å; L175-M177 HydrophobicContact CD1-SD 4.42Å; M177-R196 WeakPolarHBondContact O-CA 3.45Å; M177-W197 HydrophobicContact CB-CD2 3.82Å; M177-W197 VanDerWaalsContact CB-CE2 3.48Å; M177-W197 HydrophobicContact CB-CE3 4.16Å; M177-W197 HydrophobicContact CB-CG 4.45Å; M177-W197 HydrophobicContact CB-CH2 3.88Å; M177-W197 HydrophobicContact CB-CZ2 3.52Å; M177-W197 HydrophobicContact CB-CZ3 4.18Å; M177-W197 HydrophobicContact CG-CZ2 4.18Å; M177-W197 PolarHBondContact N-O 3.41Å; M177-W197 PolarHBondContact O-N 3.15Å; M177-W197 VanDerWaalsContact O-N 3.09Å; M177-V199 HydrophobicContact CG-CG2 3.62Å; M177-Y205 HydrophobicContact CE-CE1 3.99Å; M177-Y205 HydrophobicContact SD-CE1 4.24Å; M177-P207 HydrophobicContact CE-CB 4.07Å; M177-P207 HydrophobicContact CE-CG 4.34Å; M177-E211 HydrophobicContact CE-CB 3.62Å; M177-Q212 CarbonylContact C-O 3.51Å; M177-Q212 VanDerWaalsContact CA-O 3.3Å; M177-Q212 WeakPolarHBondContact CA-O 3.33Å; M177-I213 HydrophobicContact CE-CG1 3.8Å; M177-I213 HydrophobicContact SD-CB 4.43Å; M177-I213 HydrophobicContact SD-CG1 3.79Å
178	E	94.2	Very high	90.3	Very high	44 Å²	44	53.3 Å²	53.3	21%	0.206	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	137.1	170.1	-174.3	170.1	161.2	0	0	110.8	T180 E195 R196 Q212 V214	E178-T180 PolarHBondContact O-N 3.14Å; E178-E195 WeakPolarHBondContact CA-O 3.29Å; E178-R196 HydrophobicContact CB-CG 3.94Å; E178-R196 HydrophobicContact CG-CG 3.96Å; E178-R196 IonicContact OE2-CZ 2.89Å; E178-R196 IonicContact OE2-NE 3.29Å; E178-R196 PolarHBondContact OE2-NE 3.31Å; E178-R196 IonicContact OE2-NH2 3.2Å; E178-R196 PolarHBondContact OE2-NH2 3.13Å; E178-Q212 PolarHBondContact N-O 3Å; E178-Q212 PolarHBondContact O-N 3.06Å; E178-V214 HydrophobicContact CB-CG2 3.47Å; E178-V214 VanDerWaalsContact CB-CG2 3.47Å
179	A	93.6	Very high	90.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	111.2	178.2	0	0	0	0	0	110.8	K181 R191 V192 Y193 G194 E195 W197	A179-K181 VanDerWaalsContact C-N 3.31Å; A179-R191 HydrophobicContact CB-CB 3.93Å; A179-V192 VanDerWaalsContact CB-O 3.29Å; A179-V192 WeakPolarHBondContact CB-O 3.36Å; A179-Y193 WeakPolarHBondContact O-CA 3.32Å; A179-G194 PolarHBondContact O-N 3.4Å; A179-E195 PolarHBondContact N-O 3.12Å; A179-W197 HydrophobicContact CB-CH2 4.25Å; A179-W197 HydrophobicContact CB-CZ3 3.78Å
180	T	91.2	Very high	90.4	Very high	46 Å²	46	56.1 Å²	56.1	28%	0.282	32%	0.324	S	S	.	.	S	Bend	trans	-81.1	-9.5	177.9	60	0	0	0	0	113.9	E178 Y193 Y210 Q212	E178-T180 PolarHBondContact O-N 3.14Å; T180-Y193 VanDerWaalsContact C-CD2 3.43Å; T180-Y193 WeakPolarHBondContact O-CD2 3.47Å; T180-Y193 WeakPolarHBondContact O-CE2 3.39Å; T180-Y210 PolarHBondContact N-O 3.44Å; T180-Y210 VanDerWaalsContact OG1-C 3.29Å; T180-Y210 WeakPolarHBondContact OG1-CA 3.36Å; T180-Y210 PolarHBondContact OG1-O 2.97Å; T180-Q212 HydrophobicContact CG2-CB 3.69Å
181	K	90.1	Very high	90.5	Very high	113 Å²	113	52.4 Å²	52.4	49%	0.491	30%	0.302	S	S	.	.	S	Bend	trans	-154	166.7	162.2	-68.9	-167.2	-174.8	172.2	0	108.1	A179 C183 Y210	A179-K181 VanDerWaalsContact C-N 3.31Å; K181-C183 PolarHBondContact O-N 3.2Å; K181-Y210 HydrophobicContact CB-CD1 3.93Å; K181-Y210 HydrophobicContact CB-CD2 4.4Å; K181-Y210 HydrophobicContact CB-CE1 4.42Å; K181-Y210 HydrophobicContact CB-CG 3.93Å; K181-Y210 HydrophobicContact CD-CD1 4Å; K181-Y210 HydrophobicContact CD-CE1 3.71Å; K181-Y210 HydrophobicContact CG-CD1 3.95Å; K181-Y210 HydrophobicContact CG-CE1 4.2Å; K181-Y210 HydrophobicContact CG-CG 4.47Å
182	D	90.8	Very high	90.7	Very high	109 Å²	109	51.4 Å²	51.4	58%	0.583	30%	0.296	S	S	*	.	S	Bend	trans	-55	123.9	167.7	-63	-2.3	0	0	0	109.7	R191 V192 Y193	D182-R191 WeakPolarHBondContact CA-O 3.27Å; D182-V192 WeakPolarHBondContact OD1-CA 3.37Å; D182-Y193 PolarHBondContact OD1-N 2.95Å
183	C	89.1	Confident	90.9	Very high	23 Å²	23	55.9 Å²	55.9	16%	0.155	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	175.1	-173.3	68.9	0	0	0	0	111.5	K181 P190 R191 Y210	K181-C183 PolarHBondContact O-N 3.2Å; C183-P190 CarbonylContact O-C 3.54Å; C183-P190 WeakPolarHBondContact O-CA 3.44Å; C183-R191 PolarHBondContact N-O 3.43Å; C183-R191 PolarHBondContact O-N 3.37Å; C183-Y210 HydrophobicContact CB-CD2 3.98Å; C183-Y210 HydrophobicContact CB-CG 4.43Å
184	V	90.3	Very high	90.7	Very high	99 Å²	99	56.4 Å²	56.4	60%	0.6	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.1	166.9	-177.2	0	0	0	0	106.8	G188 V189	V184-G188 VanDerWaalsContact CG1-C 3.48Å; V184-V189 WeakPolarHBondContact CA-O 3.41Å
185	D	89.1	Confident	90.7	Very high	8 Å²	8	59.2 Å²	59.2	4%	0.043	33%	0.33	C	S	.	.			trans	-73.8	168.7	179.6	75.2	19.1	0	0	0	112.1	S187 G188 V189 R191 W197 E211	D185-S187 VanDerWaalsContact CG-OG 3.3Å; D185-S187 PolarHBondContact O-N 2.98Å; D185-S187 VanDerWaalsContact OD1-CA 3.28Å; D185-S187 WeakPolarHBondContact OD1-CA 3.36Å; D185-S187 WeakPolarHBondContact OD1-CB 3.14Å; D185-S187 PolarHBondContact OD1-N 3.16Å; D185-S187 PolarHBondContact OD1-OG 2.8Å; D185-S187 PolarHBondContact OD2-OG 3.47Å; D185-G188 PolarHBondContact O-N 3.49Å; D185-G188 PolarHBondContact OD1-N 3.04Å; D185-V189 PolarHBondContact N-O 3.22Å; D185-V189 PolarHBondContact OD1-N 3.43Å; D185-R191 HydrophobicContact CB-CG 4.05Å; D185-R191 IonicContact OD2-CZ 3.58Å; D185-R191 IonicContact OD2-NE 2.68Å; D185-R191 PolarHBondContact OD2-NE 3.28Å; D185-R191 IonicContact OD2-NH2 2.92Å; D185-R191 PolarHBondContact OD2-NH2 2.93Å; D185-W197 HydrophobicContact CB-CZ2 3.71Å; D185-W197 PolarHBondContact OD2-NE1 3.3Å; D185-E211 VanDerWaalsContact CA-OE1 3.23Å; D185-E211 WeakPolarHBondContact CA-OE1 3.46Å; D185-E211 WeakPolarHBondContact CB-OE1 3.19Å
186	R	85.1	Confident	90.6	Very high	105 Å²	105	64.9 Å²	64.9	40%	0.396	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-14.8	177	-74.3	-150.9	-175.7	-98.8	-11.7	116	E147 G188 Y205 L206 E211	E147-R186 IonicContact OE1-CZ 3.69Å; E147-R186 VanDerWaalsContact OE1-CZ 3.3Å; E147-R186 IonicContact OE1-NH1 3.93Å; E147-R186 PolarHBondContact OE1-NH1 3.28Å; E147-R186 IonicContact OE1-NH2 2.78Å; E147-R186 PolarHBondContact OE1-NH2 3.4Å; E147-R186 IonicContact OE2-CZ 2.69Å; E147-R186 IonicContact OE2-NH1 3.75Å; E147-R186 PolarHBondContact OE2-NH1 2.86Å; E147-R186 IonicContact OE2-NH2 3.22Å; R186-G188 VanDerWaalsContact C-N 3.34Å; R186-Y205 HydrophobicContact CB-CE2 3.92Å; R186-Y205 HydrophobicContact CG-CE2 4.2Å; R186-L206 VanDerWaalsContact CZ-O 3.27Å; R186-L206 PolarHBondContact NE-O 2.92Å; R186-L206 PolarHBondContact NH2-O 2.91Å; R186-E211 PolarHBondContact N-OE1 2.96Å
187	S	84.1	Confident	90.6	Very high	91 Å²	91	65.4 Å²	65.4	64%	0.636	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-1.3	173.8	70.4	0	0	0	0	113.5	D185 V189	D185-S187 VanDerWaalsContact CG-OG 3.3Å; D185-S187 PolarHBondContact O-N 2.98Å; D185-S187 VanDerWaalsContact OD1-CA 3.28Å; D185-S187 WeakPolarHBondContact OD1-CA 3.36Å; D185-S187 WeakPolarHBondContact OD1-CB 3.14Å; D185-S187 PolarHBondContact OD1-N 3.16Å; D185-S187 PolarHBondContact OD1-OG 2.8Å; D185-S187 PolarHBondContact OD2-OG 3.47Å; S187-V189 WeakPolarHBondContact OG-CG2 3.13Å
188	G	85.7	Confident	90.5	Very high	53 Å²	53	67.3 Å²	67.3	55%	0.546	36%	0.363	S	S	.	.	S	Bend	trans	86.2	9.9	-178.3	0	0	0	0	0	113.8	V184 D185 R186	V184-G188 VanDerWaalsContact CG1-C 3.48Å; D185-G188 PolarHBondContact O-N 3.49Å; D185-G188 PolarHBondContact OD1-N 3.04Å; R186-G188 VanDerWaalsContact C-N 3.34Å
189	V	89.8	Confident	90.4	Very high	57 Å²	57	65.9 Å²	65.9	35%	0.345	36%	0.357	S	S	.	.			trans	-89.4	127.6	-178.6	179.9	0	0	0	0	109.5	V184 D185 S187 R191	V184-V189 WeakPolarHBondContact CA-O 3.41Å; D185-V189 PolarHBondContact N-O 3.22Å; D185-V189 PolarHBondContact OD1-N 3.43Å; S187-V189 WeakPolarHBondContact OG-CG2 3.13Å; V189-R191 PolarHBondContact O-N 3.35Å
190	P	94.2	Very high	90.1	Very high	98 Å²	98	69.4 Å²	69.4	64%	0.636	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	131	172.1	28.8	-33.6	0	0	0	110.1	C183	C183-P190 CarbonylContact O-C 3.54Å; C183-P190 WeakPolarHBondContact O-CA 3.44Å
191	R	93.3	Very high	90	Very high	40 Å²	40	72 Å²	72	15%	0.151	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141.7	179.6	-57.9	-62.8	179.9	-174.3	-4.4	110.1	A179 D182 C183 D185 V189 E195 W197	A179-R191 HydrophobicContact CB-CB 3.93Å; D182-R191 WeakPolarHBondContact CA-O 3.27Å; C183-R191 PolarHBondContact N-O 3.43Å; C183-R191 PolarHBondContact O-N 3.37Å; D185-R191 HydrophobicContact CB-CG 4.05Å; D185-R191 IonicContact OD2-CZ 3.58Å; D185-R191 IonicContact OD2-NE 2.68Å; D185-R191 PolarHBondContact OD2-NE 3.28Å; D185-R191 IonicContact OD2-NH2 2.92Å; D185-R191 PolarHBondContact OD2-NH2 2.93Å; V189-R191 PolarHBondContact O-N 3.35Å; R191-E195 WeakPolarHBondContact CA-OE2 3.48Å; R191-E195 WeakPolarHBondContact CD-OE1 3.46Å; R191-E195 IonicContact CZ-OE1 2.71Å; R191-E195 IonicContact NE-OE1 3.18Å; R191-E195 IonicContact NH1-OE1 3.16Å; R191-E195 PolarHBondContact NH1-OE1 3.37Å; R191-W197 HydrophobicContact CB-CH2 4.43Å; R191-W197 HydrophobicContact CB-CZ3 4.1Å; R191-W197 HydrophobicContact CG-CD2 4.28Å; R191-W197 HydrophobicContact CG-CE3 3.93Å; R191-W197 HydrophobicContact CG-CH2 3.92Å; R191-W197 HydrophobicContact CG-CZ2 4.25Å; R191-W197 HydrophobicContact CG-CZ3 3.75Å
192	V	92.6	Very high	90	Very high	89 Å²	89	70.3 Å²	70.3	54%	0.539	40%	0.395	S	S	.	.			trans	-98.4	152	177	-176	0	0	0	0	110.4	A179 D182 G194 E195	A179-V192 VanDerWaalsContact CB-O 3.29Å; A179-V192 WeakPolarHBondContact CB-O 3.36Å; D182-V192 WeakPolarHBondContact OD1-CA 3.37Å; V192-G194 PolarHBondContact O-N 3.17Å; V192-E195 PolarHBondContact N-OE2 3.44Å; V192-E195 WeakPolarHBondContact O-CB 3.42Å; V192-E195 PolarHBondContact O-N 3.49Å
193	Y	92.2	Very high	90	Very high	167 Å²	167	66.8 Å²	66.8	66%	0.655	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46	127.8	174.6	-179.6	-111.1	0	0	0	113.8	A179 T180 D182 E195	A179-Y193 WeakPolarHBondContact O-CA 3.32Å; T180-Y193 VanDerWaalsContact C-CD2 3.43Å; T180-Y193 WeakPolarHBondContact O-CD2 3.47Å; T180-Y193 WeakPolarHBondContact O-CE2 3.39Å; D182-Y193 PolarHBondContact OD1-N 2.95Å; Y193-E195 PolarHBondContact O-N 3.04Å
194	G	88.7	Confident	90.1	Very high	33 Å²	33	67.9 Å²	67.9	34%	0.34	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	0.9	-177.3	0	0	0	0	0	114.9	A179 V192	A179-G194 PolarHBondContact O-N 3.4Å; V192-G194 PolarHBondContact O-N 3.17Å
195	E	91.7	Very high	90.1	Very high	61 Å²	61	64.3 Å²	64.3	29%	0.285	37%	0.371	S	S	.	.			trans	-67.4	134.3	172	-171.1	-176	151.4	0	0	110.2	E178 A179 R191 V192 Y193	E178-E195 WeakPolarHBondContact CA-O 3.29Å; A179-E195 PolarHBondContact N-O 3.12Å; R191-E195 WeakPolarHBondContact CA-OE2 3.48Å; R191-E195 WeakPolarHBondContact CD-OE1 3.46Å; R191-E195 IonicContact CZ-OE1 2.71Å; R191-E195 IonicContact NE-OE1 3.18Å; R191-E195 IonicContact NH1-OE1 3.16Å; R191-E195 PolarHBondContact NH1-OE1 3.37Å; V192-E195 PolarHBondContact N-OE2 3.44Å; V192-E195 WeakPolarHBondContact O-CB 3.42Å; V192-E195 PolarHBondContact O-N 3.49Å; Y193-E195 PolarHBondContact O-N 3.04Å
196	R	91.8	Very high	90.2	Very high	123 Å²	123	64.5 Å²	64.5	46%	0.464	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.7	174.5	-66.8	-175	178.1	167.3	1	111.5	V176 M177 E178 A264	V176-R196 HydrophobicContact CG1-CB 4.36Å; M177-R196 WeakPolarHBondContact O-CA 3.45Å; E178-R196 HydrophobicContact CB-CG 3.94Å; E178-R196 HydrophobicContact CG-CG 3.96Å; E178-R196 IonicContact OE2-CZ 2.89Å; E178-R196 IonicContact OE2-NE 3.29Å; E178-R196 PolarHBondContact OE2-NE 3.31Å; E178-R196 IonicContact OE2-NH2 3.2Å; E178-R196 PolarHBondContact OE2-NH2 3.13Å; R196-A264 HydrophobicContact CB-CB 3.85Å
197	W	91.4	Very high	90.5	Very high	15 Å²	15	60.5 Å²	60.5	6%	0.057	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	171.2	175.7	70.5	101.6	0	0	0	111.3	V176 M177 A179 D185 R191 E211	V176-W197 WeakPolarHBondContact CA-O 3.18Å; M177-W197 HydrophobicContact CB-CD2 3.82Å; M177-W197 VanDerWaalsContact CB-CE2 3.48Å; M177-W197 HydrophobicContact CB-CE3 4.16Å; M177-W197 HydrophobicContact CB-CG 4.45Å; M177-W197 HydrophobicContact CB-CH2 3.88Å; M177-W197 HydrophobicContact CB-CZ2 3.52Å; M177-W197 HydrophobicContact CB-CZ3 4.18Å; M177-W197 HydrophobicContact CG-CZ2 4.18Å; M177-W197 PolarHBondContact N-O 3.41Å; M177-W197 PolarHBondContact O-N 3.15Å; M177-W197 VanDerWaalsContact O-N 3.09Å; A179-W197 HydrophobicContact CB-CH2 4.25Å; A179-W197 HydrophobicContact CB-CZ3 3.78Å; D185-W197 HydrophobicContact CB-CZ2 3.71Å; D185-W197 PolarHBondContact OD2-NE1 3.3Å; R191-W197 HydrophobicContact CB-CH2 4.43Å; R191-W197 HydrophobicContact CB-CZ3 4.1Å; R191-W197 HydrophobicContact CG-CD2 4.28Å; R191-W197 HydrophobicContact CG-CE3 3.93Å; R191-W197 HydrophobicContact CG-CH2 3.92Å; R191-W197 HydrophobicContact CG-CZ2 4.25Å; R191-W197 HydrophobicContact CG-CZ3 3.75Å; W197-E211 HydrophobicContact CH2-CB 4.42Å; W197-E211 HydrophobicContact CH2-CG 4.06Å; W197-E211 HydrophobicContact CZ2-CB 4.46Å; W197-E211 HydrophobicContact CZ2-CG 3.95Å
198	L	91.8	Very high	90.8	Very high	39 Å²	39	57 Å²	57	20%	0.204	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.3	-176.9	-165	76.2	0	0	0	109.9	A174 L175 V176 T200 I261	A174-L198 HydrophobicContact CB-CD1 3.66Å; A174-L198 HydrophobicContact CB-CD2 4Å; A174-L198 HydrophobicContact CB-CG 3.69Å; L175-L198 WeakPolarHBondContact O-CA 3.44Å; V176-L198 HydrophobicContact CG2-CD1 3.86Å; L198-T200 HydrophobicContact CD2-CG2 3.65Å; L198-T200 HydrophobicContact CG-CG2 4.02Å; L198-I261 HydrophobicContact CD2-CB 4.38Å; L198-I261 HydrophobicContact CD2-CG2 3.81Å
199	V	91.4	Very high	91	Very high	14 Å²	14	55.4 Å²	55.4	9%	0.085	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	111.1	172.9	-179.4	0	0	0	0	108.5	I169 A174 L175 M177 Y205	I169-V199 HydrophobicContact CD1-CB 4.21Å; I169-V199 HydrophobicContact CD1-CG1 3.64Å; A174-V199 CarbonylContact C-O 3.5Å; A174-V199 WeakPolarHBondContact CA-O 3.34Å; A174-V199 VanDerWaalsContact CB-O 3.3Å; A174-V199 WeakPolarHBondContact CB-O 3.47Å; L175-V199 PolarHBondContact N-O 3.03Å; L175-V199 PolarHBondContact O-N 3.48Å; M177-V199 HydrophobicContact CG-CG2 3.62Å; V199-Y205 HydrophobicContact CG1-CD2 3.69Å; V199-Y205 HydrophobicContact CG1-CE2 3.67Å; V199-Y205 HydrophobicContact CG1-CG 4.22Å; V199-Y205 HydrophobicContact CG2-CE1 4.46Å; V199-Y205 HydrophobicContact CG2-CE2 4.23Å
200	T	87.6	Confident	91.1	Very high	74 Å²	74	55 Å²	55	45%	0.454	31%	0.31	S	S	.	.			trans	-105.3	-7.6	-174.3	55.7	0	0	0	0	114.1	A174 L198 P202 I261	A174-T200 HydrophobicContact CB-CG2 3.89Å; L198-T200 HydrophobicContact CD2-CG2 3.65Å; L198-T200 HydrophobicContact CG-CG2 4.02Å; T200-P202 VanDerWaalsContact O-CD 3.25Å; T200-P202 WeakPolarHBondContact O-CD 3.35Å; T200-I261 HydrophobicContact CG2-CD1 4.47Å
201	T	89.1	Confident	91	Very high	101 Å²	101	51 Å²	51	62%	0.62	28%	0.283	S	S	*	.			trans	-67.5	117	-175.8	-49.7	0	0	0	0	110.6
202	P	90.2	Very high	91	Very high	77 Å²	77	54 Å²	54	50%	0.5	30%	0.299	S	S	.	.			trans	-66.3	140	179.7	-20.4	33.9	0	0	0	111.7	I169 V171 T200	I169-P202 WeakPolarHBondContact O-CA 3.36Å; V171-P202 HydrophobicContact CG2-CB 4.28Å; V171-P202 HydrophobicContact CG2-CG 4.28Å; T200-P202 VanDerWaalsContact O-CD 3.25Å; T200-P202 WeakPolarHBondContact O-CD 3.35Å
203	G	90.9	Very high	90.9	Very high	35 Å²	35	52.6 Å²	52.6	36%	0.361	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	135.2	-171.7	-178.6	0	0	0	0	0	113.3	V168 I169 Y205	V168-G203 WeakPolarHBondContact CA-O 3.43Å; I169-G203 PolarHBondContact N-O 3.06Å; I169-G203 PolarHBondContact O-N 3.39Å; G203-Y205 PolarHBondContact O-N 3.09Å
204	A	90.1	Very high	90.9	Very high	46 Å²	46	47.3 Å²	47.3	38%	0.38	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	112.1	175	0	0	0	0	0	110.1	N120 A166	N120-A204 HydrophobicContact CB-CB 4.38Å; A166-A204 HydrophobicContact CB-CB 3.95Å
205	Y	91.8	Very high	90.9	Very high	24 Å²	24	49 Å²	49	9%	0.094	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114.8	175.6	-169.9	-94	0	0	0	110.3	A166 K167 I169 L175 M177 R186 V199 G203 P207 E211	A166-Y205 CarbonylContact C-O 3.52Å; A166-Y205 VanDerWaalsContact CA-O 3.31Å; A166-Y205 WeakPolarHBondContact CA-O 3.33Å; K167-Y205 PolarHBondContact N-O 3.26Å; K167-Y205 PolarHBondContact O-N 3.27Å; I169-Y205 HydrophobicContact CD1-CG 4.24Å; L175-Y205 HydrophobicContact CD1-CD1 4.39Å; M177-Y205 HydrophobicContact CE-CE1 3.99Å; M177-Y205 HydrophobicContact SD-CE1 4.24Å; R186-Y205 HydrophobicContact CB-CE2 3.92Å; R186-Y205 HydrophobicContact CG-CE2 4.2Å; V199-Y205 HydrophobicContact CG1-CD2 3.69Å; V199-Y205 HydrophobicContact CG1-CE2 3.67Å; V199-Y205 HydrophobicContact CG1-CG 4.22Å; V199-Y205 HydrophobicContact CG2-CE1 4.46Å; V199-Y205 HydrophobicContact CG2-CE2 4.23Å; G203-Y205 PolarHBondContact O-N 3.09Å; Y205-P207 WeakPolarHBondContact O-CD 3.48Å; Y205-E211 WeakPolarHBondContact CE1-OE2 3.45Å; Y205-E211 PolarHBondContact OH-OE1 3.13Å; Y205-E211 PolarHBondContact OH-OE2 3.05Å
206	L	91.8	Very high	90.9	Very high	13 Å²	13	51.5 Å²	51.5	7%	0.068	29%	0.286	C	S	.	.			trans	-93.5	108.4	176.9	-178.7	64.3	0	0	0	109.3	A122 E147 E164 A166 R186 G208	A122-L206 HydrophobicContact CB-CD2 3.89Å; E147-L206 HydrophobicContact CG-CD2 4.15Å; E164-L206 HydrophobicContact CB-CD1 4.26Å; A166-L206 HydrophobicContact CB-CB 3.93Å; A166-L206 HydrophobicContact CB-CD1 4.26Å; R186-L206 VanDerWaalsContact CZ-O 3.27Å; R186-L206 PolarHBondContact NE-O 2.92Å; R186-L206 PolarHBondContact NH2-O 2.91Å; L206-G208 PolarHBondContact O-N 2.86Å
207	P	90.9	Very high	90.8	Very high	20 Å²	20	48.6 Å²	48.6	13%	0.13	27%	0.274	C	S	.	.			trans	-57.4	136.8	-177.5	-24.6	35.5	0	0	0	111.7	L145 M177 Y205 E211 I213	L145-P207 WeakPolarHBondContact CD1-O 3.47Å; M177-P207 HydrophobicContact CE-CB 4.07Å; M177-P207 HydrophobicContact CE-CG 4.34Å; Y205-P207 WeakPolarHBondContact O-CD 3.48Å; P207-E211 WeakPolarHBondContact CA-OE2 3.27Å; P207-E211 HydrophobicContact CB-CB 4.29Å; P207-I213 HydrophobicContact CG-CD1 3.83Å; P207-I213 HydrophobicContact CG-CG1 4.01Å
208	G	90.5	Very high	90.9	Very high	17 Å²	17	56.1 Å²	56.1	18%	0.175	31%	0.308	C	S	.	.			trans	-63.6	164	169.3	0	0	0	0	0	112	L206 Y210 E211	L206-G208 PolarHBondContact O-N 2.86Å; G208-Y210 PolarHBondContact O-N 3.07Å; G208-E211 PolarHBondContact N-OE2 3.41Å; G208-E211 PolarHBondContact O-N 3.16Å
209	V	89.8	Confident	90.8	Very high	21 Å²	21	55.3 Å²	55.3	13%	0.127	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-43.8	-178	-173.4	0	0	0	0	112.9	R124 E143 L145	R124-V209 PolarHBondContact NH1-O 2.92Å; R124-V209 PolarHBondContact NH2-O 3.2Å; E143-V209 HydrophobicContact CB-CG1 3.54Å; L145-V209 HydrophobicContact CD2-CG2 4.45Å; L145-V209 HydrophobicContact CG-CG2 3.91Å
210	Y	91.8	Very high	90.8	Very high	47 Å²	47	56.6 Å²	56.6	18%	0.184	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	6.2	-174.9	-54.1	-55.6	0	0	0	112.9	T180 K181 C183 G208	T180-Y210 PolarHBondContact N-O 3.44Å; T180-Y210 VanDerWaalsContact OG1-C 3.29Å; T180-Y210 WeakPolarHBondContact OG1-CA 3.36Å; T180-Y210 PolarHBondContact OG1-O 2.97Å; K181-Y210 HydrophobicContact CB-CD1 3.93Å; K181-Y210 HydrophobicContact CB-CD2 4.4Å; K181-Y210 HydrophobicContact CB-CE1 4.42Å; K181-Y210 HydrophobicContact CB-CG 3.93Å; K181-Y210 HydrophobicContact CD-CD1 4Å; K181-Y210 HydrophobicContact CD-CE1 3.71Å; K181-Y210 HydrophobicContact CG-CD1 3.95Å; K181-Y210 HydrophobicContact CG-CE1 4.2Å; K181-Y210 HydrophobicContact CG-CG 4.47Å; C183-Y210 HydrophobicContact CB-CD2 3.98Å; C183-Y210 HydrophobicContact CB-CG 4.43Å; G208-Y210 PolarHBondContact O-N 3.07Å
211	E	92.5	Very high	91	Very high	14 Å²	14	57 Å²	57	7%	0.065	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.9	176.2	-53.9	-180	162.6	0	0	109.9	M177 D185 R186 W197 Y205 P207 G208	M177-E211 HydrophobicContact CE-CB 3.62Å; D185-E211 VanDerWaalsContact CA-OE1 3.23Å; D185-E211 WeakPolarHBondContact CA-OE1 3.46Å; D185-E211 WeakPolarHBondContact CB-OE1 3.19Å; R186-E211 PolarHBondContact N-OE1 2.96Å; W197-E211 HydrophobicContact CH2-CB 4.42Å; W197-E211 HydrophobicContact CH2-CG 4.06Å; W197-E211 HydrophobicContact CZ2-CB 4.46Å; W197-E211 HydrophobicContact CZ2-CG 3.95Å; Y205-E211 WeakPolarHBondContact CE1-OE2 3.45Å; Y205-E211 PolarHBondContact OH-OE1 3.13Å; Y205-E211 PolarHBondContact OH-OE2 3.05Å; P207-E211 WeakPolarHBondContact CA-OE2 3.27Å; P207-E211 HydrophobicContact CB-CB 4.29Å; G208-E211 PolarHBondContact N-OE2 3.41Å; G208-E211 PolarHBondContact O-N 3.16Å
212	Q	92.3	Very high	91.1	Very high	105 Å²	105	52.3 Å²	52.3	49%	0.491	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.4	175	177.1	172.3	-9	0	0	110.4	M177 E178 T180 V214	M177-Q212 CarbonylContact C-O 3.51Å; M177-Q212 VanDerWaalsContact CA-O 3.3Å; M177-Q212 WeakPolarHBondContact CA-O 3.33Å; E178-Q212 PolarHBondContact N-O 3Å; E178-Q212 PolarHBondContact O-N 3.06Å; T180-Q212 HydrophobicContact CG2-CB 3.69Å; Q212-V214 PolarHBondContact O-N 3.3Å
213	I	91.6	Very high	91.2	Very high	58 Å²	58	50.6 Å²	50.6	30%	0.297	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	123.6	169.2	-55.5	170	0	0	0	108.1	K167 L175 M177 P207	K167-I213 HydrophobicContact CB-CD1 3.81Å; K167-I213 HydrophobicContact CG-CD1 4.11Å; L175-I213 HydrophobicContact CD1-CD1 4.12Å; L175-I213 HydrophobicContact CD1-CG1 4.37Å; L175-I213 HydrophobicContact CD2-CG2 4.28Å; M177-I213 HydrophobicContact CE-CG1 3.8Å; M177-I213 HydrophobicContact SD-CB 4.43Å; M177-I213 HydrophobicContact SD-CG1 3.79Å; P207-I213 HydrophobicContact CG-CD1 3.83Å; P207-I213 HydrophobicContact CG-CG1 4.01Å
214	V	90.6	Very high	91.1	Very high	57 Å²	57	54 Å²	54	35%	0.345	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-41.7	179.7	178.3	0	0	0	0	112.2	V176 E178 Q212	V176-V214 PolarHBondContact O-N 3.34Å; E178-V214 HydrophobicContact CB-CG2 3.47Å; E178-V214 VanDerWaalsContact CB-CG2 3.47Å; Q212-V214 PolarHBondContact O-N 3.3Å
215	D	89.7	Confident	91.2	Very high	67 Å²	67	59.2 Å²	59.2	36%	0.358	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	155	-170.2	177.1	35	0	0	0	111.1	V176 R217	V176-D215 HydrophobicContact CB-CB 3.91Å; V176-D215 HydrophobicContact CG2-CB 3.89Å; V176-D215 PolarHBondContact N-O 2.91Å; D215-R217 VanDerWaalsContact OD2-CG 3.31Å; D215-R217 WeakPolarHBondContact OD2-CG 3.28Å; D215-R217 IonicContact OD2-CZ 3.72Å; D215-R217 IonicContact OD2-NE 2.7Å; D215-R217 PolarHBondContact OD2-NE 3.49Å; D215-R217 IonicContact OD2-NH2 3.69Å
216	E	91.3	Very high	91.2	Very high	115 Å²	115	62.8 Å²	62.8	54%	0.537	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	106.5	178.5	-67.3	-173.3	-146.4	0	0	109.7	K167 L175	K167-E216 WeakPolarHBondContact CE-OE1 3.48Å; K167-E216 IonicContact NZ-OE1 2.73Å; K167-E216 PolarHBondContact NZ-OE1 3.38Å; K167-E216 IonicContact NZ-OE2 2.75Å; L175-E216 HydrophobicContact CD2-CG 3.79Å
217	R	90.7	Very high	91.3	Very high	61 Å²	61	62.2 Å²	62.2	23%	0.23	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	141.2	-176.2	-65.8	-173.6	175.1	-161.9	-1.7	111.6	S173 A174 V176 D215 I261 C262 S263 E266	S173-R217 CarbonylContact C-O 3.56Å; S173-R217 WeakPolarHBondContact CA-O 3.29Å; S173-R217 WeakPolarHBondContact CB-O 3.31Å; A174-R217 PolarHBondContact N-O 3.11Å; A174-R217 PolarHBondContact O-N 3.15Å; V176-R217 HydrophobicContact CG2-CG 3.9Å; D215-R217 VanDerWaalsContact OD2-CG 3.31Å; D215-R217 WeakPolarHBondContact OD2-CG 3.28Å; D215-R217 IonicContact OD2-CZ 3.72Å; D215-R217 IonicContact OD2-NE 2.7Å; D215-R217 PolarHBondContact OD2-NE 3.49Å; D215-R217 IonicContact OD2-NH2 3.69Å; R217-I261 HydrophobicContact CB-CG2 3.91Å; R217-C262 VanDerWaalsContact CD-O 3.22Å; R217-C262 WeakPolarHBondContact CD-O 3.49Å; R217-C262 PolarHBondContact NH1-O 3.03Å; R217-S263 PolarHBondContact NH1-O 3.36Å; R217-E266 PolarHBondContact NH1-O 3Å; R217-E266 VanDerWaalsContact NH1-O 3.16Å
218	K	91.7	Very high	91.5	Very high	173 Å²	173	61.3 Å²	61.3	75%	0.752	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	150.6	173	-64.5	-178	-178	176.7	0	109.7
219	A	90.4	Very high	91.6	Very high	22 Å²	22	60.5 Å²	60.5	18%	0.182	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-69.9	139.9	173.5	0	0	0	0	0	111.2	N172 Y259 H260 I261	N172-A219 HydrophobicContact CB-CB 3.85Å; N172-A219 WeakPolarHBondContact O-CB 3.46Å; N172-A219 PolarHBondContact O-N 2.92Å; A219-Y259 HydrophobicContact CB-CD2 3.62Å; A219-Y259 HydrophobicContact CB-CE2 4.45Å; A219-Y259 HydrophobicContact CB-CG 4.14Å; A219-H260 WeakPolarHBondContact CA-O 3.42Å; A219-I261 HydrophobicContact CB-CD1 4.26Å; A219-I261 HydrophobicContact CB-CG1 3.56Å
220	I	90.9	Very high	91.8	Very high	42 Å²	42	59.5 Å²	59.5	22%	0.215	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.4	167.7	-53.6	170.1	0	0	0	106.8	L222 I228 Y259 H260 F268	I220-L222 HydrophobicContact CG2-CD2 4.48Å; I220-I228 HydrophobicContact CB-CG2 4.5Å; I220-I228 HydrophobicContact CD1-CD1 4.26Å; I220-I228 HydrophobicContact CD1-CG2 4.3Å; I220-I228 HydrophobicContact CG2-CG2 3.82Å; I220-Y259 CarbonylContact O-C 3.58Å; I220-Y259 VanDerWaalsContact O-CA 3.24Å; I220-Y259 WeakPolarHBondContact O-CA 3.37Å; I220-H260 PolarHBondContact N-O 3.12Å; I220-H260 PolarHBondContact O-N 3.27Å; I220-F268 HydrophobicContact CD1-CD2 3.49Å; I220-F268 VanDerWaalsContact CD1-CD2 3.49Å; I220-F268 HydrophobicContact CD1-CE2 3.67Å; I220-F268 HydrophobicContact CD1-CG 4.26Å
221	T	91.8	Very high	91.9	Very high	82 Å²	82	60.2 Å²	60.2	50%	0.503	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	128.3	175.3	-52.5	0	0	0	0	110	T223	T221-T223 HydrophobicContact CG2-CG2 4.49Å
222	L	92.5	Very high	91.9	Very high	3 Å²	3	59.6 Å²	59.6	2%	0.016	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-104	141.8	178.4	-53.9	-179.5	0	0	0	109	I220 R226 I228 I252 H254 A257 E258 H260	I220-L222 HydrophobicContact CG2-CD2 4.48Å; L222-R226 WeakPolarHBondContact CA-O 3.25Å; L222-I228 HydrophobicContact CD2-CB 4.29Å; L222-I228 HydrophobicContact CD2-CD1 4.22Å; L222-I228 HydrophobicContact CD2-CG1 3.9Å; L222-I228 HydrophobicContact CD2-CG2 3.72Å; L222-I252 HydrophobicContact CD1-CB 4.26Å; L222-I252 HydrophobicContact CD1-CG2 3.53Å; L222-H254 HydrophobicContact CB-CB 4.42Å; L222-H254 PolarHBondContact O-ND1 3.32Å; L222-A257 WeakPolarHBondContact CB-O 3.48Å; L222-A257 WeakPolarHBondContact CD1-O 3.43Å; L222-E258 PolarHBondContact N-O 3.47Å; L222-H260 HydrophobicContact CD1-CB 4.24Å
223	T	92	Very high	91.8	Very high	41 Å²	41	58.5 Å²	58.5	25%	0.252	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-137.6	173.4	177.1	85.8	0	0	0	0	110.6	T221 R225 R226	T221-T223 HydrophobicContact CG2-CG2 4.49Å; T223-R225 PolarHBondContact O-N 3.03Å; T223-R225 PolarHBondContact OG1-N 3.45Å; T223-R226 PolarHBondContact N-O 2.92Å; T223-R226 CarbonylContact O-C 3.52Å; T223-R226 PolarHBondContact O-N 3.14Å; T223-R226 PolarHBondContact OG1-N 2.87Å
224	D	89.1	Confident	91.6	Very high	105 Å²	105	62.2 Å²	62.2	56%	0.561	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.7	-21.6	164.9	67.7	-37.5	0	0	0	115.1	F310	D224-F310 WeakPolarHBondContact O-CZ 3.29Å
225	R	91.7	Very high	91.7	Very high	156 Å²	156	62.3 Å²	62.3	59%	0.589	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-12.2	179.6	-56.6	-175.1	-171.8	-172.6	-3.9	115.2	T223 V274	T223-R225 PolarHBondContact O-N 3.03Å; T223-R225 PolarHBondContact OG1-N 3.45Å; R225-V274 HydrophobicContact CB-CG1 3.81Å; R225-V274 HydrophobicContact CG-CG1 3.85Å; R225-V274 PolarHBondContact O-N 3.09Å; R225-V274 VanDerWaalsContact O-N 3.16Å
226	R	92	Very high	91.7	Very high	100 Å²	100	60 Å²	60	38%	0.377	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	105	-171.6	-58.6	-176.9	73.8	-156.5	-0.6	110.1	L222 T223 E271	L222-R226 WeakPolarHBondContact CA-O 3.25Å; T223-R226 PolarHBondContact N-O 2.92Å; T223-R226 CarbonylContact O-C 3.52Å; T223-R226 PolarHBondContact O-N 3.14Å; T223-R226 PolarHBondContact OG1-N 2.87Å; R226-E271 IonicContact CZ-OE1 3.73Å; R226-E271 IonicContact CZ-OE2 2.99Å; R226-E271 IonicContact NE-OE1 3.54Å; R226-E271 PolarHBondContact NE-OE1 3.17Å; R226-E271 IonicContact NH2-OE1 3.3Å; R226-E271 PolarHBondContact NH2-OE1 3Å; R226-E271 IonicContact NH2-OE2 3.06Å; R226-E271 PolarHBondContact NH2-OE2 2.98Å
227	A	93.7	Very high	91.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	166.7	169.5	0	0	0	0	0	109.9	L251 I252 T253 V272 F310	A227-L251 HydrophobicContact CB-CD1 3.79Å; A227-L251 HydrophobicContact CB-CD2 4.26Å; A227-L251 HydrophobicContact CB-CG 4.06Å; A227-I252 WeakPolarHBondContact CA-O 3.43Å; A227-I252 WeakPolarHBondContact CB-O 3.44Å; A227-T253 HydrophobicContact CB-CG2 4.2Å; A227-V272 HydrophobicContact CB-CB 4.41Å; A227-V272 PolarHBondContact N-O 3.38Å; A227-V272 PolarHBondContact O-N 3.24Å; A227-F310 HydrophobicContact CB-CB 4.46Å; A227-F310 HydrophobicContact CB-CD1 3.47Å; A227-F310 VanDerWaalsContact CB-CD1 3.47Å; A227-F310 HydrophobicContact CB-CD2 4.06Å; A227-F310 HydrophobicContact CB-CE1 3.51Å; A227-F310 HydrophobicContact CB-CE2 4.11Å; A227-F310 HydrophobicContact CB-CG 3.74Å; A227-F310 HydrophobicContact CB-CZ 3.84Å
228	I	94.5	Very high	91.6	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.5	174.9	62.4	176.3	0	0	0	111.5	I220 L222 V230 L251 I252 H260 F268	I220-I228 HydrophobicContact CB-CG2 4.5Å; I220-I228 HydrophobicContact CD1-CD1 4.26Å; I220-I228 HydrophobicContact CD1-CG2 4.3Å; I220-I228 HydrophobicContact CG2-CG2 3.82Å; L222-I228 HydrophobicContact CD2-CB 4.29Å; L222-I228 HydrophobicContact CD2-CD1 4.22Å; L222-I228 HydrophobicContact CD2-CG1 3.9Å; L222-I228 HydrophobicContact CD2-CG2 3.72Å; I228-V230 HydrophobicContact CD1-CG1 4.04Å; I228-V230 HydrophobicContact CG1-CG1 4.44Å; I228-L251 CarbonylContact O-C 3.55Å; I228-L251 WeakPolarHBondContact O-CA 3.41Å; I228-I252 HydrophobicContact CD1-CD1 4.48Å; I228-I252 HydrophobicContact CG1-CB 4.02Å; I228-I252 PolarHBondContact N-O 3.1Å; I228-I252 PolarHBondContact O-N 3.48Å; I228-H260 HydrophobicContact CD1-CB 3.81Å; I228-F268 HydrophobicContact CB-CD2 4.39Å; I228-F268 HydrophobicContact CB-CE2 4.08Å; I228-F268 HydrophobicContact CG2-CD2 4.45Å; I228-F268 HydrophobicContact CG2-CE2 3.82Å
229	C	93.3	Very high	91.2	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.007	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.4	166.2	-172.8	0	0	0	0	108.9	W250 V269 R270 V272	C229-W250 WeakPolarHBondContact CA-O 3.42Å; C229-V269 HydrophobicContact CB-CB 4.24Å; C229-V269 WeakPolarHBondContact O-CB 3.24Å; C229-V269 PolarHBondContact O-N 3.47Å; C229-R270 HydrophobicContact CB-CG 3.77Å; C229-R270 PolarHBondContact N-O 2.72Å; C229-R270 PolarHBondContact O-N 3.26Å; C229-V272 HydrophobicContact CB-CG2 4.13Å
230	V	93.4	Very high	91.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	156.2	175.6	-78.6	0	0	0	0	110.6	I228 E249 W250 I252 E267	I228-V230 HydrophobicContact CD1-CG1 4.04Å; I228-V230 HydrophobicContact CG1-CG1 4.44Å; V230-E249 VanDerWaalsContact O-CA 3.31Å; V230-E249 WeakPolarHBondContact O-CA 3.22Å; V230-W250 HydrophobicContact CB-CZ2 4.43Å; V230-W250 HydrophobicContact CG2-CD2 3.98Å; V230-W250 VanDerWaalsContact CG2-CE2 3.41Å; V230-W250 HydrophobicContact CG2-CG 4.31Å; V230-W250 HydrophobicContact CG2-CH2 4.39Å; V230-W250 HydrophobicContact CG2-CZ2 3.65Å; V230-W250 PolarHBondContact N-O 3.18Å; V230-W250 PolarHBondContact O-N 3.38Å; V230-I252 HydrophobicContact CG1-CD1 4.47Å; V230-I252 HydrophobicContact CG2-CD1 3.44Å; V230-I252 VanDerWaalsContact CG2-CD1 3.44Å; V230-I252 HydrophobicContact CG2-CG1 3.81Å; V230-E267 CarbonylContact C-O 3.56Å; V230-E267 VanDerWaalsContact CA-O 3.31Å; V230-E267 WeakPolarHBondContact CA-O 3.4Å
231	K	94.1	Very high	90.8	Very high	62 Å²	62	57.4 Å²	57.4	27%	0.27	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	137.7	-175.6	-174.7	174.3	-173.8	166	0	111.2	V233 E248 E249 E266 E267 V269	K231-V233 PolarHBondContact O-N 3.39Å; K231-E248 VanDerWaalsContact CA-O 3.3Å; K231-E248 WeakPolarHBondContact CA-O 3.46Å; K231-E249 HydrophobicContact CB-CG 3.94Å; K231-E249 HydrophobicContact CD-CG 4.05Å; K231-E249 HydrophobicContact CG-CG 3.86Å; K231-E249 IonicContact NZ-OE1 3.13Å; K231-E266 CarbonylContact O-C 3.56Å; K231-E266 WeakPolarHBondContact O-CA 3.5Å; K231-E267 HydrophobicContact CB-CB 4.38Å; K231-E267 PolarHBondContact N-O 3.39Å; K231-E267 PolarHBondContact O-N 2.91Å; K231-V269 HydrophobicContact CB-CG2 3.55Å; K231-V269 HydrophobicContact CD-CG2 4.32Å
232	A	92.6	Very high	90.7	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	117.8	173.7	0	0	0	0	0	110.6	R244 K245 G247 E248 W250	A232-R244 HydrophobicContact CB-CB 3.89Å; A232-K245 WeakPolarHBondContact CB-O 3.35Å; A232-G247 PolarHBondContact O-N 2.93Å; A232-E248 PolarHBondContact N-O 3.08Å; A232-W250 HydrophobicContact CB-CH2 4Å; A232-W250 HydrophobicContact CB-CZ3 3.69Å
233	V	90.4	Very high	90.6	Very high	82 Å²	82	65.3 Å²	65.3	50%	0.497	33%	0.325	S	S	.	.	S	Bend	trans	-72.4	-36	174.3	-177.3	0	0	0	0	110.7	K231 L265 E267	K231-V233 PolarHBondContact O-N 3.39Å; V233-L265 PolarHBondContact N-O 3.4Å; V233-E267 HydrophobicContact CG2-CB 3.81Å
234	K	88.3	Confident	90.7	Very high	136 Å²	136	64.6 Å²	64.6	59%	0.591	32%	0.318	S	S	*	.	S	Bend	trans	-134.6	154.4	172.5	-66.3	-177.8	-179.6	175.6	0	109.3	H236 L265	K234-H236 PolarHBondContact O-N 3.08Å; K234-H236 PolarHBondContact O-ND1 2.8Å; K234-L265 HydrophobicContact CB-CD2 4.39Å; K234-L265 HydrophobicContact CD-CD2 4.33Å
235	S	91.7	Very high	90.8	Very high	59 Å²	59	66.2 Å²	66.2	41%	0.413	32%	0.32	S	S	.	.			trans	-65.3	126.7	177.6	-50.4	0	0	0	0	111.1	Y243 R244 A246	S235-Y243 WeakPolarHBondContact CB-OH 3.38Å; S235-R244 CarbonylContact C-O 3.59Å; S235-R244 WeakPolarHBondContact CA-O 3.34Å; S235-R244 WeakPolarHBondContact CB-O 3.1Å; S235-A246 PolarHBondContact OG-N 2.77Å
236	H	90.2	Very high	90.8	Very high	20 Å²	20	61.6 Å²	61.6	9%	0.093	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	170.1	-176.4	68.3	-73	0	0	0	111.1	K234 R244 L265 E266	K234-H236 PolarHBondContact O-N 3.08Å; K234-H236 PolarHBondContact O-ND1 2.8Å; H236-R244 PolarHBondContact N-O 2.81Å; H236-R244 PolarHBondContact O-N 3.46Å; H236-L265 HydrophobicContact CB-CD1 3.64Å; H236-L265 PolarHBondContact CE1-O 3.39Å; H236-E266 IonicContact NE2-OE1 2.7Å
237	C	90.6	Very high	90.6	Very high	85 Å²	85	58.9 Å²	58.9	57%	0.574	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	127	165.2	-62.6	0	0	0	0	109.2	K242	C237-K242 WeakPolarHBondContact CA-O 3.21Å
238	D	88.2	Confident	90.5	Very high	9 Å²	9	61.5 Å²	61.5	5%	0.048	33%	0.33	C	S	.	.			trans	-69.7	172.8	175.9	70.8	17.9	0	0	0	112	F240 G241 K242 R244 W250	D238-F240 PolarHBondContact O-N 3.35Å; D238-F240 VanDerWaalsContact OD1-C 3.31Å; D238-F240 WeakPolarHBondContact OD1-CA 3.25Å; D238-F240 WeakPolarHBondContact OD1-CB 3.32Å; D238-F240 PolarHBondContact OD1-N 2.66Å; D238-G241 PolarHBondContact O-N 2.92Å; D238-G241 PolarHBondContact OD1-N 3.43Å; D238-G241 VanDerWaalsContact OD1-N 3.07Å; D238-K242 PolarHBondContact N-O 2.96Å; D238-K242 PolarHBondContact OD1-N 3.01Å; D238-R244 HydrophobicContact CB-CG 4.06Å; D238-R244 IonicContact OD2-CZ 2.7Å; D238-R244 VanDerWaalsContact OD2-CZ 3.27Å; D238-R244 IonicContact OD2-NE 3.42Å; D238-R244 PolarHBondContact OD2-NE 2.97Å; D238-R244 IonicContact OD2-NH2 2.83Å; D238-R244 PolarHBondContact OD2-NH2 3.5Å; D238-W250 HydrophobicContact CB-CZ2 4.17Å
239	K	84.2	Confident	90.4	Very high	141 Å²	141	64.3 Å²	64.3	61%	0.613	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-19.5	178.7	-171.5	-179.9	173.5	-168.2	0	113.4
240	F	88.2	Confident	90.3	Very high	61 Å²	61	64.8 Å²	64.8	27%	0.268	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	5.2	-178.8	-45.1	-72.8	0	0	0	112.6	D238 I252 D256 A257	D238-F240 PolarHBondContact O-N 3.35Å; D238-F240 VanDerWaalsContact OD1-C 3.31Å; D238-F240 WeakPolarHBondContact OD1-CA 3.25Å; D238-F240 WeakPolarHBondContact OD1-CB 3.32Å; D238-F240 PolarHBondContact OD1-N 2.66Å; F240-I252 HydrophobicContact CE2-CD1 3.82Å; F240-I252 HydrophobicContact CE2-CG1 4.04Å; F240-I252 HydrophobicContact CE2-CG2 4Å; F240-I252 HydrophobicContact CZ-CD1 4.4Å; F240-I252 HydrophobicContact CZ-CG2 3.79Å; F240-D256 HydrophobicContact CD1-CB 4.28Å; F240-D256 HydrophobicContact CE1-CB 3.85Å; F240-D256 VanDerWaalsContact CE1-O 3.31Å; F240-D256 WeakPolarHBondContact CE1-O 3.25Å; F240-D256 HydrophobicContact CZ-CB 3.97Å; F240-A257 HydrophobicContact CE1-CB 4.13Å; F240-A257 HydrophobicContact CZ-CB 4.3Å
241	G	85.3	Confident	90.3	Very high	62 Å²	62	66.3 Å²	66.3	64%	0.639	35%	0.353	S	S	*	.	S	Bend	trans	81.1	7.7	177.9	0	0	0	0	0	115	D238	D238-G241 PolarHBondContact O-N 2.92Å; D238-G241 PolarHBondContact OD1-N 3.43Å; D238-G241 VanDerWaalsContact OD1-N 3.07Å
242	K	88.4	Confident	90.2	Very high	105 Å²	105	63.4 Å²	63.4	46%	0.457	34%	0.34	S	S	.	.			trans	-86.4	131.8	177.2	-64.8	166.4	-177.3	162.9	0	109.4	C237 D238 R244 D256	C237-K242 WeakPolarHBondContact CA-O 3.21Å; D238-K242 PolarHBondContact N-O 2.96Å; D238-K242 PolarHBondContact OD1-N 3.01Å; K242-R244 PolarHBondContact O-N 2.63Å; K242-D256 IonicContact NZ-OD1 2.71Å
243	Y	91.7	Very high	90.2	Very high	146 Å²	146	64.4 Å²	64.4	57%	0.573	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	120.3	176.5	-176.6	-95.6	0	0	0	110.7	S235 K245	S235-Y243 WeakPolarHBondContact CB-OH 3.38Å; Y243-K245 HydrophobicContact CE1-CG 4.26Å
244	R	92.3	Very high	90.2	Very high	26 Å²	26	64.7 Å²	64.7	10%	0.098	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	136.7	-178.1	-54	-57.2	-178.7	161.5	8.9	110.6	A232 S235 H236 D238 K242 E248 W250	A232-R244 HydrophobicContact CB-CB 3.89Å; S235-R244 CarbonylContact C-O 3.59Å; S235-R244 WeakPolarHBondContact CA-O 3.34Å; S235-R244 WeakPolarHBondContact CB-O 3.1Å; H236-R244 PolarHBondContact N-O 2.81Å; H236-R244 PolarHBondContact O-N 3.46Å; D238-R244 HydrophobicContact CB-CG 4.06Å; D238-R244 IonicContact OD2-CZ 2.7Å; D238-R244 VanDerWaalsContact OD2-CZ 3.27Å; D238-R244 IonicContact OD2-NE 3.42Å; D238-R244 PolarHBondContact OD2-NE 2.97Å; D238-R244 IonicContact OD2-NH2 2.83Å; D238-R244 PolarHBondContact OD2-NH2 3.5Å; K242-R244 PolarHBondContact O-N 2.63Å; R244-E248 WeakPolarHBondContact CA-OE2 3.44Å; R244-E248 WeakPolarHBondContact CD-OE1 3.4Å; R244-E248 IonicContact CZ-OE1 3.81Å; R244-E248 IonicContact NE-OE1 2.74Å; R244-E248 IonicContact NH1-OE1 2.85Å; R244-E248 PolarHBondContact NH1-OE1 3.39Å; R244-W250 HydrophobicContact CB-CH2 4.14Å; R244-W250 HydrophobicContact CB-CZ3 3.88Å; R244-W250 HydrophobicContact CG-CD2 4.41Å; R244-W250 HydrophobicContact CG-CE3 4.04Å; R244-W250 HydrophobicContact CG-CH2 3.69Å; R244-W250 HydrophobicContact CG-CZ2 4.05Å; R244-W250 HydrophobicContact CG-CZ3 3.67Å
245	K	92.4	Very high	90.3	Very high	139 Å²	139	67.2 Å²	67.2	60%	0.604	36%	0.356	S	S	*	.			trans	-88.4	148.5	173.3	-66.4	173.9	-176.2	169.5	0	110.7	A232 Y243 G247 E248	A232-K245 WeakPolarHBondContact CB-O 3.35Å; Y243-K245 HydrophobicContact CE1-CG 4.26Å; K245-G247 PolarHBondContact O-N 3.1Å; K245-E248 HydrophobicContact CB-CB 4.41Å; K245-E248 PolarHBondContact N-OE2 3.07Å; K245-E248 WeakPolarHBondContact O-CB 3.32Å; K245-E248 PolarHBondContact O-N 3.2Å
246	A	91.2	Very high	90.2	Very high	59 Å²	59	67 Å²	67	49%	0.488	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	128.6	172.1	0	0	0	0	0	111.3	S235 E248	S235-A246 PolarHBondContact OG-N 2.77Å; A246-E248 VanDerWaalsContact C-N 3.34Å
247	G	88.7	Confident	90.1	Very high	43 Å²	43	67 Å²	67	44%	0.443	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	-9.3	-175	0	0	0	0	0	115.6	A232 K245	A232-G247 PolarHBondContact O-N 2.93Å; K245-G247 PolarHBondContact O-N 3.1Å
248	E	91.2	Very high	90.1	Very high	55 Å²	55	69.5 Å²	69.5	26%	0.257	36%	0.357	S	S	.	.			trans	-66.1	132.8	175.2	-172.3	-174.6	139.5	0	0	110.5	K231 A232 R244 K245 A246 W250	K231-E248 VanDerWaalsContact CA-O 3.3Å; K231-E248 WeakPolarHBondContact CA-O 3.46Å; A232-E248 PolarHBondContact N-O 3.08Å; R244-E248 WeakPolarHBondContact CA-OE2 3.44Å; R244-E248 WeakPolarHBondContact CD-OE1 3.4Å; R244-E248 IonicContact CZ-OE1 3.81Å; R244-E248 IonicContact NE-OE1 2.74Å; R244-E248 IonicContact NH1-OE1 2.85Å; R244-E248 PolarHBondContact NH1-OE1 3.39Å; K245-E248 HydrophobicContact CB-CB 4.41Å; K245-E248 PolarHBondContact N-OE2 3.07Å; K245-E248 WeakPolarHBondContact O-CB 3.32Å; K245-E248 PolarHBondContact O-N 3.2Å; A246-E248 VanDerWaalsContact C-N 3.34Å; E248-W250 WeakPolarHBondContact O-CZ3 3.38Å
249	E	92	Very high	90.2	Very high	60 Å²	60	73.1 Å²	73.1	28%	0.28	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.9	174	-68.2	-178.7	-167	0	0	109.6	V230 K231 V269 P313	V230-E249 VanDerWaalsContact O-CA 3.31Å; V230-E249 WeakPolarHBondContact O-CA 3.22Å; K231-E249 HydrophobicContact CB-CG 3.94Å; K231-E249 HydrophobicContact CD-CG 4.05Å; K231-E249 HydrophobicContact CG-CG 3.86Å; K231-E249 IonicContact NZ-OE1 3.13Å; E249-V269 HydrophobicContact CG-CG2 4.3Å; E249-P313 HydrophobicContact CB-CB 3.86Å; E249-P313 HydrophobicContact CB-CG 4.05Å
250	W	91.2	Very high	90.6	Very high	10 Å²	10	66.4 Å²	66.4	4%	0.038	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	159.8	174.3	68.1	95.5	0	0	0	111.9	C229 V230 A232 D238 R244 E248 E266	C229-W250 WeakPolarHBondContact CA-O 3.42Å; V230-W250 HydrophobicContact CB-CZ2 4.43Å; V230-W250 HydrophobicContact CG2-CD2 3.98Å; V230-W250 VanDerWaalsContact CG2-CE2 3.41Å; V230-W250 HydrophobicContact CG2-CG 4.31Å; V230-W250 HydrophobicContact CG2-CH2 4.39Å; V230-W250 HydrophobicContact CG2-CZ2 3.65Å; V230-W250 PolarHBondContact N-O 3.18Å; V230-W250 PolarHBondContact O-N 3.38Å; A232-W250 HydrophobicContact CB-CH2 4Å; A232-W250 HydrophobicContact CB-CZ3 3.69Å; D238-W250 HydrophobicContact CB-CZ2 4.17Å; R244-W250 HydrophobicContact CB-CH2 4.14Å; R244-W250 HydrophobicContact CB-CZ3 3.88Å; R244-W250 HydrophobicContact CG-CD2 4.41Å; R244-W250 HydrophobicContact CG-CE3 4.04Å; R244-W250 HydrophobicContact CG-CH2 3.69Å; R244-W250 HydrophobicContact CG-CZ2 4.05Å; R244-W250 HydrophobicContact CG-CZ3 3.67Å; E248-W250 WeakPolarHBondContact O-CZ3 3.38Å; W250-E266 HydrophobicContact CH2-CG 4.23Å; W250-E266 HydrophobicContact CZ2-CG 4.3Å
251	L	93	Very high	90.7	Very high	32 Å²	32	64.6 Å²	64.6	17%	0.168	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	139.2	173.7	-166.8	78.2	0	0	0	110.2	A227 I228 T253 V272 F310	A227-L251 HydrophobicContact CB-CD1 3.79Å; A227-L251 HydrophobicContact CB-CD2 4.26Å; A227-L251 HydrophobicContact CB-CG 4.06Å; I228-L251 CarbonylContact O-C 3.55Å; I228-L251 WeakPolarHBondContact O-CA 3.41Å; L251-T253 HydrophobicContact CD2-CG2 3.56Å; L251-T253 HydrophobicContact CG-CG2 4.06Å; L251-V272 HydrophobicContact CD1-CB 3.82Å; L251-V272 HydrophobicContact CD1-CG1 4.11Å; L251-V272 HydrophobicContact CD1-CG2 3.71Å; L251-F310 HydrophobicContact CD1-CB 4.5Å; L251-F310 HydrophobicContact CD2-CB 3.4Å; L251-F310 HydrophobicContact CD2-CD2 4.48Å; L251-F310 HydrophobicContact CD2-CG 4.13Å
252	I	93	Very high	91	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.6	164.6	-55.3	173.3	0	0	0	107.7	L222 A227 I228 V230 F240 D256 H260	L222-I252 HydrophobicContact CD1-CB 4.26Å; L222-I252 HydrophobicContact CD1-CG2 3.53Å; A227-I252 WeakPolarHBondContact CA-O 3.43Å; A227-I252 WeakPolarHBondContact CB-O 3.44Å; I228-I252 HydrophobicContact CD1-CD1 4.48Å; I228-I252 HydrophobicContact CG1-CB 4.02Å; I228-I252 PolarHBondContact N-O 3.1Å; I228-I252 PolarHBondContact O-N 3.48Å; V230-I252 HydrophobicContact CG1-CD1 4.47Å; V230-I252 HydrophobicContact CG2-CD1 3.44Å; V230-I252 VanDerWaalsContact CG2-CD1 3.44Å; V230-I252 HydrophobicContact CG2-CG1 3.81Å; F240-I252 HydrophobicContact CE2-CD1 3.82Å; F240-I252 HydrophobicContact CE2-CG1 4.04Å; F240-I252 HydrophobicContact CE2-CG2 4Å; F240-I252 HydrophobicContact CZ-CD1 4.4Å; F240-I252 HydrophobicContact CZ-CG2 3.79Å; I252-D256 HydrophobicContact CG2-CB 3.85Å; I252-H260 HydrophobicContact CD1-CB 4.5Å
253	T	92.5	Very high	90.9	Very high	21 Å²	21	59 Å²	59	13%	0.129	30%	0.298	C	S	.	.			trans	-112.8	172.7	-177.6	67.2	0	0	0	0	111.6	A227 L251 E255 D256 A257 F310	A227-T253 HydrophobicContact CB-CG2 4.2Å; L251-T253 HydrophobicContact CD2-CG2 3.56Å; L251-T253 HydrophobicContact CG-CG2 4.06Å; T253-E255 PolarHBondContact O-N 3.26Å; T253-E255 PolarHBondContact OG1-N 3.38Å; T253-D256 PolarHBondContact N-OD2 2.91Å; T253-D256 PolarHBondContact O-N 3.11Å; T253-D256 VanDerWaalsContact O-N 3.07Å; T253-D256 PolarHBondContact OG1-OD2 3.48Å; T253-A257 PolarHBondContact O-N 3.27Å; T253-F310 HydrophobicContact CG2-CD2 3.93Å; T253-F310 HydrophobicContact CG2-CE2 4.31Å
254	H	91	Very high	90.6	Very high	88 Å²	88	52.8 Å²	52.8	41%	0.407	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.6	172.5	-173.5	78.6	0	0	0	113.4	L222 D256 A257	L222-H254 HydrophobicContact CB-CB 4.42Å; L222-H254 PolarHBondContact O-ND1 3.32Å; H254-D256 VanDerWaalsContact C-N 3.31Å; H254-A257 WeakPolarHBondContact CA-O 3.49Å
255	E	89.4	Confident	90.5	Very high	190 Å²	190	54.2 Å²	54.2	89%	0.888	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-27.6	174.1	-58.4	-176.2	172.3	0	0	112.3	T253	T253-E255 PolarHBondContact O-N 3.26Å; T253-E255 PolarHBondContact OG1-N 3.38Å
256	D	89.9	Confident	90.5	Very high	55 Å²	55	47.8 Å²	47.8	29%	0.294	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-43	175.3	-54.9	-84.4	0	0	0	111.2	F240 K242 I252 T253 H254	F240-D256 HydrophobicContact CD1-CB 4.28Å; F240-D256 HydrophobicContact CE1-CB 3.85Å; F240-D256 VanDerWaalsContact CE1-O 3.31Å; F240-D256 WeakPolarHBondContact CE1-O 3.25Å; F240-D256 HydrophobicContact CZ-CB 3.97Å; K242-D256 IonicContact NZ-OD1 2.71Å; I252-D256 HydrophobicContact CG2-CB 3.85Å; T253-D256 PolarHBondContact N-OD2 2.91Å; T253-D256 PolarHBondContact O-N 3.11Å; T253-D256 VanDerWaalsContact O-N 3.07Å; T253-D256 PolarHBondContact OG1-OD2 3.48Å; H254-D256 VanDerWaalsContact C-N 3.31Å
257	A	88.8	Confident	90.5	Very high	19 Å²	19	49.8 Å²	49.8	16%	0.157	26%	0.258	C	S	.	.			trans	-162.1	149.8	175.6	0	0	0	0	0	113.5	L222 F240 T253 H254 Y259	L222-A257 WeakPolarHBondContact CB-O 3.48Å; L222-A257 WeakPolarHBondContact CD1-O 3.43Å; F240-A257 HydrophobicContact CE1-CB 4.13Å; F240-A257 HydrophobicContact CZ-CB 4.3Å; T253-A257 PolarHBondContact O-N 3.27Å; H254-A257 WeakPolarHBondContact CA-O 3.49Å; A257-Y259 WeakPolarHBondContact CB-O 3.41Å; A257-Y259 PolarHBondContact O-N 2.94Å
258	E	89.3	Confident	90.6	Very high	138 Å²	138	52 Å²	52	65%	0.645	26%	0.256	S	S	*	.	S	Bend	trans	-63.2	-29.6	170.6	-62.1	179.3	176.6	0	0	113.3	L222	L222-E258 PolarHBondContact N-O 3.47Å
259	Y	90	Very high	90.6	Very high	84 Å²	84	52 Å²	52	33%	0.329	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	148.8	177	64.6	-93.2	0	0	0	111.1	A219 I220 A257	A219-Y259 HydrophobicContact CB-CD2 3.62Å; A219-Y259 HydrophobicContact CB-CE2 4.45Å; A219-Y259 HydrophobicContact CB-CG 4.14Å; I220-Y259 CarbonylContact O-C 3.58Å; I220-Y259 VanDerWaalsContact O-CA 3.24Å; I220-Y259 WeakPolarHBondContact O-CA 3.37Å; A257-Y259 WeakPolarHBondContact CB-O 3.41Å; A257-Y259 PolarHBondContact O-N 2.94Å
260	H	92.1	Very high	90.6	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.9	175.7	-166.1	60	0	0	0	111.7	A219 I220 L222 I228 I252 E266	A219-H260 WeakPolarHBondContact CA-O 3.42Å; I220-H260 PolarHBondContact N-O 3.12Å; I220-H260 PolarHBondContact O-N 3.27Å; L222-H260 HydrophobicContact CD1-CB 4.24Å; I228-H260 HydrophobicContact CD1-CB 3.81Å; I252-H260 HydrophobicContact CD1-CB 4.5Å; H260-E266 IonicContact CD2-OE2 3.84Å; H260-E266 IonicContact CE1-OE2 2.74Å; H260-E266 PolarHBondContact CE1-OE2 3.44Å; H260-E266 IonicContact NE2-OE1 3.65Å; H260-E266 IonicContact NE2-OE2 2.69Å; H260-E266 PolarHBondContact NE2-OE2 3.35Å
261	I	91.5	Very high	90.6	Very high	22 Å²	22	57.6 Å²	57.6	11%	0.113	28%	0.281	C	S	.	.			trans	-109	117.4	167.3	-55.7	170.4	0	0	0	105.5	A174 L198 T200 R217 A219 S263	A174-I261 HydrophobicContact CB-CD1 4.37Å; A174-I261 HydrophobicContact CB-CG2 4.08Å; L198-I261 HydrophobicContact CD2-CB 4.38Å; L198-I261 HydrophobicContact CD2-CG2 3.81Å; T200-I261 HydrophobicContact CG2-CD1 4.47Å; R217-I261 HydrophobicContact CB-CG2 3.91Å; A219-I261 HydrophobicContact CB-CD1 4.26Å; A219-I261 HydrophobicContact CB-CG1 3.56Å; I261-S263 PolarHBondContact O-N 2.99Å
262	C	90.9	Very high	90.6	Very high	13 Å²	13	56.6 Å²	56.6	9%	0.088	28%	0.277	C	S	.	.			trans	-60.4	124.2	-179	-63.8	0	0	0	0	110.1	R217 E266	R217-C262 VanDerWaalsContact CD-O 3.22Å; R217-C262 WeakPolarHBondContact CD-O 3.49Å; R217-C262 PolarHBondContact NH1-O 3.03Å; C262-E266 WeakPolarHBondContact CA-OE2 3.38Å; C262-E266 HydrophobicContact CB-CB 4.21Å
263	S	87.6	Confident	90.6	Very high	37 Å²	37	63.9 Å²	63.9	26%	0.259	31%	0.311	S	S	.	.			trans	-61.2	160.1	174.3	-178.9	0	0	0	0	111.8	R217 I261 L265 E266	R217-S263 PolarHBondContact NH1-O 3.36Å; I261-S263 PolarHBondContact O-N 2.99Å; S263-L265 PolarHBondContact O-N 3.06Å; S263-E266 PolarHBondContact N-OE2 3.13Å; S263-E266 WeakPolarHBondContact O-CA 3.17Å; S263-E266 PolarHBondContact O-N 3.06Å
264	A	85.4	Confident	90.6	Very high	16 Å²	16	64.1 Å²	64.1	13%	0.132	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-17.5	175.4	0	0	0	0	0	114	V176 R196	V176-A264 HydrophobicContact CG1-CB 4.15Å; R196-A264 HydrophobicContact CB-CB 3.85Å
265	L	89.2	Confident	90.7	Very high	55 Å²	55	60.7 Å²	60.7	29%	0.288	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	2.6	175.5	-53.3	-178.2	0	0	0	113.4	V233 K234 H236 S263	V233-L265 PolarHBondContact N-O 3.4Å; K234-L265 HydrophobicContact CB-CD2 4.39Å; K234-L265 HydrophobicContact CD-CD2 4.33Å; H236-L265 HydrophobicContact CB-CD1 3.64Å; H236-L265 PolarHBondContact CE1-O 3.39Å; S263-L265 PolarHBondContact O-N 3.06Å
266	E	92.1	Very high	90.8	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.019	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	140.7	179.1	-64.3	168.6	176.4	0	0	110.9	R217 K231 H236 W250 H260 C262 S263	R217-E266 PolarHBondContact NH1-O 3Å; R217-E266 VanDerWaalsContact NH1-O 3.16Å; K231-E266 CarbonylContact O-C 3.56Å; K231-E266 WeakPolarHBondContact O-CA 3.5Å; H236-E266 IonicContact NE2-OE1 2.7Å; W250-E266 HydrophobicContact CH2-CG 4.23Å; W250-E266 HydrophobicContact CZ2-CG 4.3Å; H260-E266 IonicContact CD2-OE2 3.84Å; H260-E266 IonicContact CE1-OE2 2.74Å; H260-E266 PolarHBondContact CE1-OE2 3.44Å; H260-E266 IonicContact NE2-OE1 3.65Å; H260-E266 IonicContact NE2-OE2 2.69Å; H260-E266 PolarHBondContact NE2-OE2 3.35Å; C262-E266 WeakPolarHBondContact CA-OE2 3.38Å; C262-E266 HydrophobicContact CB-CB 4.21Å; S263-E266 PolarHBondContact N-OE2 3.13Å; S263-E266 WeakPolarHBondContact O-CA 3.17Å; S263-E266 PolarHBondContact O-N 3.06Å
267	E	91	Very high	91	Very high	102 Å²	102	53.7 Å²	53.7	48%	0.477	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.1	173.5	176.9	175.9	-145.5	0	0	109.2	V230 K231 V233	V230-E267 CarbonylContact C-O 3.56Å; V230-E267 VanDerWaalsContact CA-O 3.31Å; V230-E267 WeakPolarHBondContact CA-O 3.4Å; K231-E267 HydrophobicContact CB-CB 4.38Å; K231-E267 PolarHBondContact N-O 3.39Å; K231-E267 PolarHBondContact O-N 2.91Å; V233-E267 HydrophobicContact CG2-CB 3.81Å
268	F	90.8	Very high	91.1	Very high	90 Å²	90	54.1 Å²	54.1	40%	0.395	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	123.1	172.1	171.1	-96.7	0	0	0	109.5	I220 I228 R270 E271	I220-F268 HydrophobicContact CD1-CD2 3.49Å; I220-F268 VanDerWaalsContact CD1-CD2 3.49Å; I220-F268 HydrophobicContact CD1-CE2 3.67Å; I220-F268 HydrophobicContact CD1-CG 4.26Å; I228-F268 HydrophobicContact CB-CD2 4.39Å; I228-F268 HydrophobicContact CB-CE2 4.08Å; I228-F268 HydrophobicContact CG2-CD2 4.45Å; I228-F268 HydrophobicContact CG2-CE2 3.82Å; F268-R270 VanDerWaalsContact CZ-C 3.43Å; F268-E271 HydrophobicContact CZ-CB 4.42Å
269	V	91.4	Very high	91.1	Very high	55 Å²	55	51.8 Å²	51.8	33%	0.333	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-57.3	-179.3	-177.1	0	0	0	0	110.8	C229 K231 E249	C229-V269 HydrophobicContact CB-CB 4.24Å; C229-V269 WeakPolarHBondContact O-CB 3.24Å; C229-V269 PolarHBondContact O-N 3.47Å; K231-V269 HydrophobicContact CB-CG2 3.55Å; K231-V269 HydrophobicContact CD-CG2 4.32Å; E249-V269 HydrophobicContact CG-CG2 4.3Å
270	R	92.1	Very high	91.1	Very high	108 Å²	108	52 Å²	52	41%	0.408	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	158.7	-177.4	62.8	-178.3	-175.3	-171.5	6.3	111.7	C229 F268 V272	C229-R270 HydrophobicContact CB-CG 3.77Å; C229-R270 PolarHBondContact N-O 2.72Å; C229-R270 PolarHBondContact O-N 3.26Å; F268-R270 VanDerWaalsContact CZ-C 3.43Å; R270-V272 HydrophobicContact CG-CG2 4.34Å
271	E	91.9	Very high	91.2	Very high	78 Å²	78	54.6 Å²	54.6	36%	0.364	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	149	163.1	-159.2	170.8	144.8	0	0	109.9	R226 F268	R226-E271 IonicContact CZ-OE1 3.73Å; R226-E271 IonicContact CZ-OE2 2.99Å; R226-E271 IonicContact NE-OE1 3.54Å; R226-E271 PolarHBondContact NE-OE1 3.17Å; R226-E271 IonicContact NH2-OE1 3.3Å; R226-E271 PolarHBondContact NH2-OE1 3Å; R226-E271 IonicContact NH2-OE2 3.06Å; R226-E271 PolarHBondContact NH2-OE2 2.98Å; F268-E271 HydrophobicContact CZ-CB 4.42Å
272	V	91.7	Very high	91.3	Very high	12 Å²	12	53.7 Å²	53.7	7%	0.073	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	113.2	178.6	-175.9	0	0	0	0	108.3	A227 C229 L251 R270 F310	A227-V272 HydrophobicContact CB-CB 4.41Å; A227-V272 PolarHBondContact N-O 3.38Å; A227-V272 PolarHBondContact O-N 3.24Å; C229-V272 HydrophobicContact CB-CG2 4.13Å; L251-V272 HydrophobicContact CD1-CB 3.82Å; L251-V272 HydrophobicContact CD1-CG1 4.11Å; L251-V272 HydrophobicContact CD1-CG2 3.71Å; R270-V272 HydrophobicContact CG-CG2 4.34Å; V272-F310 HydrophobicContact CG1-CB 4.24Å; V272-F310 HydrophobicContact CG1-CD1 4.19Å; V272-F310 WeakPolarHBondContact O-CD1 3.17Å; V272-F310 WeakPolarHBondContact O-CE1 3.15Å
273	E	92.9	Very high	91.5	Very high	154 Å²	154	53.1 Å²	53.1	72%	0.72	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	150.2	173.8	-63	-176.8	169.9	0	0	110.8
274	V	93.6	Very high	91.7	Very high	25 Å²	25	52 Å²	52	15%	0.152	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	131.4	176.4	66.6	0	0	0	0	111.1	R225 I276 F310	R225-V274 HydrophobicContact CB-CG1 3.81Å; R225-V274 HydrophobicContact CG-CG1 3.85Å; R225-V274 PolarHBondContact O-N 3.09Å; R225-V274 VanDerWaalsContact O-N 3.16Å; V274-I276 HydrophobicContact CG1-CD1 3.94Å; V274-I276 HydrophobicContact CG1-CG1 3.79Å; V274-I276 HydrophobicContact CG2-CG1 4.28Å; V274-F310 HydrophobicContact CB-CD1 4.06Å; V274-F310 HydrophobicContact CB-CE1 3.65Å; V274-F310 HydrophobicContact CB-CZ 3.93Å; V274-F310 HydrophobicContact CG2-CE1 4.41Å; V274-F310 HydrophobicContact CG2-CZ 4.39Å
275	T	92.6	Very high	92.1	Very high	17 Å²	17	51.3 Å²	51.3	10%	0.104	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	118.3	166.2	-59	0	0	0	0	108.2	S308 F309 L317 V321	T275-S308 WeakPolarHBondContact O-CA 3.44Å; T275-F309 WeakPolarHBondContact CA-O 3.47Å; T275-F309 WeakPolarHBondContact CB-O 3.45Å; T275-F309 HydrophobicContact CG2-CE1 4.05Å; T275-F309 HydrophobicContact CG2-CZ 3.96Å; T275-F309 PolarHBondContact N-O 3.5Å; T275-F309 PolarHBondContact O-N 3.01Å; T275-L317 HydrophobicContact CG2-CD1 4.04Å; T275-V321 HydrophobicContact CG2-CG2 4.04Å
276	I	92.8	Very high	92.3	Very high	96 Å²	96	50.3 Å²	50.3	49%	0.492	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.1	178.6	-51.9	179.7	0	0	0	108.4	V274	V274-I276 HydrophobicContact CG1-CD1 3.94Å; V274-I276 HydrophobicContact CG1-CG1 3.79Å; V274-I276 HydrophobicContact CG2-CG1 4.28Å
277	L	92.7	Very high	92.4	Very high	2 Å²	2	52 Å²	52	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.9	169.8	-61.5	177.4	0	0	0	108.6	Q281 C283 V303 G305 E306 K307 F309 V321	L277-Q281 HydrophobicContact CB-CB 4.34Å; L277-Q281 HydrophobicContact CD2-CB 4.27Å; L277-C283 HydrophobicContact CD2-CB 4.16Å; L277-V303 HydrophobicContact CD1-CB 4.05Å; L277-V303 HydrophobicContact CD1-CG1 3.68Å; L277-G305 VanDerWaalsContact CB-O 3.28Å; L277-G305 WeakPolarHBondContact CB-O 3.28Å; L277-E306 WeakPolarHBondContact O-CA 3.48Å; L277-K307 PolarHBondContact N-O 3.31Å; L277-K307 PolarHBondContact O-N 3.45Å; L277-K307 VanDerWaalsContact O-N 3.13Å; L277-F309 HydrophobicContact CD1-CE1 4.12Å; L277-F309 HydrophobicContact CG-CE1 4.43Å; L277-V321 HydrophobicContact CD2-CB 4.21Å; L277-V321 HydrophobicContact CD2-CG1 3.58Å; L277-V321 HydrophobicContact CD2-CG2 3.73Å
278	G	91.9	Very high	92.4	Very high	27 Å²	27	47.7 Å²	47.7	28%	0.278	25%	0.245	S	C	.	.			trans	-76.5	177.4	165.4	0	0	0	0	0	113.3	H280 Q281 G305 E306	G278-H280 VanDerWaalsContact C-N 3.3Å; G278-H280 PolarHBondContact O-N 2.86Å; G278-Q281 PolarHBondContact O-N 2.83Å; G278-Q281 VanDerWaalsContact O-N 3.12Å; G278-G305 CarbonylContact O-C 3.59Å; G278-G305 VanDerWaalsContact O-C 3.3Å; G278-E306 PolarHBondContact O-N 3.2Å
279	V	89.3	Confident	92.4	Very high	89 Å²	89	46.2 Å²	46.2	54%	0.539	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-45.2	-178.9	-179.9	0	0	0	0	112.5	E306	V279-E306 HydrophobicContact CG2-CB 4.28Å
280	H	90	Very high	92.1	Very high	90 Å²	90	45.7 Å²	45.7	42%	0.417	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	32	-178.9	-58.6	-62.3	0	0	0	112.6	G278 A324 E376	G278-H280 VanDerWaalsContact C-N 3.3Å; G278-H280 PolarHBondContact O-N 2.86Å; H280-A324 HydrophobicContact CB-CB 4.41Å; H280-A324 WeakPolarHBondContact O-CB 3.26Å; H280-A324 PolarHBondContact O-N 3.07Å; H280-E376 IonicContact CE1-OE1 2.6Å; H280-E376 IonicContact CE1-OE2 3.21Å; H280-E376 PolarHBondContact CE1-OE2 2.88Å; H280-E376 VanDerWaalsContact CE1-OE2 3.29Å; H280-E376 IonicContact CG-OE1 3.22Å; H280-E376 IonicContact ND1-OE1 2.81Å; H280-E376 PolarHBondContact ND1-OE1 3.26Å; H280-E376 IonicContact ND1-OE2 3.68Å; H280-E376 PolarHBondContact ND1-OE2 2.99Å
281	Q	93.2	Very high	91.7	Very high	54 Å²	54	50.1 Å²	50.1	25%	0.252	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	153.6	-179	-76.4	179.7	-22.1	0	0	112.7	L277 G278 R304 G305 V321 Q322 D323	L277-Q281 HydrophobicContact CB-CB 4.34Å; L277-Q281 HydrophobicContact CD2-CB 4.27Å; G278-Q281 PolarHBondContact O-N 2.83Å; G278-Q281 VanDerWaalsContact O-N 3.12Å; Q281-R304 WeakPolarHBondContact O-CA 3.42Å; Q281-G305 PolarHBondContact O-N 3Å; Q281-V321 HydrophobicContact CB-CG1 4.02Å; Q281-V321 HydrophobicContact CG-CG1 4.16Å; Q281-Q322 WeakPolarHBondContact CA-O 3.31Å; Q281-D323 WeakPolarHBondContact CG-OD1 3.45Å; Q281-D323 PolarHBondContact NE2-OD1 3.03Å
282	F	94.3	Very high	91.3	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.018	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	160.9	175.8	75.3	-81.7	0	0	0	111.5	L302 V303 R304 Q322 D323 I378 P379	F282-L302 HydrophobicContact CB-CD1 4.11Å; F282-L302 HydrophobicContact CD2-CD1 3.53Å; F282-L302 HydrophobicContact CE2-CD1 4.37Å; F282-L302 HydrophobicContact CG-CD1 4.21Å; F282-V303 CarbonylContact C-O 3.54Å; F282-V303 WeakPolarHBondContact CA-O 3.32Å; F282-V303 WeakPolarHBondContact CB-O 3.04Å; F282-R304 HydrophobicContact CB-CB 3.87Å; F282-Q322 HydrophobicContact CD1-CB 4.21Å; F282-Q322 WeakPolarHBondContact CD1-O 3.43Å; F282-Q322 HydrophobicContact CE1-CB 3.71Å; F282-Q322 HydrophobicContact CE2-CB 4.28Å; F282-Q322 HydrophobicContact CZ-CB 3.75Å; F282-Q322 PolarHBondContact N-O 2.98Å; F282-Q322 PolarHBondContact O-N 3.43Å; F282-D323 WeakPolarHBondContact CE1-O 3.37Å; F282-I378 HydrophobicContact CB-CD1 4.38Å; F282-I378 HydrophobicContact CB-CG2 3.8Å; F282-I378 HydrophobicContact CD1-CG1 4.17Å; F282-I378 HydrophobicContact CD1-CG2 3.84Å; F282-I378 HydrophobicContact CD2-CG2 3.94Å; F282-I378 HydrophobicContact CE1-CG2 4.38Å; F282-I378 HydrophobicContact CE2-CG2 4.47Å; F282-I378 HydrophobicContact CG-CG2 3.59Å; F282-P379 HydrophobicContact CE2-CG 4.12Å; F282-P379 HydrophobicContact CZ-CG 3.8Å
283	C	94.2	Very high	90.7	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	161.1	167	68	0	0	0	0	110	L277 V303 L317 G320 V321	L277-C283 HydrophobicContact CD2-CB 4.16Å; C283-V303 PolarHBondContact N-O 3.41Å; C283-V303 PolarHBondContact O-N 3.21Å; C283-L317 HydrophobicContact CB-CD2 4Å; C283-G320 WeakPolarHBondContact CB-O 3.49Å; C283-V321 HydrophobicContact CB-CG2 4.47Å
284	V	93.4	Very high	90.3	Very high	13 Å²	13	50.2 Å²	50.2	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	111.3	175.1	-179.4	0	0	0	0	107.9	K300 L301 L302 L317 E318	V284-K300 HydrophobicContact CG1-CB 3.77Å; V284-K300 HydrophobicContact CG1-CD 4.15Å; V284-K300 HydrophobicContact CG1-CG 4.13Å; V284-L301 WeakPolarHBondContact CA-O 3.2Å; V284-L302 HydrophobicContact CG2-CD1 4.16Å; V284-L317 WeakPolarHBondContact O-CA 3.41Å; V284-E318 HydrophobicContact CB-CB 4.29Å; V284-E318 HydrophobicContact CG1-CB 4.47Å; V284-E318 PolarHBondContact O-N 2.84Å
285	V	94	Very high	90	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.018	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	123.4	176.6	-176.4	0	0	0	0	108.6	P288 K300 L301 V303 F309 L311 E315 L317	V285-P288 HydrophobicContact CG1-CB 4.41Å; V285-K300 CarbonylContact O-C 3.56Å; V285-K300 WeakPolarHBondContact O-CA 3.41Å; V285-L301 HydrophobicContact CB-CB 4.45Å; V285-L301 PolarHBondContact N-O 2.95Å; V285-L301 PolarHBondContact O-N 2.79Å; V285-V303 HydrophobicContact CG2-CG2 3.99Å; V285-F309 HydrophobicContact CG2-CE2 3.99Å; V285-F309 HydrophobicContact CG2-CZ 4.04Å; V285-L311 HydrophobicContact CG1-CD2 4.33Å; V285-L311 HydrophobicContact CG2-CD2 4.48Å; V285-E315 HydrophobicContact CG1-CB 3.95Å; V285-E315 HydrophobicContact CG1-CG 4.05Å; V285-L317 HydrophobicContact CG2-CD2 3.95Å
286	V	93.2	Very high	89.9	Confident	33 Å²	33	53 Å²	53	20%	0.2	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	140.4	175.9	-172.4	0	0	0	0	109	E315 C316 E318	V286-E315 WeakPolarHBondContact O-CA 3.32Å; V286-C316 PolarHBondContact N-O 3.16Å; V286-C316 PolarHBondContact O-N 3.32Å; V286-E318 HydrophobicContact CG2-CB 3.72Å; V286-E318 HydrophobicContact CG2-CG 4.31Å
287	N	93.3	Very high	89.7	Confident	39 Å²	39	55.2 Å²	55.2	21%	0.209	30%	0.301	C	S	.	.	S	Bend	trans	59.4	43	-174	-47.7	-40.3	0	0	0	114.7	Q296 L297 G298 R299 G314	N287-Q296 WeakPolarHBondContact CA-O 3.34Å; N287-L297 HydrophobicContact CB-CD2 4.22Å; N287-L297 WeakPolarHBondContact OD1-CA 3.36Å; N287-G298 PolarHBondContact OD1-N 3.49Å; N287-R299 PolarHBondContact N-O 3.37Å; N287-G314 PolarHBondContact ND2-O 3.26Å
288	P	92.2	Very high	89.3	Confident	12 Å²	12	58.1 Å²	58.1	8%	0.078	33%	0.332	C	S	.	.			trans	-60	145.8	-176.7	30.5	-37.6	0	0	0	111.4	V285 Q296 R299 L301 E315	V285-P288 HydrophobicContact CG1-CB 4.41Å; P288-Q296 HydrophobicContact CG-CB 4.49Å; P288-Q296 WeakPolarHBondContact O-CB 3.07Å; P288-Q296 WeakPolarHBondContact O-CG 3.45Å; P288-Q296 PolarHBondContact O-N 2.97Å; P288-R299 WeakPolarHBondContact CD-O 3.48Å; P288-R299 HydrophobicContact CG-CB 4.31Å; P288-L301 HydrophobicContact CB-CB 3.83Å; P288-L301 HydrophobicContact CB-CD2 4.06Å; P288-L301 HydrophobicContact CG-CB 3.86Å; P288-E315 WeakPolarHBondContact CA-OE1 3.38Å
289	W	89.6	Confident	89.3	Confident	59 Å²	59	64.8 Å²	64.8	22%	0.223	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-76.3	143.7	173.6	-71.5	43.2	0	0	0	111.2	G293 P295 R312 P313 E315	W289-G293 VanDerWaalsContact CE3-C 3.44Å; W289-G293 WeakPolarHBondContact CZ3-O 3.15Å; W289-P295 HydrophobicContact CD2-CG 4.32Å; W289-P295 HydrophobicContact CZ2-CG 4.02Å; W289-R312 VanDerWaalsContact CB-NH1 3.31Å; W289-R312 HydrophobicContact CD2-CB 4.07Å; W289-R312 HydrophobicContact CG-CB 4.04Å; W289-R312 VanDerWaalsContact CG-CD 3.49Å; W289-R312 HydrophobicContact CG-CG 4.43Å; W289-R312 HydrophobicContact CZ2-CB 4.49Å; W289-P313 HydrophobicContact CZ2-CB 4.23Å; W289-P313 HydrophobicContact CZ2-CG 4.37Å; W289-P313 PolarHBondContact NE1-O 3.44Å; W289-E315 PolarHBondContact N-OE1 3.18Å
290	D	85.8	Confident	89.4	Confident	44 Å²	44	64.2 Å²	64.2	24%	0.235	34%	0.339	C	S	.	.			trans	-80.7	178.8	171.1	78.1	-8.4	0	0	0	112.8	N292 G293 V294 Q296	D290-N292 PolarHBondContact O-N 2.92Å; D290-N292 WeakPolarHBondContact OD1-CA 3.33Å; D290-N292 WeakPolarHBondContact OD1-CB 3.5Å; D290-N292 PolarHBondContact OD1-N 2.96Å; D290-N292 PolarHBondContact OD2-ND2 3.47Å; D290-G293 PolarHBondContact O-N 2.97Å; D290-G293 VanDerWaalsContact O-N 3.1Å; D290-G293 PolarHBondContact OD1-N 3.4Å; D290-V294 PolarHBondContact N-O 2.88Å; D290-V294 PolarHBondContact OD1-N 2.82Å; D290-Q296 HydrophobicContact CB-CG 4.09Å
291	E	83.2	Confident	89.4	Confident	202 Å²	202	64.2 Å²	64.2	94%	0.944	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-24	177	-63.3	178.4	178.3	0	0	113	G293	E291-G293 VanDerWaalsContact C-N 3.32Å
292	N	83.5	Confident	89.4	Confident	140 Å²	140	63.8 Å²	63.8	75%	0.749	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-6.5	177.3	-53.2	-68.2	0	0	0	112.9	D290 V294	D290-N292 PolarHBondContact O-N 2.92Å; D290-N292 WeakPolarHBondContact OD1-CA 3.33Å; D290-N292 WeakPolarHBondContact OD1-CB 3.5Å; D290-N292 PolarHBondContact OD1-N 2.96Å; D290-N292 PolarHBondContact OD2-ND2 3.47Å; N292-V294 HydrophobicContact CB-CG2 4.43Å
293	G	78.6	Confident	89.3	Confident	30 Å²	30	64.5 Å²	64.5	31%	0.309	35%	0.345	S	S	.	.	S	Bend	trans	83.2	31.3	-177.3	0	0	0	0	0	114.4	W289 D290 E291	W289-G293 VanDerWaalsContact CE3-C 3.44Å; W289-G293 WeakPolarHBondContact CZ3-O 3.15Å; D290-G293 PolarHBondContact O-N 2.97Å; D290-G293 VanDerWaalsContact O-N 3.1Å; D290-G293 PolarHBondContact OD1-N 3.4Å; E291-G293 VanDerWaalsContact C-N 3.32Å
294	V	85.3	Confident	89.1	Confident	76 Å²	76	72 Å²	72	46%	0.461	37%	0.373	S	S	.	.			trans	-112.1	124.9	179.2	-176.1	0	0	0	0	110.8	D290 N292 Q296	D290-V294 PolarHBondContact N-O 2.88Å; D290-V294 PolarHBondContact OD1-N 2.82Å; N292-V294 HydrophobicContact CB-CG2 4.43Å; V294-Q296 PolarHBondContact O-N 2.76Å; V294-Q296 PolarHBondContact O-NE2 2.9Å
295	P	86.5	Confident	88.8	Confident	50 Å²	50	72.3 Å²	72.3	33%	0.325	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-61.7	123.4	176.4	-18.6	27.8	0	0	0	112.8	W289 L297	W289-P295 HydrophobicContact CD2-CG 4.32Å; W289-P295 HydrophobicContact CZ2-CG 4.02Å; P295-L297 PolarHBondContact O-N 2.94Å; P295-L297 VanDerWaalsContact O-N 3.16Å
296	Q	90.8	Very high	88.6	Confident	50 Å²	50	79.8 Å²	79.8	23%	0.234	41%	0.414	C	S	.	.			trans	-89.1	77.1	-179.6	-57.5	-61	-58.3	0	0	110.9	N287 P288 D290 V294 G298 R299	N287-Q296 WeakPolarHBondContact CA-O 3.34Å; P288-Q296 HydrophobicContact CG-CB 4.49Å; P288-Q296 WeakPolarHBondContact O-CB 3.07Å; P288-Q296 WeakPolarHBondContact O-CG 3.45Å; P288-Q296 PolarHBondContact O-N 2.97Å; D290-Q296 HydrophobicContact CB-CG 4.09Å; V294-Q296 PolarHBondContact O-N 2.76Å; V294-Q296 PolarHBondContact O-NE2 2.9Å; Q296-G298 PolarHBondContact O-N 3.1Å; Q296-R299 HydrophobicContact CB-CB 3.98Å; Q296-R299 HydrophobicContact CB-CG 4.1Å; Q296-R299 WeakPolarHBondContact O-CB 3.38Å; Q296-R299 PolarHBondContact O-N 2.89Å
297	L	88.6	Confident	88.5	Confident	142 Å²	142	83.8 Å²	83.8	74%	0.743	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	131.1	-175.4	-61.6	-179.2	0	0	0	112.8	N287 P295 R299	N287-L297 HydrophobicContact CB-CD2 4.22Å; N287-L297 WeakPolarHBondContact OD1-CA 3.36Å; P295-L297 PolarHBondContact O-N 2.94Å; P295-L297 VanDerWaalsContact O-N 3.16Å; L297-R299 PolarHBondContact O-N 2.61Å
298	G	85.3	Confident	88.4	Confident	64 Å²	64	86 Å²	86	66%	0.66	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-13.2	-178.7	0	0	0	0	0	115.2	N287 Q296	N287-G298 PolarHBondContact OD1-N 3.49Å; Q296-G298 PolarHBondContact O-N 3.1Å
299	R	90.7	Very high	88.4	Confident	167 Å²	167	87.7 Å²	87.7	63%	0.63	45%	0.454	S	S	*	.			trans	-74.6	157.2	171.1	-67.7	-161	174	-172	-1.9	111.3	N287 P288 Q296 L297	N287-R299 PolarHBondContact N-O 3.37Å; P288-R299 WeakPolarHBondContact CD-O 3.48Å; P288-R299 HydrophobicContact CG-CB 4.31Å; Q296-R299 HydrophobicContact CB-CB 3.98Å; Q296-R299 HydrophobicContact CB-CG 4.1Å; Q296-R299 WeakPolarHBondContact O-CB 3.38Å; Q296-R299 PolarHBondContact O-N 2.89Å; L297-R299 PolarHBondContact O-N 2.61Å
300	K	90.9	Very high	88.6	Confident	77 Å²	77	86.5 Å²	86.5	34%	0.335	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.9	178.7	-67.9	-179.9	177	-164.1	0	109.3	V284 V285 E318 V381	V284-K300 HydrophobicContact CG1-CB 3.77Å; V284-K300 HydrophobicContact CG1-CD 4.15Å; V284-K300 HydrophobicContact CG1-CG 4.13Å; V285-K300 CarbonylContact O-C 3.56Å; V285-K300 WeakPolarHBondContact O-CA 3.41Å; K300-E318 VanDerWaalsContact CE-OE2 3.28Å; K300-E318 WeakPolarHBondContact CE-OE2 3.25Å; K300-E318 IonicContact NZ-OE1 2.79Å; K300-E318 PolarHBondContact NZ-OE1 3.34Å; K300-E318 IonicContact NZ-OE2 2.76Å; K300-E318 PolarHBondContact NZ-OE2 2.9Å; K300-V381 HydrophobicContact CB-CG1 3.69Å; K300-V381 HydrophobicContact CB-CG2 4.34Å; K300-V381 HydrophobicContact CD-CG1 3.72Å; K300-V381 HydrophobicContact CG-CG1 4.35Å
301	L	91.8	Very high	88.9	Confident	90 Å²	90	85.8 Å²	85.8	47%	0.471	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	118.2	176.6	175.3	65.3	0	0	0	109.3	V284 V285 P288 V303	V284-L301 WeakPolarHBondContact CA-O 3.2Å; V285-L301 HydrophobicContact CB-CB 4.45Å; V285-L301 PolarHBondContact N-O 2.95Å; V285-L301 PolarHBondContact O-N 2.79Å; P288-L301 HydrophobicContact CB-CB 3.83Å; P288-L301 HydrophobicContact CB-CD2 4.06Å; P288-L301 HydrophobicContact CG-CB 3.86Å; L301-V303 HydrophobicContact CD2-CG2 4.27Å; L301-V303 HydrophobicContact CG-CG2 4.13Å; L301-V303 PolarHBondContact O-N 2.99Å
302	L	92.6	Very high	89.3	Confident	45 Å²	45	81.4 Å²	81.4	24%	0.236	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	117.5	171.7	175.3	62.6	0	0	0	109.7	F282 V284 I378 V381	F282-L302 HydrophobicContact CB-CD1 4.11Å; F282-L302 HydrophobicContact CD2-CD1 3.53Å; F282-L302 HydrophobicContact CE2-CD1 4.37Å; F282-L302 HydrophobicContact CG-CD1 4.21Å; V284-L302 HydrophobicContact CG2-CD1 4.16Å; L302-I378 HydrophobicContact CD1-CG2 4.04Å; L302-I378 HydrophobicContact CD2-CG2 4.15Å; L302-V381 HydrophobicContact CB-CG2 4.02Å
303	V	92.8	Very high	89.6	Confident	18 Å²	18	75.2 Å²	75.2	11%	0.109	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	131.1	172	-169	0	0	0	0	107.9	L277 F282 C283 V285 L301 K307 F309	L277-V303 HydrophobicContact CD1-CB 4.05Å; L277-V303 HydrophobicContact CD1-CG1 3.68Å; F282-V303 CarbonylContact C-O 3.54Å; F282-V303 WeakPolarHBondContact CA-O 3.32Å; F282-V303 WeakPolarHBondContact CB-O 3.04Å; C283-V303 PolarHBondContact N-O 3.41Å; C283-V303 PolarHBondContact O-N 3.21Å; V285-V303 HydrophobicContact CG2-CG2 3.99Å; L301-V303 HydrophobicContact CD2-CG2 4.27Å; L301-V303 HydrophobicContact CG-CG2 4.13Å; L301-V303 PolarHBondContact O-N 2.99Å; V303-K307 HydrophobicContact CG1-CD 3.85Å; V303-F309 HydrophobicContact CB-CE1 4.36Å; V303-F309 HydrophobicContact CB-CZ 4.41Å; V303-F309 HydrophobicContact CG1-CD1 4.5Å; V303-F309 HydrophobicContact CG1-CE1 3.86Å; V303-F309 HydrophobicContact CG1-CZ 4.35Å; V303-F309 HydrophobicContact CG2-CZ 4.29Å
304	R	89.4	Confident	90	Very high	157 Å²	157	76 Å²	76	59%	0.592	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.7	156.4	-175.6	64.1	177.3	-176.9	-178.2	1.2	112.6	Q281 F282 I378	Q281-R304 WeakPolarHBondContact O-CA 3.42Å; F282-R304 HydrophobicContact CB-CB 3.87Å; R304-I378 HydrophobicContact CB-CD1 3.89Å; R304-I378 HydrophobicContact CB-CG2 4.49Å
305	G	86.1	Confident	90.3	Very high	20 Å²	20	73.3 Å²	73.3	21%	0.206	38%	0.379	C	S	.	.	S	Bend	trans	78.4	177.4	179.5	0	0	0	0	0	113	L277 G278 Q281 K307	L277-G305 VanDerWaalsContact CB-O 3.28Å; L277-G305 WeakPolarHBondContact CB-O 3.28Å; G278-G305 CarbonylContact O-C 3.59Å; G278-G305 VanDerWaalsContact O-C 3.3Å; Q281-G305 PolarHBondContact O-N 3Å; G305-K307 PolarHBondContact O-N 3.47Å
306	E	90.9	Very high	90.6	Very high	160 Å²	160	74.4 Å²	74.4	75%	0.748	39%	0.387	S	S	*	.	S	Bend	trans	-59	103.2	-175.1	-171.2	175.6	-173.3	0	0	112	L277 G278 V279	L277-E306 WeakPolarHBondContact O-CA 3.48Å; G278-E306 PolarHBondContact O-N 3.2Å; V279-E306 HydrophobicContact CG2-CB 4.28Å
307	K	91.1	Very high	90.7	Very high	117 Å²	117	74.1 Å²	74.1	51%	0.509	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	138.7	-177.3	-69.8	-168.8	176.9	-171.6	0	111.1	L277 V303 G305	L277-K307 PolarHBondContact N-O 3.31Å; L277-K307 PolarHBondContact O-N 3.45Å; L277-K307 VanDerWaalsContact O-N 3.13Å; V303-K307 HydrophobicContact CG1-CD 3.85Å; G305-K307 PolarHBondContact O-N 3.47Å
308	S	90.5	Very high	90.8	Very high	87 Å²	87	71.4 Å²	71.4	61%	0.608	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.9	165.5	48.1	0	0	0	0	109.7	T275	T275-S308 WeakPolarHBondContact O-CA 3.44Å
309	F	92.7	Very high	91	Very high	46 Å²	46	75.1 Å²	75.1	20%	0.202	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	155.9	175.4	65.4	-80.7	0	0	0	111.3	T275 L277 V285 V303 L311	T275-F309 WeakPolarHBondContact CA-O 3.47Å; T275-F309 WeakPolarHBondContact CB-O 3.45Å; T275-F309 HydrophobicContact CG2-CE1 4.05Å; T275-F309 HydrophobicContact CG2-CZ 3.96Å; T275-F309 PolarHBondContact N-O 3.5Å; T275-F309 PolarHBondContact O-N 3.01Å; L277-F309 HydrophobicContact CD1-CE1 4.12Å; L277-F309 HydrophobicContact CG-CE1 4.43Å; V285-F309 HydrophobicContact CG2-CE2 3.99Å; V285-F309 HydrophobicContact CG2-CZ 4.04Å; V303-F309 HydrophobicContact CB-CE1 4.36Å; V303-F309 HydrophobicContact CB-CZ 4.41Å; V303-F309 HydrophobicContact CG1-CD1 4.5Å; V303-F309 HydrophobicContact CG1-CE1 3.86Å; V303-F309 HydrophobicContact CG1-CZ 4.35Å; V303-F309 HydrophobicContact CG2-CZ 4.29Å; F309-L311 HydrophobicContact CE2-CD2 4.06Å
310	F	93.6	Very high	91	Very high	34 Å²	34	68.5 Å²	68.5	15%	0.149	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	142.3	173.6	-65	-81.2	0	0	0	110.4	D224 A227 L251 T253 V272 V274 R312	D224-F310 WeakPolarHBondContact O-CZ 3.29Å; A227-F310 HydrophobicContact CB-CB 4.46Å; A227-F310 HydrophobicContact CB-CD1 3.47Å; A227-F310 VanDerWaalsContact CB-CD1 3.47Å; A227-F310 HydrophobicContact CB-CD2 4.06Å; A227-F310 HydrophobicContact CB-CE1 3.51Å; A227-F310 HydrophobicContact CB-CE2 4.11Å; A227-F310 HydrophobicContact CB-CG 3.74Å; A227-F310 HydrophobicContact CB-CZ 3.84Å; L251-F310 HydrophobicContact CD1-CB 4.5Å; L251-F310 HydrophobicContact CD2-CB 3.4Å; L251-F310 HydrophobicContact CD2-CD2 4.48Å; L251-F310 HydrophobicContact CD2-CG 4.13Å; T253-F310 HydrophobicContact CG2-CD2 3.93Å; T253-F310 HydrophobicContact CG2-CE2 4.31Å; V272-F310 HydrophobicContact CG1-CB 4.24Å; V272-F310 HydrophobicContact CG1-CD1 4.19Å; V272-F310 WeakPolarHBondContact O-CD1 3.17Å; V272-F310 WeakPolarHBondContact O-CE1 3.15Å; V274-F310 HydrophobicContact CB-CD1 4.06Å; V274-F310 HydrophobicContact CB-CE1 3.65Å; V274-F310 HydrophobicContact CB-CZ 3.93Å; V274-F310 HydrophobicContact CG2-CE1 4.41Å; V274-F310 HydrophobicContact CG2-CZ 4.39Å; F310-R312 PolarHBondContact O-N 3.09Å
311	L	92.7	Very high	91.1	Very high	30 Å²	30	67.5 Å²	67.5	16%	0.157	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-71.7	127.3	173.1	-66.5	171.4	0	0	0	110.2	V285 F309 E315 L317	V285-L311 HydrophobicContact CG1-CD2 4.33Å; V285-L311 HydrophobicContact CG2-CD2 4.48Å; F309-L311 HydrophobicContact CE2-CD2 4.06Å; L311-E315 HydrophobicContact CB-CB 4.3Å; L311-E315 HydrophobicContact CD2-CB 4.13Å; L311-L317 HydrophobicContact CD1-CG 4.21Å; L311-L317 HydrophobicContact CD2-CD2 3.91Å; L311-L317 HydrophobicContact CD2-CG 4.39Å
312	R	90.9	Very high	91.1	Very high	109 Å²	109	65.3 Å²	65.3	41%	0.411	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-73	164	175.1	-64.1	179.5	171.6	-173.8	0.3	111	W289 F310 G314 E315	W289-R312 VanDerWaalsContact CB-NH1 3.31Å; W289-R312 HydrophobicContact CD2-CB 4.07Å; W289-R312 HydrophobicContact CG-CB 4.04Å; W289-R312 VanDerWaalsContact CG-CD 3.49Å; W289-R312 HydrophobicContact CG-CG 4.43Å; W289-R312 HydrophobicContact CZ2-CB 4.49Å; F310-R312 PolarHBondContact O-N 3.09Å; R312-G314 PolarHBondContact O-N 3.05Å; R312-E315 HydrophobicContact CB-CG 4.13Å; R312-E315 PolarHBondContact N-OE2 3.2Å; R312-E315 WeakPolarHBondContact O-CB 3.45Å; R312-E315 PolarHBondContact O-N 3.23Å
313	P	89.3	Confident	91.1	Very high	11 Å²	11	68.3 Å²	68.3	7%	0.071	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	130.8	177.3	-25.3	36.3	0	0	0	111.6	E249 W289 E315	E249-P313 HydrophobicContact CB-CB 3.86Å; E249-P313 HydrophobicContact CB-CG 4.05Å; W289-P313 HydrophobicContact CZ2-CB 4.23Å; W289-P313 HydrophobicContact CZ2-CG 4.37Å; W289-P313 PolarHBondContact NE1-O 3.44Å; P313-E315 VanDerWaalsContact C-N 3.31Å; P313-E315 PolarHBondContact O-N 2.97Å
314	G	87.3	Confident	91	Very high	47 Å²	47	68 Å²	68	49%	0.485	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	-10.7	-175.1	0	0	0	0	0	116.4	N287 R312	N287-G314 PolarHBondContact ND2-O 3.26Å; R312-G314 PolarHBondContact O-N 3.05Å
315	E	93	Very high	91.1	Very high	18 Å²	18	63.3 Å²	63.3	8%	0.084	33%	0.334	C	S	.	.			trans	-78.9	142.5	173.2	-66.7	-179.5	166.5	0	0	111.5	V285 V286 P288 W289 L311 R312 P313	V285-E315 HydrophobicContact CG1-CB 3.95Å; V285-E315 HydrophobicContact CG1-CG 4.05Å; V286-E315 WeakPolarHBondContact O-CA 3.32Å; P288-E315 WeakPolarHBondContact CA-OE1 3.38Å; W289-E315 PolarHBondContact N-OE1 3.18Å; L311-E315 HydrophobicContact CB-CB 4.3Å; L311-E315 HydrophobicContact CD2-CB 4.13Å; R312-E315 HydrophobicContact CB-CG 4.13Å; R312-E315 PolarHBondContact N-OE2 3.2Å; R312-E315 WeakPolarHBondContact O-CB 3.45Å; R312-E315 PolarHBondContact O-N 3.23Å; P313-E315 VanDerWaalsContact C-N 3.31Å; P313-E315 PolarHBondContact O-N 2.97Å
316	C	91.5	Very high	91.3	Very high	73 Å²	73	66.9 Å²	66.9	49%	0.493	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	152.2	175.2	-67.4	0	0	0	0	110.7	V286	V286-C316 PolarHBondContact N-O 3.16Å; V286-C316 PolarHBondContact O-N 3.32Å
317	L	92.8	Very high	91.3	Very high	45 Å²	45	59.4 Å²	59.4	24%	0.236	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128.7	171.8	-57.3	-178.6	0	0	0	110.1	T275 C283 V284 V285 L311 R319 V321	T275-L317 HydrophobicContact CG2-CD1 4.04Å; C283-L317 HydrophobicContact CB-CD2 4Å; V284-L317 WeakPolarHBondContact O-CA 3.41Å; V285-L317 HydrophobicContact CG2-CD2 3.95Å; L311-L317 HydrophobicContact CD1-CG 4.21Å; L311-L317 HydrophobicContact CD2-CD2 3.91Å; L311-L317 HydrophobicContact CD2-CG 4.39Å; L317-R319 PolarHBondContact O-N 3.21Å; L317-V321 HydrophobicContact CD1-CG2 4.38Å
318	E	90.5	Very high	91.3	Very high	84 Å²	84	59.7 Å²	59.7	39%	0.393	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	-39.9	-176.1	-170.4	176.9	-173.5	0	0	112.9	V284 V286 K300	V284-E318 HydrophobicContact CB-CB 4.29Å; V284-E318 HydrophobicContact CG1-CB 4.47Å; V284-E318 PolarHBondContact O-N 2.84Å; V286-E318 HydrophobicContact CG2-CB 3.72Å; V286-E318 HydrophobicContact CG2-CG 4.31Å; K300-E318 VanDerWaalsContact CE-OE2 3.28Å; K300-E318 WeakPolarHBondContact CE-OE2 3.25Å; K300-E318 IonicContact NZ-OE1 2.79Å; K300-E318 PolarHBondContact NZ-OE1 3.34Å; K300-E318 IonicContact NZ-OE2 2.76Å; K300-E318 PolarHBondContact NZ-OE2 2.9Å
319	R	89.6	Confident	91.1	Very high	143 Å²	143	61.7 Å²	61.7	54%	0.54	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	25.7	-179.2	-62	-175.2	-179.4	-179	-1.5	112.3	L317 E384	L317-R319 PolarHBondContact O-N 3.21Å; R319-E384 IonicContact NH2-OE1 2.73Å
320	G	92	Very high	91	Very high	27 Å²	27	63 Å²	63	28%	0.278	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.9	-158.2	-171.7	0	0	0	0	0	113.4	C283	C283-G320 WeakPolarHBondContact CB-O 3.49Å
321	V	92.7	Very high	90.9	Very high	56 Å²	56	62.2 Å²	62.2	34%	0.339	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	134.2	168.6	177.2	0	0	0	0	108.8	T275 L277 Q281 C283 L317	T275-V321 HydrophobicContact CG2-CG2 4.04Å; L277-V321 HydrophobicContact CD2-CB 4.21Å; L277-V321 HydrophobicContact CD2-CG1 3.58Å; L277-V321 HydrophobicContact CD2-CG2 3.73Å; Q281-V321 HydrophobicContact CB-CG1 4.02Å; Q281-V321 HydrophobicContact CG-CG1 4.16Å; C283-V321 HydrophobicContact CB-CG2 4.47Å; L317-V321 HydrophobicContact CD1-CG2 4.38Å
322	Q	92	Very high	90.9	Very high	44 Å²	44	60.8 Å²	60.8	21%	0.206	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.8	-179.9	-71.4	162.8	105.7	0	0	109.6	Q281 F282	Q281-Q322 WeakPolarHBondContact CA-O 3.31Å; F282-Q322 HydrophobicContact CD1-CB 4.21Å; F282-Q322 WeakPolarHBondContact CD1-O 3.43Å; F282-Q322 HydrophobicContact CE1-CB 3.71Å; F282-Q322 HydrophobicContact CE2-CB 4.28Å; F282-Q322 HydrophobicContact CZ-CB 3.75Å; F282-Q322 PolarHBondContact N-O 2.98Å; F282-Q322 PolarHBondContact O-N 3.43Å
323	D	92.7	Very high	91	Very high	109 Å²	109	55.6 Å²	55.6	58%	0.583	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	145.6	172	-56.3	-52.1	0	0	0	110.7	Q281 F282	Q281-D323 WeakPolarHBondContact CG-OD1 3.45Å; Q281-D323 PolarHBondContact NE2-OD1 3.03Å; F282-D323 WeakPolarHBondContact CE1-O 3.37Å
324	A	89.8	Confident	91.2	Very high	10 Å²	10	55.4 Å²	55.4	8%	0.083	30%	0.297	C	S	.	.			trans	-63.9	146.1	173.5	0	0	0	0	0	110.8	H280 I326 E376 I378	H280-A324 HydrophobicContact CB-CB 4.41Å; H280-A324 WeakPolarHBondContact O-CB 3.26Å; H280-A324 PolarHBondContact O-N 3.07Å; A324-I326 PolarHBondContact O-N 2.99Å; A324-E376 HydrophobicContact CB-CG 3.77Å; A324-E376 WeakPolarHBondContact CB-OE1 3.38Å; A324-I378 HydrophobicContact CB-CD1 4.03Å; A324-I378 HydrophobicContact CB-CG1 3.56Å
325	Y	90.6	Very high	91.4	Very high	59 Å²	59	53.1 Å²	53.1	23%	0.231	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	95.3	179.1	-65	-93.9	0	0	0	109.8	L327 L333 Y377 P379 V385	Y325-L327 PolarHBondContact O-N 3.41Å; Y325-L333 HydrophobicContact CD1-CD1 3.8Å; Y325-L333 HydrophobicContact CD1-CD2 4.01Å; Y325-L333 HydrophobicContact CD2-CD1 4.29Å; Y325-L333 HydrophobicContact CE1-CD1 4.5Å; Y325-L333 HydrophobicContact CE1-CD2 4.44Å; Y325-L333 HydrophobicContact CG-CD1 3.68Å; Y325-Y377 WeakPolarHBondContact CB-O 3.42Å; Y325-Y377 PolarHBondContact N-O 3.49Å; Y325-Y377 PolarHBondContact O-N 2.86Å; Y325-P379 HydrophobicContact CE2-CG 4.13Å; Y325-V385 HydrophobicContact CD2-CG2 4.41Å; Y325-V385 HydrophobicContact CE1-CG1 4.15Å; Y325-V385 HydrophobicContact CE1-CG2 4.44Å; Y325-V385 HydrophobicContact CE2-CG2 3.81Å
326	I	90.6	Very high	91.4	Very high	95 Å²	95	56.3 Å²	56.3	49%	0.487	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	112.7	168	-55.5	173	0	0	0	107.5	A324 E376 R388	A324-I326 PolarHBondContact O-N 2.99Å; I326-E376 HydrophobicContact CG1-CG 4.47Å; I326-R388 PolarHBondContact O-NH2 3.03Å
327	L	90.9	Very high	91.5	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.1	177.5	-56.5	175	0	0	0	109.9	Y325 E331 L333 L371 P374 I375	Y325-L327 PolarHBondContact O-N 3.41Å; L327-E331 HydrophobicContact CB-CB 4.33Å; L327-E331 HydrophobicContact CD2-CB 4.29Å; L327-L333 HydrophobicContact CD1-CD1 4.11Å; L327-L333 HydrophobicContact CD1-CG 3.84Å; L327-L333 HydrophobicContact CD2-CD1 4.26Å; L327-L333 HydrophobicContact CD2-CD2 3.98Å; L327-L333 HydrophobicContact CD2-CG 3.75Å; L327-L333 HydrophobicContact CG-CG 4.35Å; L327-L371 HydrophobicContact CD1-CD2 4.16Å; L327-L371 HydrophobicContact CD1-CG 4.27Å; L327-P374 VanDerWaalsContact O-CA 3.28Å; L327-P374 WeakPolarHBondContact O-CA 3.4Å; L327-I375 HydrophobicContact CB-CG2 4.44Å; L327-I375 HydrophobicContact CD1-CG2 4.02Å; L327-I375 PolarHBondContact N-O 2.84Å; L327-I375 PolarHBondContact O-N 2.86Å; L327-I375 VanDerWaalsContact O-N 3.15Å
328	Q	90.9	Very high	91.3	Very high	122 Å²	122	54.6 Å²	54.6	57%	0.57	27%	0.267	S	S	*	.			trans	-87.6	174.8	171.5	-59.2	-169.3	31.2	0	0	112	D330 E331 G373	Q328-D330 VanDerWaalsContact CB-OD1 3.23Å; Q328-D330 WeakPolarHBondContact CB-OD1 3.37Å; Q328-D330 PolarHBondContact O-N 2.96Å; Q328-E331 HydrophobicContact CB-CG 4.26Å; Q328-E331 PolarHBondContact N-OE2 3.26Å; Q328-E331 VanDerWaalsContact N-OE2 3.08Å; Q328-E331 PolarHBondContact O-N 3.33Å; Q328-G373 VanDerWaalsContact O-CA 3.31Å; Q328-G373 WeakPolarHBondContact O-CA 3.37Å
329	N	87.2	Confident	91.3	Very high	129 Å²	129	56.4 Å²	56.4	69%	0.69	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-29.6	-180	-65.8	-0.3	0	0	0	113	P374	N329-P374 VanDerWaalsContact OD1-CB 3.29Å; N329-P374 WeakPolarHBondContact OD1-CB 3.5Å; N329-P374 VanDerWaalsContact OD1-CD 3.23Å; N329-P374 WeakPolarHBondContact OD1-CD 3.26Å; N329-P374 WeakPolarHBondContact OD1-CG 3.29Å
330	D	90.3	Very high	91.4	Very high	73 Å²	73	56 Å²	56	39%	0.39	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	11.2	-179.7	65	-45.2	0	0	0	113.2	Q328 N390 V391 M419	Q328-D330 VanDerWaalsContact CB-OD1 3.23Å; Q328-D330 WeakPolarHBondContact CB-OD1 3.37Å; Q328-D330 PolarHBondContact O-N 2.96Å; D330-N390 CarbonylContact O-C 3.55Å; D330-N390 VanDerWaalsContact O-CA 3.3Å; D330-N390 WeakPolarHBondContact O-CA 3.47Å; D330-V391 HydrophobicContact CB-CB 4.04Å; D330-V391 HydrophobicContact CB-CG2 3.81Å; D330-V391 WeakPolarHBondContact O-CG2 3.21Å; D330-V391 PolarHBondContact O-N 3.49Å; D330-M419 VanDerWaalsContact C-CE 3.41Å; D330-M419 VanDerWaalsContact O-CE 3.31Å; D330-M419 WeakPolarHBondContact O-CE 3.49Å
331	E	92.7	Very high	91.2	Very high	18 Å²	18	55.9 Å²	55.9	8%	0.084	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	154	-179	-59.9	-170.9	115.9	0	0	113.3	L327 Q328 G373 R388 R389 M419	L327-E331 HydrophobicContact CB-CB 4.33Å; L327-E331 HydrophobicContact CD2-CB 4.29Å; Q328-E331 HydrophobicContact CB-CG 4.26Å; Q328-E331 PolarHBondContact N-OE2 3.26Å; Q328-E331 VanDerWaalsContact N-OE2 3.08Å; Q328-E331 PolarHBondContact O-N 3.33Å; E331-G373 PolarHBondContact O-N 2.86Å; E331-R388 IonicContact OE1-CZ 3.14Å; E331-R388 IonicContact OE1-NE 2.73Å; E331-R388 PolarHBondContact OE1-NE 3.1Å; E331-R388 IonicContact OE1-NH2 2.7Å; E331-R388 PolarHBondContact OE1-NH2 2.95Å; E331-R388 IonicContact OE2-CZ 3.9Å; E331-R388 IonicContact OE2-NE 2.72Å; E331-R388 IonicContact OE2-NH2 2.96Å; E331-R388 PolarHBondContact OE2-NH2 3.41Å; E331-R389 CarbonylContact C-O 3.59Å; E331-R389 WeakPolarHBondContact CA-O 3.27Å; E331-M419 VanDerWaalsContact C-CE 3.45Å
332	G	91.5	Very high	90.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	163.7	172.4	0	0	0	0	0	112.8	L371 R389	G332-L371 CarbonylContact C-O 3.54Å; G332-L371 WeakPolarHBondContact CA-O 3.4Å; G332-R389 PolarHBondContact N-O 3.2Å; G332-R389 PolarHBondContact O-N 2.96Å
333	L	93.4	Very high	90	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.1	173.1	-63.5	176.6	0	0	0	110.2	Y325 L327 L335 M370 L371 Y377 V385 D387 R388	Y325-L333 HydrophobicContact CD1-CD1 3.8Å; Y325-L333 HydrophobicContact CD1-CD2 4.01Å; Y325-L333 HydrophobicContact CD2-CD1 4.29Å; Y325-L333 HydrophobicContact CE1-CD1 4.5Å; Y325-L333 HydrophobicContact CE1-CD2 4.44Å; Y325-L333 HydrophobicContact CG-CD1 3.68Å; L327-L333 HydrophobicContact CD1-CD1 4.11Å; L327-L333 HydrophobicContact CD1-CG 3.84Å; L327-L333 HydrophobicContact CD2-CD1 4.26Å; L327-L333 HydrophobicContact CD2-CD2 3.98Å; L327-L333 HydrophobicContact CD2-CG 3.75Å; L327-L333 HydrophobicContact CG-CG 4.35Å; L333-L335 HydrophobicContact CB-CD2 3.86Å; L333-L335 HydrophobicContact CB-CG 4.28Å; L333-L335 HydrophobicContact CD1-CD2 4.31Å; L333-M370 CarbonylContact O-C 3.6Å; L333-M370 WeakPolarHBondContact O-CA 3.19Å; L333-L371 PolarHBondContact N-O 3.01Å; L333-L371 PolarHBondContact O-N 3.28Å; L333-Y377 HydrophobicContact CD1-CD1 4.07Å; L333-V385 HydrophobicContact CB-CG1 4.37Å; L333-V385 HydrophobicContact CD1-CG1 4.18Å; L333-V385 HydrophobicContact CD1-CG2 4.26Å; L333-V385 HydrophobicContact CD2-CG1 3.86Å; L333-V385 HydrophobicContact CG-CG1 4.35Å; L333-D387 WeakPolarHBondContact CA-O 3.34Å; L333-R388 HydrophobicContact CD2-CB 4Å; L333-R388 HydrophobicContact CD2-CG 4.05Å
334	I	92.8	Very high	88.8	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	113	163.9	-61.3	177.6	0	0	0	107.2	I386 D387 R389 Q422	I334-I386 HydrophobicContact CG2-CB 4.34Å; I334-I386 PolarHBondContact O-N 3.42Å; I334-D387 HydrophobicContact CB-CB 4.12Å; I334-D387 HydrophobicContact CD1-CB 4.21Å; I334-D387 HydrophobicContact CG1-CB 4.43Å; I334-D387 PolarHBondContact N-O 3.16Å; I334-R389 HydrophobicContact CD1-CG 3.78Å; I334-R389 VanDerWaalsContact CD1-CZ 3.48Å; I334-R389 HydrophobicContact CG1-CG 3.96Å; I334-Q422 HydrophobicContact CG1-CB 4.4Å; I334-Q422 HydrophobicContact CG2-CB 4.05Å
335	L	92.7	Very high	87.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	150.5	179.2	-57.5	-178.4	0	0	0	110	L333 R368 W369 L371 Y377 V383 E384 V385	L333-L335 HydrophobicContact CB-CD2 3.86Å; L333-L335 HydrophobicContact CB-CG 4.28Å; L333-L335 HydrophobicContact CD1-CD2 4.31Å; L335-R368 VanDerWaalsContact O-CA 3.25Å; L335-R368 WeakPolarHBondContact O-CA 3.47Å; L335-W369 HydrophobicContact CB-CD2 3.98Å; L335-W369 HydrophobicContact CB-CE3 4.28Å; L335-W369 HydrophobicContact CB-CH2 4.03Å; L335-W369 HydrophobicContact CB-CZ2 3.74Å; L335-W369 HydrophobicContact CB-CZ3 4.3Å; L335-W369 HydrophobicContact CD1-CZ2 3.82Å; L335-W369 HydrophobicContact CG-CZ2 4.44Å; L335-W369 PolarHBondContact N-O 2.92Å; L335-W369 PolarHBondContact O-N 3.13Å; L335-W369 VanDerWaalsContact O-N 3.13Å; L335-L371 HydrophobicContact CD1-CB 3.87Å; L335-L371 HydrophobicContact CD1-CD2 4.27Å; L335-L371 HydrophobicContact CG-CB 4.42Å; L335-Y377 HydrophobicContact CD1-CE1 3.75Å; L335-Y377 HydrophobicContact CD1-CE2 4.43Å; L335-Y377 HydrophobicContact CD2-CE1 3.85Å; L335-Y377 HydrophobicContact CG-CE1 4.49Å; L335-V383 HydrophobicContact CB-CG1 3.97Å; L335-V383 HydrophobicContact CD1-CG1 4.3Å; L335-V383 HydrophobicContact CD2-CG1 4.14Å; L335-V383 HydrophobicContact CG-CG1 4.36Å; L335-E384 CarbonylContact C-O 3.53Å; L335-E384 WeakPolarHBondContact CA-O 3.16Å; L335-V385 HydrophobicContact CD2-CB 4.32Å; L335-V385 HydrophobicContact CD2-CG2 3.75Å
336	R	93.3	Very high	85.4	Confident	84 Å²	84	57.2 Å²	57.2	32%	0.317	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	132.3	171	169.9	174.4	65.6	-166.9	0.5	110.7	D367 R368 E384 I386	R336-D367 VanDerWaalsContact CA-O 3.31Å; R336-D367 WeakPolarHBondContact CA-O 3.21Å; R336-R368 HydrophobicContact CB-CG 4.41Å; R336-E384 IonicContact CZ-OE2 3.96Å; R336-E384 PolarHBondContact N-O 3.22Å; R336-E384 IonicContact NE-OE2 3.14Å; R336-E384 PolarHBondContact NE-OE2 3.03Å; R336-E384 IonicContact NH2-OE2 2.7Å; R336-E384 PolarHBondContact NH2-OE2 3.44Å; R336-E384 PolarHBondContact O-N 2.74Å; R336-I386 HydrophobicContact CB-CD1 3.5Å; R336-I386 VanDerWaalsContact CB-CD1 3.5Å; R336-I386 HydrophobicContact CB-CG1 3.9Å; R336-I386 HydrophobicContact CG-CD1 4.31Å
337	A	91.9	Very high	83.3	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.008	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	127.3	170.8	0	0	0	0	0	110.4	F341 R363 R364 G366 D367 W369	A337-F341 HydrophobicContact CB-CD1 4.48Å; A337-F341 HydrophobicContact CB-CE1 4.06Å; A337-R363 HydrophobicContact CB-CB 3.94Å; A337-R364 VanDerWaalsContact CB-O 3.31Å; A337-R364 WeakPolarHBondContact CB-O 3.38Å; A337-G366 PolarHBondContact O-N 2.84Å; A337-D367 PolarHBondContact N-O 2.77Å; A337-W369 HydrophobicContact CB-CH2 4.36Å; A337-W369 HydrophobicContact CB-CZ3 4.01Å
338	K	90.2	Very high	81	Confident	82 Å²	82	61.1 Å²	61.1	36%	0.357	32%	0.317	S	S	.	.	S	Bend	trans	-85.4	-39.8	168.6	-77.3	175.9	167	156.6	0	111.3	P365 E382 E384	K338-P365 WeakPolarHBondContact O-CB 3.24Å; K338-E382 PolarHBondContact N-O 2.78Å; K338-E384 HydrophobicContact CD-CB 4.23Å; K338-E384 WeakPolarHBondContact CE-OE1 3.29Å; K338-E384 VanDerWaalsContact CE-OE2 3.26Å; K338-E384 WeakPolarHBondContact CE-OE2 3.45Å; K338-E384 HydrophobicContact CG-CB 4.32Å; K338-E384 IonicContact NZ-OE1 3.79Å; K338-E384 PolarHBondContact NZ-OE1 2.75Å; K338-E384 IonicContact NZ-OE2 3.65Å
339	E	89.6	Confident	78.5	Confident	121 Å²	121	60 Å²	60	57%	0.565	33%	0.329	S	S	*	.	S	Bend	trans	-125.2	166.1	-178.2	-65.9	-176	-156	0	0	110.2	F341 E382	E339-F341 PolarHBondContact O-N 3.07Å; E339-E382 HydrophobicContact CB-CB 4.24Å; E339-E382 HydrophobicContact CB-CG 4.29Å
340	Q	91.9	Very high	76.3	Confident	135 Å²	135	60.5 Å²	60.5	63%	0.631	33%	0.33	S	S	*	.			trans	-77.7	121.3	175.8	-177.7	179.5	-17.8	0	0	109.6	I362 R363	Q340-I362 HydrophobicContact CG-CG2 4.15Å; Q340-R363 WeakPolarHBondContact CA-O 3.48Å; Q340-R363 WeakPolarHBondContact CG-O 3.45Å
341	F	88	Confident	73.8	Confident	25 Å²	25	61 Å²	61	11%	0.11	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	169.2	176.1	79.3	-75.7	0	0	0	111.7	A337 E339 E343 R363 W369 E382 V383	A337-F341 HydrophobicContact CB-CD1 4.48Å; A337-F341 HydrophobicContact CB-CE1 4.06Å; E339-F341 PolarHBondContact O-N 3.07Å; F341-E343 HydrophobicContact CE2-CB 3.7Å; F341-E343 HydrophobicContact CE2-CG 4.15Å; F341-E343 HydrophobicContact CZ-CB 4.14Å; F341-E343 HydrophobicContact CZ-CG 4.48Å; F341-R363 HydrophobicContact CD1-CB 3.96Å; F341-R363 HydrophobicContact CD1-CG 4.47Å; F341-R363 HydrophobicContact CE1-CB 3.58Å; F341-R363 HydrophobicContact CE1-CG 3.76Å; F341-R363 HydrophobicContact CZ-CB 4.17Å; F341-R363 HydrophobicContact CZ-CG 3.81Å; F341-R363 PolarHBondContact N-O 3.41Å; F341-R363 PolarHBondContact O-N 3.13Å; F341-W369 AromaticContact CE1-CH2 3.96Å; F341-W369 HydrophobicContact CE1-CH2 3.96Å; F341-W369 AromaticContact CZ-CH2 3.85Å; F341-W369 HydrophobicContact CZ-CH2 3.85Å; F341-W369 HydrophobicContact CZ-CZ2 4.09Å; F341-E382 HydrophobicContact CB-CB 4.04Å; F341-E382 HydrophobicContact CB-CG 4.02Å; F341-E382 HydrophobicContact CD1-CB 3.75Å; F341-E382 HydrophobicContact CE1-CB 4.46Å; F341-E382 HydrophobicContact CG-CB 3.95Å; F341-E382 HydrophobicContact CG-CG 4.43Å; F341-V383 HydrophobicContact CD1-CG2 4.38Å; F341-V383 HydrophobicContact CE1-CG2 3.47Å; F341-V383 VanDerWaalsContact CE1-CG2 3.47Å; F341-V383 HydrophobicContact CE2-CG2 4.02Å; F341-V383 HydrophobicContact CZ-CG2 3.26Å
342	V	83.6	Confident	71.2	Confident	76 Å²	76	69.4 Å²	69.4	46%	0.461	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116.5	175.8	-175.6	0	0	0	0	108.4	K360 C361 I362	V342-K360 HydrophobicContact CG1-CB 3.74Å; V342-K360 HydrophobicContact CG1-CD 4.13Å; V342-K360 HydrophobicContact CG1-CG 4.17Å; V342-C361 WeakPolarHBondContact CA-O 3.48Å; V342-I362 HydrophobicContact CG2-CG1 4.4Å
343	E	74.9	Confident	68.6	Low	8 Å²	8	73.5 Å²	73.5	4%	0.037	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	118.4	178.6	-169.4	174.8	-145.9	0	0	109.9	F341 I345 C361 R363 W369	F341-E343 HydrophobicContact CE2-CB 3.7Å; F341-E343 HydrophobicContact CE2-CG 4.15Å; F341-E343 HydrophobicContact CZ-CB 4.14Å; F341-E343 HydrophobicContact CZ-CG 4.48Å; E343-I345 VanDerWaalsContact C-N 3.35Å; E343-C361 PolarHBondContact N-O 2.99Å; E343-C361 PolarHBondContact O-N 2.87Å; E343-R363 HydrophobicContact CB-CG 4.3Å; E343-R363 IonicContact OE2-CZ 3.68Å; E343-R363 IonicContact OE2-NE 2.82Å; E343-R363 PolarHBondContact OE2-NE 3.02Å; E343-R363 IonicContact OE2-NH2 2.69Å; E343-R363 PolarHBondContact OE2-NH2 2.78Å; E343-W369 VanDerWaalsContact OE1-CZ2 3.31Å; E343-W369 WeakPolarHBondContact OE1-CZ2 3.39Å; E343-W369 PolarHBondContact OE1-NE1 3.26Å; E343-W369 PolarHBondContact OE2-NE1 2.97Å
344	D	67.4	Low	65.9	Low	92 Å²	92	81.2 Å²	81.2	49%	0.492	46%	0.457	S	S	.	.	S	Bend	trans	-78.1	-19.7	175.5	-75.6	-30.1	0	0	0	112.8	K360	D344-K360 WeakPolarHBondContact OD1-CE 3.37Å; D344-K360 IonicContact OD1-NZ 3.43Å; D344-K360 PolarHBondContact OD1-NZ 3.09Å; D344-K360 IonicContact OD2-NZ 3.17Å
345	I	60.6	Low	63.4	Low	84 Å²	84	86.2 Å²	86.2	43%	0.431	49%	0.492	S	S	.	.			trans	-104.5	79.5	-177	-49.6	175.4	0	0	0	110	E343 G347 I375	E343-I345 VanDerWaalsContact C-N 3.35Å; I345-G347 PolarHBondContact O-N 3.42Å; I345-I375 HydrophobicContact CG2-CD1 4.15Å
346	C	49.5	Very low	61	Low	46 Å²	46	92.9 Å²	92.9	31%	0.311	53%	0.533	S	S	.	.			trans	-87.5	89.7	166.4	-77.7	0	0	0	0	110.7	D348 K359 C361	C346-D348 VanDerWaalsContact C-N 3.28Å; C346-D348 PolarHBondContact O-N 2.95Å; C346-K359 HydrophobicContact CB-CB 4.33Å; C346-K359 VanDerWaalsContact CB-O 3.32Å; C346-K359 WeakPolarHBondContact CB-O 3.34Å; C346-K359 PolarHBondContact SG-O 3.26Å; C346-C361 WeakPolarHBondContact SG-CB 3.36Å
347	G	46.2	Very low	58.6	Low	42 Å²	42	97.6 Å²	97.6	43%	0.433	56%	0.555	S	S	.	*			trans	-77.1	53.8	-177.4	0	0	0	0	0	116	I345 A349	I345-G347 PolarHBondContact O-N 3.42Å; G347-A349 PolarHBondContact O-N 3.08Å
348	D	42.7	Very low	56.4	Low	139 Å²	139	105.2 Å²	105.2	74%	0.743	59%	0.591	S	S	*	*			trans	-85.8	59.1	163.4	-77.2	-29.7	0	0	0	110.1	C346 I350	C346-D348 VanDerWaalsContact C-N 3.28Å; C346-D348 PolarHBondContact O-N 2.95Å; D348-I350 PolarHBondContact O-N 3.18Å
349	A	38.7	Very low	54.8	Low	98 Å²	98	108.9 Å²	108.9	81%	0.81	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	8.4	-172.6	0	0	0	0	0	115.1	G347	G347-A349 PolarHBondContact O-N 3.08Å
350	I	40.7	Very low	53.7	Low	139 Å²	139	109.5 Å²	109.5	71%	0.713	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	8.7	-174.7	-38.1	-179.4	0	0	0	111.9	D348 E352	D348-I350 PolarHBondContact O-N 3.18Å; I350-E352 VanDerWaalsContact C-N 3.33Å; I350-E352 PolarHBondContact O-N 2.7Å; I350-E352 VanDerWaalsContact O-N 3.1Å
351	S	38.3	Very low	53	Low	85 Å²	85	105 Å²	105	59%	0.594	59%	0.59	S	S	*	*			trans	-78.9	84.5	163.3	-68.8	0	0	0	0	110.1	G353	S351-G353 PolarHBondContact O-N 2.6Å
352	E	36.7	Very low	52.9	Low	194 Å²	194	108.5 Å²	108.5	91%	0.907	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.8	123.5	170.2	-70.5	-164.6	155.2	0	0	110.6	I350	I350-E352 VanDerWaalsContact C-N 3.33Å; I350-E352 PolarHBondContact O-N 2.7Å; I350-E352 VanDerWaalsContact O-N 3.1Å
353	G	38.5	Very low	53.1	Low	85 Å²	85	106.7 Å²	106.7	88%	0.876	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.3	-13.3	166.4	0	0	0	0	0	117.6	S351	S351-G353 PolarHBondContact O-N 2.6Å
354	E	35.2	Very low	53.9	Low	164 Å²	164	114.4 Å²	114.4	77%	0.766	62%	0.623	S	S	*	*	S	Bend	trans	-100.8	130.9	174.3	-69.9	-153.4	155.8	0	0	112.8	V356	E354-V356 PolarHBondContact O-N 3.14Å
355	S	41.1	Very low	55.1	Low	110 Å²	110	114 Å²	114	77%	0.769	63%	0.625	S	S	*	*			trans	-54.9	133.2	179.8	-46	0	0	0	0	111.4	K357	S355-K357 VanDerWaalsContact C-N 3.26Å; S355-K357 PolarHBondContact O-N 3.43Å
356	V	42.6	Very low	56.3	Low	141 Å²	141	112.2 Å²	112.2	86%	0.855	63%	0.627	S	S	*	*			trans	-60.3	80.5	-175.5	-172.2	0	0	0	0	111.9	E354 Q358	E354-V356 PolarHBondContact O-N 3.14Å; V356-Q358 PolarHBondContact O-N 2.93Å
357	K	43.2	Very low	58.3	Low	182 Å²	182	112.9 Å²	112.9	79%	0.791	63%	0.628	S	S	*	*			trans	-71.4	108.9	165.2	-76.9	177.1	179.8	166.9	0	106.7	S355 K359	S355-K357 VanDerWaalsContact C-N 3.26Å; S355-K357 PolarHBondContact O-N 3.43Å; K357-K359 PolarHBondContact O-N 2.68Å
358	Q	45.3	Very low	60.4	Low	161 Å²	161	117.1 Å²	117.1	75%	0.752	63%	0.631	S	S	*	*			trans	-56.2	87.4	167.1	-70.5	174.7	-27.3	0	0	109.4	V356 K360	V356-Q358 PolarHBondContact O-N 2.93Å; Q358-K360 PolarHBondContact O-N 2.76Å; Q358-K360 VanDerWaalsContact O-N 3.13Å
359	K	56	Low	62.7	Low	159 Å²	159	111.2 Å²	111.2	69%	0.691	60%	0.598	S	S	*	*			trans	-70.7	105.7	171.2	-84.7	178.2	176.6	168.4	0	106.8	C346 K357 C361	C346-K359 HydrophobicContact CB-CB 4.33Å; C346-K359 VanDerWaalsContact CB-O 3.32Å; C346-K359 WeakPolarHBondContact CB-O 3.34Å; C346-K359 PolarHBondContact SG-O 3.26Å; K357-K359 PolarHBondContact O-N 2.68Å; K359-C361 PolarHBondContact O-N 2.96Å
360	K	67.2	Low	65.2	Low	134 Å²	134	107.7 Å²	107.7	58%	0.583	57%	0.566	S	S	*	*			trans	-67.3	116.4	166.1	-70.9	-175	-178.6	-105	0	108.4	V342 D344 Q358	V342-K360 HydrophobicContact CG1-CB 3.74Å; V342-K360 HydrophobicContact CG1-CD 4.13Å; V342-K360 HydrophobicContact CG1-CG 4.17Å; D344-K360 WeakPolarHBondContact OD1-CE 3.37Å; D344-K360 IonicContact OD1-NZ 3.43Å; D344-K360 PolarHBondContact OD1-NZ 3.09Å; D344-K360 IonicContact OD2-NZ 3.17Å; Q358-K360 PolarHBondContact O-N 2.76Å; Q358-K360 VanDerWaalsContact O-N 3.13Å
361	C	75.7	Confident	67.6	Low	40 Å²	40	101.3 Å²	101.3	27%	0.27	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.7	175.3	-173.7	0	0	0	0	109.9	V342 E343 C346 K359 R363	V342-C361 WeakPolarHBondContact CA-O 3.48Å; E343-C361 PolarHBondContact N-O 2.99Å; E343-C361 PolarHBondContact O-N 2.87Å; C346-C361 WeakPolarHBondContact SG-CB 3.36Å; K359-C361 PolarHBondContact O-N 2.96Å; C361-R363 PolarHBondContact O-N 3.31Å
362	I	87.8	Confident	70	Confident	99 Å²	99	102 Å²	102	51%	0.508	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	104.7	173.4	-56	174.7	0	0	0	107	Q340 V342	Q340-I362 HydrophobicContact CG-CG2 4.15Å; V342-I362 HydrophobicContact CG2-CG1 4.4Å
363	R	87.8	Confident	72.4	Confident	38 Å²	38	93.6 Å²	93.6	14%	0.143	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.7	174.2	-57.8	-62	-175.5	179.3	0.6	109.3	A337 Q340 F341 E343 C361 W369	A337-R363 HydrophobicContact CB-CB 3.94Å; Q340-R363 WeakPolarHBondContact CA-O 3.48Å; Q340-R363 WeakPolarHBondContact CG-O 3.45Å; F341-R363 HydrophobicContact CD1-CB 3.96Å; F341-R363 HydrophobicContact CD1-CG 4.47Å; F341-R363 HydrophobicContact CE1-CB 3.58Å; F341-R363 HydrophobicContact CE1-CG 3.76Å; F341-R363 HydrophobicContact CZ-CB 4.17Å; F341-R363 HydrophobicContact CZ-CG 3.81Å; F341-R363 PolarHBondContact N-O 3.41Å; F341-R363 PolarHBondContact O-N 3.13Å; E343-R363 HydrophobicContact CB-CG 4.3Å; E343-R363 IonicContact OE2-CZ 3.68Å; E343-R363 IonicContact OE2-NE 2.82Å; E343-R363 PolarHBondContact OE2-NE 3.02Å; E343-R363 IonicContact OE2-NH2 2.69Å; E343-R363 PolarHBondContact OE2-NH2 2.78Å; C361-R363 PolarHBondContact O-N 3.31Å; R363-W369 HydrophobicContact CB-CZ3 4.46Å; R363-W369 HydrophobicContact CG-CH2 4.01Å; R363-W369 HydrophobicContact CG-CZ2 4.4Å; R363-W369 HydrophobicContact CG-CZ3 4.05Å
364	R	91.6	Very high	74.9	Confident	170 Å²	170	94.2 Å²	94.2	64%	0.642	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-101.9	153.7	174.6	-60.6	-179.3	179.6	-167.4	-0.2	110.5	A337 G366 D367	A337-R364 VanDerWaalsContact CB-O 3.31Å; A337-R364 WeakPolarHBondContact CB-O 3.38Å; R364-G366 PolarHBondContact O-N 2.94Å; R364-D367 PolarHBondContact N-OD2 3.38Å; R364-D367 VanDerWaalsContact O-CB 3.27Å; R364-D367 WeakPolarHBondContact O-CB 3.46Å; R364-D367 VanDerWaalsContact O-CG 3.28Å; R364-D367 PolarHBondContact O-N 3.23Å
365	P	90.9	Very high	77.5	Confident	84 Å²	84	88.9 Å²	88.9	55%	0.545	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	125.5	174.4	-27.6	35.3	0	0	0	112.2	K338	K338-P365 WeakPolarHBondContact O-CB 3.24Å
366	G	86.8	Confident	79.7	Confident	46 Å²	46	87.7 Å²	87.7	47%	0.474	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.4	-17.9	-177.9	0	0	0	0	0	115.4	A337 R364 R368	A337-G366 PolarHBondContact O-N 2.84Å; R364-G366 PolarHBondContact O-N 2.94Å; G366-R368 PolarHBondContact O-N 3.38Å
367	D	90.7	Very high	82	Confident	61 Å²	61	81.4 Å²	81.4	33%	0.326	40%	0.396	S	S	.	.			trans	-56.7	133.4	176.1	-72.4	-6.2	0	0	0	110.1	R336 A337 R364	R336-D367 VanDerWaalsContact CA-O 3.31Å; R336-D367 WeakPolarHBondContact CA-O 3.21Å; A337-D367 PolarHBondContact N-O 2.77Å; R364-D367 PolarHBondContact N-OD2 3.38Å; R364-D367 VanDerWaalsContact O-CB 3.27Å; R364-D367 WeakPolarHBondContact O-CB 3.46Å; R364-D367 VanDerWaalsContact O-CG 3.28Å; R364-D367 PolarHBondContact O-N 3.23Å
368	R	90.6	Very high	84.2	Confident	130 Å²	130	74 Å²	74	49%	0.491	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	144.6	174.5	-59.1	-173.2	-171.8	-168.1	2.5	110.6	L335 R336 G366 Q422	L335-R368 VanDerWaalsContact O-CA 3.25Å; L335-R368 WeakPolarHBondContact O-CA 3.47Å; R336-R368 HydrophobicContact CB-CG 4.41Å; G366-R368 PolarHBondContact O-N 3.38Å; R368-Q422 HydrophobicContact CB-CB 4.27Å; R368-Q422 HydrophobicContact CB-CG 4.23Å
369	W	90.7	Very high	86.4	Confident	16 Å²	16	67 Å²	67	6%	0.061	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	160.8	170.6	67.4	108.3	0	0	0	110.6	L335 A337 F341 E343 R363 V383	L335-W369 HydrophobicContact CB-CD2 3.98Å; L335-W369 HydrophobicContact CB-CE3 4.28Å; L335-W369 HydrophobicContact CB-CH2 4.03Å; L335-W369 HydrophobicContact CB-CZ2 3.74Å; L335-W369 HydrophobicContact CB-CZ3 4.3Å; L335-W369 HydrophobicContact CD1-CZ2 3.82Å; L335-W369 HydrophobicContact CG-CZ2 4.44Å; L335-W369 PolarHBondContact N-O 2.92Å; L335-W369 PolarHBondContact O-N 3.13Å; L335-W369 VanDerWaalsContact O-N 3.13Å; A337-W369 HydrophobicContact CB-CH2 4.36Å; A337-W369 HydrophobicContact CB-CZ3 4.01Å; F341-W369 AromaticContact CE1-CH2 3.96Å; F341-W369 HydrophobicContact CE1-CH2 3.96Å; F341-W369 AromaticContact CZ-CH2 3.85Å; F341-W369 HydrophobicContact CZ-CH2 3.85Å; F341-W369 HydrophobicContact CZ-CZ2 4.09Å; E343-W369 VanDerWaalsContact OE1-CZ2 3.31Å; E343-W369 WeakPolarHBondContact OE1-CZ2 3.39Å; E343-W369 PolarHBondContact OE1-NE1 3.26Å; E343-W369 PolarHBondContact OE2-NE1 2.97Å; R363-W369 HydrophobicContact CB-CZ3 4.46Å; R363-W369 HydrophobicContact CG-CH2 4.01Å; R363-W369 HydrophobicContact CG-CZ2 4.4Å; R363-W369 HydrophobicContact CG-CZ3 4.05Å; W369-V383 HydrophobicContact CH2-CG1 4.09Å; W369-V383 HydrophobicContact CH2-CG2 4.12Å; W369-V383 HydrophobicContact CZ2-CG1 4.28Å; W369-V383 HydrophobicContact CZ2-CG2 4.42Å
370	M	91.9	Very high	88	Confident	24 Å²	24	61.2 Å²	61.2	12%	0.118	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.8	170.1	172.1	168.3	-86.7	0	0	110.1	L333 R372 R389 M419 L420	L333-M370 CarbonylContact O-C 3.6Å; L333-M370 WeakPolarHBondContact O-CA 3.19Å; M370-R372 HydrophobicContact CG-CG 3.91Å; M370-R372 HydrophobicContact SD-CG 4.06Å; M370-R372 VanDerWaalsContact SD-CZ 3.6Å; M370-R389 HydrophobicContact CE-CB 3.69Å; M370-R389 HydrophobicContact CE-CG 3.84Å; M370-M419 HydrophobicContact CE-CG 3.95Å; M370-M419 HydrophobicContact CE-SD 3.66Å; M370-M419 HydrophobicContact SD-CG 4.27Å; M370-M419 HydrophobicContact SD-SD 3.53Å; M370-L420 WeakPolarHBondContact CE-O 3.49Å
371	L	90.6	Very high	89	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	128.1	161.2	179.2	67.7	0	0	0	108.1	L327 G332 L333 L335 I375 Y377	L327-L371 HydrophobicContact CD1-CD2 4.16Å; L327-L371 HydrophobicContact CD1-CG 4.27Å; G332-L371 CarbonylContact C-O 3.54Å; G332-L371 WeakPolarHBondContact CA-O 3.4Å; L333-L371 PolarHBondContact N-O 3.01Å; L333-L371 PolarHBondContact O-N 3.28Å; L335-L371 HydrophobicContact CD1-CB 3.87Å; L335-L371 HydrophobicContact CD1-CD2 4.27Å; L335-L371 HydrophobicContact CG-CB 4.42Å; L371-I375 HydrophobicContact CD1-CG2 4.44Å; L371-I375 HydrophobicContact CD2-CG2 4.11Å; L371-I375 HydrophobicContact CG-CG2 4.21Å; L371-Y377 HydrophobicContact CD2-CD1 3.86Å; L371-Y377 HydrophobicContact CD2-CD2 3.39Å; L371-Y377 HydrophobicContact CD2-CE1 4.35Å; L371-Y377 HydrophobicContact CD2-CE2 3.93Å; L371-Y377 HydrophobicContact CD2-CG 3.33Å
372	R	88.2	Confident	89.7	Confident	100 Å²	100	58 Å²	58	38%	0.377	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	147.8	177.1	-63.4	179.4	179.4	-93.7	-3.7	110.5	M370 M419	M370-R372 HydrophobicContact CG-CG 3.91Å; M370-R372 HydrophobicContact SD-CG 4.06Å; M370-R372 VanDerWaalsContact SD-CZ 3.6Å; R372-M419 PolarHBondContact NH1-SD 2.93Å; R372-M419 VanDerWaalsContact NH1-SD 3.44Å
373	G	88.1	Confident	89.9	Confident	17 Å²	17	53.7 Å²	53.7	18%	0.175	28%	0.276	C	S	.	.	S	Bend	trans	-75.7	177.5	168.5	0	0	0	0	0	113.5	Q328 E331	Q328-G373 VanDerWaalsContact O-CA 3.31Å; Q328-G373 WeakPolarHBondContact O-CA 3.37Å; E331-G373 PolarHBondContact O-N 2.86Å
374	P	91.4	Very high	90	Very high	98 Å²	98	53.4 Å²	53.4	64%	0.636	28%	0.276	S	S	*	.	S	Bend	cis	-82.8	117.9	3.4	32	-32.1	0	0	0	111.9	L327 N329	L327-P374 VanDerWaalsContact O-CA 3.28Å; L327-P374 WeakPolarHBondContact O-CA 3.4Å; N329-P374 VanDerWaalsContact OD1-CB 3.29Å; N329-P374 WeakPolarHBondContact OD1-CB 3.5Å; N329-P374 VanDerWaalsContact OD1-CD 3.23Å; N329-P374 WeakPolarHBondContact OD1-CD 3.26Å; N329-P374 WeakPolarHBondContact OD1-CG 3.29Å
375	I	88.9	Confident	90	Very high	52 Å²	52	46.8 Å²	46.8	27%	0.267	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	145.3	179.8	-163.1	168	0	0	0	111.5	L327 I345 L371	L327-I375 HydrophobicContact CB-CG2 4.44Å; L327-I375 HydrophobicContact CD1-CG2 4.02Å; L327-I375 PolarHBondContact N-O 2.84Å; L327-I375 PolarHBondContact O-N 2.86Å; L327-I375 VanDerWaalsContact O-N 3.15Å; I345-I375 HydrophobicContact CG2-CD1 4.15Å; L371-I375 HydrophobicContact CD1-CG2 4.44Å; L371-I375 HydrophobicContact CD2-CG2 4.11Å; L371-I375 HydrophobicContact CG-CG2 4.21Å
376	E	87.5	Confident	90	Very high	85 Å²	85	46 Å²	46	40%	0.397	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.1	162.5	-178.6	-177.7	175.4	0	0	109	H280 A324 I326	H280-E376 IonicContact CE1-OE1 2.6Å; H280-E376 IonicContact CE1-OE2 3.21Å; H280-E376 PolarHBondContact CE1-OE2 2.88Å; H280-E376 VanDerWaalsContact CE1-OE2 3.29Å; H280-E376 IonicContact CG-OE1 3.22Å; H280-E376 IonicContact ND1-OE1 2.81Å; H280-E376 PolarHBondContact ND1-OE1 3.26Å; H280-E376 IonicContact ND1-OE2 3.68Å; H280-E376 PolarHBondContact ND1-OE2 2.99Å; A324-E376 HydrophobicContact CB-CG 3.77Å; A324-E376 WeakPolarHBondContact CB-OE1 3.38Å; I326-E376 HydrophobicContact CG1-CG 4.47Å
377	Y	90.1	Very high	90.1	Very high	10 Å²	10	46.7 Å²	46.7	4%	0.039	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.4	-177.8	-174.4	-108.3	0	0	0	112.3	Y325 L333 L335 L371 P379 P380	Y325-Y377 WeakPolarHBondContact CB-O 3.42Å; Y325-Y377 PolarHBondContact N-O 3.49Å; Y325-Y377 PolarHBondContact O-N 2.86Å; L333-Y377 HydrophobicContact CD1-CD1 4.07Å; L335-Y377 HydrophobicContact CD1-CE1 3.75Å; L335-Y377 HydrophobicContact CD1-CE2 4.43Å; L335-Y377 HydrophobicContact CD2-CE1 3.85Å; L335-Y377 HydrophobicContact CG-CE1 4.49Å; L371-Y377 HydrophobicContact CD2-CD1 3.86Å; L371-Y377 HydrophobicContact CD2-CD2 3.39Å; L371-Y377 HydrophobicContact CD2-CE1 4.35Å; L371-Y377 HydrophobicContact CD2-CE2 3.93Å; L371-Y377 HydrophobicContact CD2-CG 3.33Å; Y377-P379 HydrophobicContact CE1-CB 3.89Å; Y377-P380 VanDerWaalsContact OH-CD 3.28Å; Y377-P380 WeakPolarHBondContact OH-CD 3.29Å
378	I	90.2	Very high	90.2	Very high	25 Å²	25	49.4 Å²	49.4	13%	0.128	24%	0.243	C	C	.	.			trans	-113.6	114.5	169.9	-65.4	174.3	0	0	0	106.6	F282 L302 R304 A324 P380	F282-I378 HydrophobicContact CB-CD1 4.38Å; F282-I378 HydrophobicContact CB-CG2 3.8Å; F282-I378 HydrophobicContact CD1-CG1 4.17Å; F282-I378 HydrophobicContact CD1-CG2 3.84Å; F282-I378 HydrophobicContact CD2-CG2 3.94Å; F282-I378 HydrophobicContact CE1-CG2 4.38Å; F282-I378 HydrophobicContact CE2-CG2 4.47Å; F282-I378 HydrophobicContact CG-CG2 3.59Å; L302-I378 HydrophobicContact CD1-CG2 4.04Å; L302-I378 HydrophobicContact CD2-CG2 4.15Å; R304-I378 HydrophobicContact CB-CD1 3.89Å; R304-I378 HydrophobicContact CB-CG2 4.49Å; A324-I378 HydrophobicContact CB-CD1 4.03Å; A324-I378 HydrophobicContact CB-CG1 3.56Å; I378-P380 WeakPolarHBondContact O-CD 3.42Å
379	P	90.9	Very high	90.2	Very high	15 Å²	15	45.6 Å²	45.6	10%	0.097	23%	0.229	C	C	.	.			trans	-63.9	129.7	-176.5	24.8	-33.3	0	0	0	111.1	F282 Y325 Y377 V385	F282-P379 HydrophobicContact CE2-CG 4.12Å; F282-P379 HydrophobicContact CZ-CG 3.8Å; Y325-P379 HydrophobicContact CE2-CG 4.13Å; Y377-P379 HydrophobicContact CE1-CB 3.89Å; P379-V385 HydrophobicContact CB-CG2 4.31Å; P379-V385 HydrophobicContact CG-CG2 4.34Å
380	P	90.1	Very high	90.3	Very high	38 Å²	38	48.7 Å²	48.7	25%	0.247	25%	0.247	C	C	.	.			trans	-57.8	161.6	164.2	-22.6	33.8	0	0	0	111.8	Y377 I378 E382 V383	Y377-P380 VanDerWaalsContact OH-CD 3.28Å; Y377-P380 WeakPolarHBondContact OH-CD 3.29Å; I378-P380 WeakPolarHBondContact O-CD 3.42Å; P380-E382 WeakPolarHBondContact CB-OE2 3.35Å; P380-E382 PolarHBondContact O-N 2.85Å; P380-V383 HydrophobicContact CB-CG2 4.17Å; P380-V383 HydrophobicContact CG-CG2 4.12Å; P380-V383 PolarHBondContact O-N 2.87Å
381	V	88.9	Confident	90.4	Very high	40 Å²	40	49.4 Å²	49.4	24%	0.242	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-32	-179.3	176.6	0	0	0	0	111.7	K300 L302 V383	K300-V381 HydrophobicContact CB-CG1 3.69Å; K300-V381 HydrophobicContact CB-CG2 4.34Å; K300-V381 HydrophobicContact CD-CG1 3.72Å; K300-V381 HydrophobicContact CG-CG1 4.35Å; L302-V381 HydrophobicContact CB-CG2 4.02Å; V381-V383 PolarHBondContact O-N 2.94Å
382	E	90	Very high	90.5	Very high	65 Å²	65	50.9 Å²	50.9	30%	0.304	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-7.6	-178.7	-51.8	84.7	171.1	0	0	112.7	K338 E339 F341 P380	K338-E382 PolarHBondContact N-O 2.78Å; E339-E382 HydrophobicContact CB-CB 4.24Å; E339-E382 HydrophobicContact CB-CG 4.29Å; F341-E382 HydrophobicContact CB-CB 4.04Å; F341-E382 HydrophobicContact CB-CG 4.02Å; F341-E382 HydrophobicContact CD1-CB 3.75Å; F341-E382 HydrophobicContact CE1-CB 4.46Å; F341-E382 HydrophobicContact CG-CB 3.95Å; F341-E382 HydrophobicContact CG-CG 4.43Å; P380-E382 WeakPolarHBondContact CB-OE2 3.35Å; P380-E382 PolarHBondContact O-N 2.85Å
383	V	91	Very high	90.7	Very high	9 Å²	9	50.7 Å²	50.7	6%	0.055	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	142.1	-174.9	-175.1	0	0	0	0	111.5	L335 F341 W369 P380 V381	L335-V383 HydrophobicContact CB-CG1 3.97Å; L335-V383 HydrophobicContact CD1-CG1 4.3Å; L335-V383 HydrophobicContact CD2-CG1 4.14Å; L335-V383 HydrophobicContact CG-CG1 4.36Å; F341-V383 HydrophobicContact CD1-CG2 4.38Å; F341-V383 HydrophobicContact CE1-CG2 3.47Å; F341-V383 VanDerWaalsContact CE1-CG2 3.47Å; F341-V383 HydrophobicContact CE2-CG2 4.02Å; F341-V383 HydrophobicContact CZ-CG2 3.26Å; W369-V383 HydrophobicContact CH2-CG1 4.09Å; W369-V383 HydrophobicContact CH2-CG2 4.12Å; W369-V383 HydrophobicContact CZ2-CG1 4.28Å; W369-V383 HydrophobicContact CZ2-CG2 4.42Å; P380-V383 HydrophobicContact CB-CG2 4.17Å; P380-V383 HydrophobicContact CG-CG2 4.12Å; P380-V383 PolarHBondContact O-N 2.87Å; V381-V383 PolarHBondContact O-N 2.94Å
384	E	91.8	Very high	90.9	Very high	32 Å²	32	50.5 Å²	50.5	15%	0.15	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.9	170.8	-179.3	160.6	-112.8	0	0	110.9	R319 L335 R336 K338 I386	R319-E384 IonicContact NH2-OE1 2.73Å; L335-E384 CarbonylContact C-O 3.53Å; L335-E384 WeakPolarHBondContact CA-O 3.16Å; R336-E384 IonicContact CZ-OE2 3.96Å; R336-E384 PolarHBondContact N-O 3.22Å; R336-E384 IonicContact NE-OE2 3.14Å; R336-E384 PolarHBondContact NE-OE2 3.03Å; R336-E384 IonicContact NH2-OE2 2.7Å; R336-E384 PolarHBondContact NH2-OE2 3.44Å; R336-E384 PolarHBondContact O-N 2.74Å; K338-E384 HydrophobicContact CD-CB 4.23Å; K338-E384 WeakPolarHBondContact CE-OE1 3.29Å; K338-E384 VanDerWaalsContact CE-OE2 3.26Å; K338-E384 WeakPolarHBondContact CE-OE2 3.45Å; K338-E384 HydrophobicContact CG-CB 4.32Å; K338-E384 IonicContact NZ-OE1 3.79Å; K338-E384 PolarHBondContact NZ-OE1 2.75Å; K338-E384 IonicContact NZ-OE2 3.65Å; E384-I386 PolarHBondContact O-N 3.43Å
385	V	91.5	Very high	90.7	Very high	32 Å²	32	50.5 Å²	50.5	19%	0.194	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	117.1	166.2	-174.2	0	0	0	0	107.8	Y325 L333 L335 P379	Y325-V385 HydrophobicContact CD2-CG2 4.41Å; Y325-V385 HydrophobicContact CE1-CG1 4.15Å; Y325-V385 HydrophobicContact CE1-CG2 4.44Å; Y325-V385 HydrophobicContact CE2-CG2 3.81Å; L333-V385 HydrophobicContact CB-CG1 4.37Å; L333-V385 HydrophobicContact CD1-CG1 4.18Å; L333-V385 HydrophobicContact CD1-CG2 4.26Å; L333-V385 HydrophobicContact CD2-CG1 3.86Å; L333-V385 HydrophobicContact CG-CG1 4.35Å; L335-V385 HydrophobicContact CD2-CB 4.32Å; L335-V385 HydrophobicContact CD2-CG2 3.75Å; P379-V385 HydrophobicContact CB-CG2 4.31Å; P379-V385 HydrophobicContact CG-CG2 4.34Å
386	I	89.9	Confident	90.7	Very high	68 Å²	68	51.6 Å²	51.6	35%	0.349	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-47.5	176.1	-63.2	-176	0	0	0	110.5	I334 R336 E384	I334-I386 HydrophobicContact CG2-CB 4.34Å; I334-I386 PolarHBondContact O-N 3.42Å; R336-I386 HydrophobicContact CB-CD1 3.5Å; R336-I386 VanDerWaalsContact CB-CD1 3.5Å; R336-I386 HydrophobicContact CB-CG1 3.9Å; R336-I386 HydrophobicContact CG-CD1 4.31Å; E384-I386 PolarHBondContact O-N 3.43Å
387	D	89.6	Confident	90.7	Very high	60 Å²	60	51.2 Å²	51.2	32%	0.321	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	153.1	-164.4	-164.9	10.5	0	0	0	111.2	L333 I334 R389	L333-D387 WeakPolarHBondContact CA-O 3.34Å; I334-D387 HydrophobicContact CB-CB 4.12Å; I334-D387 HydrophobicContact CD1-CB 4.21Å; I334-D387 HydrophobicContact CG1-CB 4.43Å; I334-D387 PolarHBondContact N-O 3.16Å; D387-R389 IonicContact OD2-CZ 3.39Å; D387-R389 IonicContact OD2-NE 3.81Å; D387-R389 PolarHBondContact OD2-NE 3.36Å; D387-R389 IonicContact OD2-NH2 3.85Å; D387-R389 PolarHBondContact OD2-NH2 3.03Å
388	R	92.3	Very high	90.7	Very high	117 Å²	117	54.6 Å²	54.6	44%	0.442	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.1	173	-174	-178.7	-171.3	136.4	6.5	108	I326 E331 L333	I326-R388 PolarHBondContact O-NH2 3.03Å; E331-R388 IonicContact OE1-CZ 3.14Å; E331-R388 IonicContact OE1-NE 2.73Å; E331-R388 PolarHBondContact OE1-NE 3.1Å; E331-R388 IonicContact OE1-NH2 2.7Å; E331-R388 PolarHBondContact OE1-NH2 2.95Å; E331-R388 IonicContact OE2-CZ 3.9Å; E331-R388 IonicContact OE2-NE 2.72Å; E331-R388 IonicContact OE2-NH2 2.96Å; E331-R388 PolarHBondContact OE2-NH2 3.41Å; L333-R388 HydrophobicContact CD2-CB 4Å; L333-R388 HydrophobicContact CD2-CG 4.05Å
389	R	90.8	Very high	90.8	Very high	51 Å²	51	53.5 Å²	53.5	19%	0.192	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.8	-178.7	-67.3	-68.3	167.1	109.4	-7	109.6	E331 G332 I334 M370 D387 M419 E424	E331-R389 CarbonylContact C-O 3.59Å; E331-R389 WeakPolarHBondContact CA-O 3.27Å; G332-R389 PolarHBondContact N-O 3.2Å; G332-R389 PolarHBondContact O-N 2.96Å; I334-R389 HydrophobicContact CD1-CG 3.78Å; I334-R389 VanDerWaalsContact CD1-CZ 3.48Å; I334-R389 HydrophobicContact CG1-CG 3.96Å; M370-R389 HydrophobicContact CE-CB 3.69Å; M370-R389 HydrophobicContact CE-CG 3.84Å; D387-R389 IonicContact OD2-CZ 3.39Å; D387-R389 IonicContact OD2-NE 3.81Å; D387-R389 PolarHBondContact OD2-NE 3.36Å; D387-R389 IonicContact OD2-NH2 3.85Å; D387-R389 PolarHBondContact OD2-NH2 3.03Å; R389-M419 HydrophobicContact CB-CG 4.14Å; R389-E424 PolarHBondContact NH1-O 2.67Å
390	N	93	Very high	91	Very high	80 Å²	80	52.9 Å²	52.9	43%	0.428	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	154.1	174	-61.9	14.3	0	0	0	108.5	D330 I392	D330-N390 CarbonylContact O-C 3.55Å; D330-N390 VanDerWaalsContact O-CA 3.3Å; D330-N390 WeakPolarHBondContact O-CA 3.47Å; N390-I392 PolarHBondContact O-N 3.34Å
391	V	93	Very high	91.3	Very high	40 Å²	40	51 Å²	51	24%	0.242	27%	0.268	C	S	.	.			trans	-62.7	130.3	169.6	175.4	0	0	0	0	108.9	D330 P393 A417 M419	D330-V391 HydrophobicContact CB-CB 4.04Å; D330-V391 HydrophobicContact CB-CG2 3.81Å; D330-V391 WeakPolarHBondContact O-CG2 3.21Å; D330-V391 PolarHBondContact O-N 3.49Å; V391-P393 WeakPolarHBondContact O-CD 3.37Å; V391-A417 HydrophobicContact CG1-CB 3.55Å; V391-M419 HydrophobicContact CG2-CB 3.99Å; V391-M419 HydrophobicContact CG2-CE 3.72Å
392	I	92.6	Very high	91.6	Very high	35 Å²	35	49.1 Å²	49.1	18%	0.179	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-87.8	111.6	169	-58	170.4	0	0	0	106.6	N390 L394 I400 A417 Y418 L420 L426	N390-I392 PolarHBondContact O-N 3.34Å; I392-L394 HydrophobicContact CG2-CD2 3.91Å; I392-L394 HydrophobicContact CG2-CG 4.2Å; I392-I400 HydrophobicContact CD1-CD1 3.77Å; I392-I400 HydrophobicContact CG2-CG2 4.36Å; I392-A417 CarbonylContact O-C 3.46Å; I392-A417 WeakPolarHBondContact O-CA 3.28Å; I392-Y418 PolarHBondContact N-O 3.4Å; I392-Y418 PolarHBondContact O-N 3.34Å; I392-L420 HydrophobicContact CD1-CD1 4.25Å; I392-L426 HydrophobicContact CD1-CD2 4.16Å
393	P	92.3	Very high	91.9	Very high	96 Å²	96	50.7 Å²	50.7	62%	0.623	26%	0.26	S	S	*	.			trans	-69.8	132.1	174.5	29.5	-33.5	0	0	0	109.4	V391	V391-P393 WeakPolarHBondContact O-CD 3.37Å
394	L	92	Very high	92	Very high	13 Å²	13	51.5 Å²	51.5	7%	0.068	26%	0.264	C	S	.	.			trans	-133.4	117.8	178.9	-58.8	169.3	0	0	0	108.3	I392 E398 I400 V413 G415 E416	I392-L394 HydrophobicContact CG2-CD2 3.91Å; I392-L394 HydrophobicContact CG2-CG 4.2Å; L394-E398 HydrophobicContact CB-CB 4.42Å; L394-E398 HydrophobicContact CD2-CB 4.16Å; L394-I400 HydrophobicContact CD1-CD1 4.16Å; L394-I400 HydrophobicContact CD1-CG1 3.88Å; L394-I400 HydrophobicContact CD1-CG2 4.46Å; L394-I400 HydrophobicContact CD2-CG2 4.05Å; L394-V413 HydrophobicContact CD1-CG1 4.47Å; L394-G415 CarbonylContact O-C 3.57Å; L394-E416 WeakPolarHBondContact CB-O 3.34Å; L394-E416 WeakPolarHBondContact CD1-O 3.32Å
395	D	89	Confident	91.9	Very high	97 Å²	97	53.2 Å²	53.2	52%	0.519	28%	0.277	S	S	.	.			trans	-73.7	166.2	169.8	-176.7	29.6	0	0	0	110.4	N397 E398 G415	D395-N397 PolarHBondContact O-N 3.5Å; D395-E398 PolarHBondContact O-N 2.96Å; D395-E398 VanDerWaalsContact O-O 3.11Å; D395-G415 VanDerWaalsContact O-CA 3.32Å; D395-G415 WeakPolarHBondContact O-CA 3.25Å; D395-G415 PolarHBondContact O-N 2.94Å
396	C	88.5	Confident	91.8	Very high	75 Å²	75	58.5 Å²	58.5	51%	0.507	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-20.5	178.8	60.1	0	0	0	0	115.3	M497	C396-M497 WeakPolarHBondContact O-CE 3.4Å
397	N	86.9	Confident	91.9	Very high	77 Å²	77	59.8 Å²	59.8	41%	0.412	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-1.9	177.4	-61.4	-59.8	0	0	0	113.7	D395 L495	D395-N397 PolarHBondContact O-N 3.5Å; N397-L495 HydrophobicContact CB-CD2 3.57Å; N397-L495 WeakPolarHBondContact OD1-CD2 3.49Å
398	E	90.4	Very high	91.9	Very high	81 Å²	81	58.7 Å²	58.7	38%	0.379	31%	0.313	S	S	.	.			trans	-113.8	153.3	-179.4	-67	-167.4	-167.1	0	0	111.7	L394 D395 I414 G415 R465	L394-E398 HydrophobicContact CB-CB 4.42Å; L394-E398 HydrophobicContact CD2-CB 4.16Å; D395-E398 PolarHBondContact O-N 2.96Å; D395-E398 VanDerWaalsContact O-O 3.11Å; E398-I414 WeakPolarHBondContact O-CA 3.34Å; E398-I414 WeakPolarHBondContact O-CG2 3.22Å; E398-G415 PolarHBondContact O-N 3.04Å; E398-G415 VanDerWaalsContact O-N 3.12Å; E398-R465 IonicContact OE2-CZ 2.77Å; E398-R465 IonicContact OE2-NH1 2.78Å; E398-R465 PolarHBondContact OE2-NH1 3.44Å; E398-R465 IonicContact OE2-NH2 3.01Å
399	G	92.5	Very high	91.9	Very high	2 Å²	2	58.8 Å²	58.8	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	172.5	171.9	0	0	0	0	0	113.2	V413 R465 V466	G399-V413 CarbonylContact C-O 3.38Å; G399-V413 WeakPolarHBondContact CA-O 3.31Å; G399-R465 CarbonylContact O-C 3.47Å; G399-R465 WeakPolarHBondContact O-CA 3.41Å; G399-V466 VanDerWaalsContact C-CG2 3.49Å; G399-V466 PolarHBondContact O-N 2.89Å
400	I	95.4	Very high	92	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	150.3	173.5	56.8	-178.8	0	0	0	110.8	I392 L394 V402 A412 V413 Y418 L420 L426 T464 R465	I392-I400 HydrophobicContact CD1-CD1 3.77Å; I392-I400 HydrophobicContact CG2-CG2 4.36Å; L394-I400 HydrophobicContact CD1-CD1 4.16Å; L394-I400 HydrophobicContact CD1-CG1 3.88Å; L394-I400 HydrophobicContact CD1-CG2 4.46Å; L394-I400 HydrophobicContact CD2-CG2 4.05Å; I400-V402 HydrophobicContact CD1-CG2 3.93Å; I400-V402 HydrophobicContact CG1-CG2 3.86Å; I400-A412 WeakPolarHBondContact O-CA 3.49Å; I400-V413 HydrophobicContact CG1-CB 4.31Å; I400-V413 PolarHBondContact N-O 3.33Å; I400-V413 PolarHBondContact O-N 3.1Å; I400-Y418 HydrophobicContact CD1-CD1 4.31Å; I400-L420 HydrophobicContact CD1-CD2 4.48Å; I400-L426 HydrophobicContact CB-CD2 3.95Å; I400-L426 HydrophobicContact CD1-CD2 3.94Å; I400-L426 HydrophobicContact CG1-CD2 4.41Å; I400-L426 HydrophobicContact CG2-CD2 4.17Å; I400-T464 WeakPolarHBondContact CA-O 3.29Å; I400-R465 HydrophobicContact CG2-CG 4.34Å
401	Y	96.7	Very high	92	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.2	166.5	-60	-63.1	0	0	0	109.9	R411 A412 L426 W427 K429 T464 R465 V466 V467 L498 P500	Y401-R411 WeakPolarHBondContact CA-O 3.45Å; Y401-A412 HydrophobicContact CD1-CB 4.11Å; Y401-A412 HydrophobicContact CE1-CB 4.1Å; Y401-L426 WeakPolarHBondContact O-CA 3.28Å; Y401-W427 WeakPolarHBondContact CB-O 3.47Å; Y401-W427 HydrophobicContact CD2-CE3 4.25Å; Y401-W427 AromaticContact CG-CE3 3.97Å; Y401-W427 HydrophobicContact CG-CE3 3.97Å; Y401-W427 HydrophobicContact CG-CZ3 4.44Å; Y401-W427 PolarHBondContact O-N 3.35Å; Y401-K429 HydrophobicContact CD2-CB 3.83Å; Y401-K429 HydrophobicContact CE2-CB 3.56Å; Y401-K429 HydrophobicContact CE2-CD 3.57Å; Y401-K429 HydrophobicContact CE2-CG 4.17Å; Y401-K429 WeakPolarHBondContact OH-CD 3.38Å; Y401-T464 PolarHBondContact N-O 3.05Å; Y401-R465 WeakPolarHBondContact CE2-O 3.23Å; Y401-V466 HydrophobicContact CD1-CG2 4.19Å; Y401-V466 HydrophobicContact CE1-CG2 3.88Å; Y401-V467 HydrophobicContact CE2-CG2 4.44Å; Y401-V467 PolarHBondContact OH-N 2.96Å; Y401-V467 VanDerWaalsContact OH-N 3.15Å; Y401-L498 WeakPolarHBondContact CE1-O 3.46Å; Y401-L498 PolarHBondContact OH-O 2.9Å; Y401-P500 HydrophobicContact CD1-CB 4.46Å; Y401-P500 HydrophobicContact CD1-CG 4.02Å; Y401-P500 HydrophobicContact CE1-CG 4.33Å
402	V	95	Very high	92	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.2	179.1	-176.7	0	0	0	0	108.9	I400 V410 R411 V413 Y418 L420 E424	I400-V402 HydrophobicContact CD1-CG2 3.93Å; I400-V402 HydrophobicContact CG1-CG2 3.86Å; V402-V410 WeakPolarHBondContact O-CA 3.46Å; V402-R411 HydrophobicContact CB-CG 4.4Å; V402-R411 PolarHBondContact N-O 3.38Å; V402-R411 PolarHBondContact O-N 2.68Å; V402-V413 HydrophobicContact CB-CG2 4.49Å; V402-V413 HydrophobicContact CG2-CB 4.4Å; V402-V413 HydrophobicContact CG2-CG2 3.78Å; V402-Y418 HydrophobicContact CG2-CD1 4.38Å; V402-Y418 HydrophobicContact CG2-CE1 4.27Å; V402-L420 HydrophobicContact CB-CD2 4.27Å; V402-L420 HydrophobicContact CG1-CD2 3.66Å; V402-L420 HydrophobicContact CG2-CD2 3.77Å; V402-E424 HydrophobicContact CG1-CB 3.86Å; V402-E424 HydrophobicContact CG1-CG 3.74Å
403	R	95.3	Very high	92	Very high	97 Å²	97	56 Å²	56	37%	0.366	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.2	170.6	176.3	169.7	-180	-126.3	6.2	109.8	Q409 V410 E424 E425 W427	R403-Q409 WeakPolarHBondContact CA-O 3.45Å; R403-V410 HydrophobicContact CB-CG2 4.11Å; R403-V410 HydrophobicContact CG-CG2 4.11Å; R403-E424 WeakPolarHBondContact O-CA 3.38Å; R403-E425 HydrophobicContact CB-CG 3.97Å; R403-E425 WeakPolarHBondContact CD-OE1 3.21Å; R403-E425 HydrophobicContact CG-CG 4.38Å; R403-E425 IonicContact CZ-OE1 2.75Å; R403-E425 PolarHBondContact N-O 2.9Å; R403-E425 IonicContact NE-OE1 3.87Å; R403-E425 IonicContact NH1-OE1 3.88Å; R403-E425 PolarHBondContact NH1-OE1 3.2Å; R403-E425 PolarHBondContact O-N 3.31Å; R403-W427 HydrophobicContact CB-CB 3.93Å; R403-W427 HydrophobicContact CB-CG 4.39Å
404	N	93.4	Very high	92	Very high	26 Å²	26	54.7 Å²	54.7	14%	0.139	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	122	167.3	-177	-74.4	0	0	0	109.1	Q406 T407 G408 Q409 D423	N404-Q406 WeakPolarHBondContact OD1-CB 3.4Å; N404-Q406 PolarHBondContact OD1-N 3.03Å; N404-T407 WeakPolarHBondContact CB-OG1 3.43Å; N404-T407 PolarHBondContact OD1-N 3.02Å; N404-T407 PolarHBondContact OD1-OG1 3.26Å; N404-G408 CarbonylContact O-C 3.59Å; N404-G408 WeakPolarHBondContact O-CA 3.39Å; N404-G408 PolarHBondContact O-N 2.97Å; N404-Q409 PolarHBondContact N-O 3.45Å; N404-D423 CarbonylContact C-O 3.6Å; N404-D423 WeakPolarHBondContact CA-O 3.32Å
405	T	89.7	Confident	91.9	Very high	69 Å²	69	55.9 Å²	55.9	42%	0.423	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-22.8	-175.2	58.8	0	0	0	0	113.9	D423 E425	T405-D423 WeakPolarHBondContact CB-O 3.32Å; T405-D423 PolarHBondContact N-O 3.46Å; T405-D423 VanDerWaalsContact OG1-C 3.28Å; T405-D423 WeakPolarHBondContact OG1-CA 3.34Å; T405-D423 PolarHBondContact OG1-O 3.48Å; T405-E425 HydrophobicContact CG2-CB 4.25Å; T405-E425 HydrophobicContact CG2-CG 3.87Å
406	Q	89.3	Confident	91.9	Very high	143 Å²	143	56.5 Å²	56.5	67%	0.668	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-47.2	175.4	-62.1	-172.6	6.4	0	0	112.1	N404 D423	N404-Q406 WeakPolarHBondContact OD1-CB 3.4Å; N404-Q406 PolarHBondContact OD1-N 3.03Å; Q406-D423 HydrophobicContact CG-CB 4.2Å; Q406-D423 PolarHBondContact NE2-OD1 2.57Å; Q406-D423 PolarHBondContact NE2-OD2 3.22Å
407	T	92.8	Very high	91.9	Very high	95 Å²	95	56.3 Å²	56.3	58%	0.583	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-16.3	-175.2	65.8	0	0	0	0	113.5	N404 Q409	N404-T407 WeakPolarHBondContact CB-OG1 3.43Å; N404-T407 PolarHBondContact OD1-N 3.02Å; N404-T407 PolarHBondContact OD1-OG1 3.26Å; T407-Q409 PolarHBondContact O-N 3.43Å; T407-Q409 WeakPolarHBondContact OG1-CB 3.28Å; T407-Q409 PolarHBondContact OG1-N 3.4Å
408	G	89.2	Confident	92.2	Very high	36 Å²	36	54.6 Å²	54.6	37%	0.371	30%	0.301	S	S	.	.			trans	72.1	-0.5	-171.7	0	0	0	0	0	114.5	N404 V410	N404-G408 CarbonylContact O-C 3.59Å; N404-G408 WeakPolarHBondContact O-CA 3.39Å; N404-G408 PolarHBondContact O-N 2.97Å; G408-V410 PolarHBondContact O-N 2.99Å
409	Q	92	Very high	92.2	Very high	119 Å²	119	51.2 Å²	51.2	56%	0.556	29%	0.285	S	S	*	.			trans	-68.5	126.3	-176.5	-175.7	177.5	-0.4	0	0	111.2	R403 N404 T407	R403-Q409 WeakPolarHBondContact CA-O 3.45Å; N404-Q409 PolarHBondContact N-O 3.45Å; T407-Q409 PolarHBondContact O-N 3.43Å; T407-Q409 WeakPolarHBondContact OG1-CB 3.28Å; T407-Q409 PolarHBondContact OG1-N 3.4Å
410	V	93.2	Very high	92.2	Very high	29 Å²	29	51.7 Å²	51.7	18%	0.176	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	137.5	172.4	-168.1	0	0	0	0	109.9	V402 R403 G408 W427 P500	V402-V410 WeakPolarHBondContact O-CA 3.46Å; R403-V410 HydrophobicContact CB-CG2 4.11Å; R403-V410 HydrophobicContact CG-CG2 4.11Å; G408-V410 PolarHBondContact O-N 2.99Å; V410-W427 HydrophobicContact CG1-CB 4.06Å; V410-W427 HydrophobicContact CG1-CD2 3.71Å; V410-W427 HydrophobicContact CG1-CE3 3.73Å; V410-W427 HydrophobicContact CG1-CG 3.87Å; V410-W427 HydrophobicContact CG1-CZ3 4.36Å; V410-W427 HydrophobicContact CG2-CD2 4.26Å; V410-W427 HydrophobicContact CG2-CG 4.15Å; V410-P500 HydrophobicContact CB-CB 4.15Å; V410-P500 HydrophobicContact CB-CG 4.35Å; V410-P500 HydrophobicContact CG1-CB 3.76Å; V410-P500 HydrophobicContact CG1-CG 3.87Å
411	R	92.6	Very high	92	Very high	75 Å²	75	53.3 Å²	53.3	28%	0.283	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	158.5	173.5	66.4	-174.3	-172.1	-87.7	1.3	110.7	Y401 V402 V413 Y418 E424	Y401-R411 WeakPolarHBondContact CA-O 3.45Å; V402-R411 HydrophobicContact CB-CG 4.4Å; V402-R411 PolarHBondContact N-O 3.38Å; V402-R411 PolarHBondContact O-N 2.68Å; R411-V413 HydrophobicContact CG-CG2 4.49Å; R411-Y418 PolarHBondContact NH2-OH 3.14Å; R411-E424 IonicContact CZ-OE1 2.7Å; R411-E424 VanDerWaalsContact CZ-OE1 3.29Å; R411-E424 IonicContact NH1-OE1 3.98Å; R411-E424 PolarHBondContact NH1-OE1 3.02Å; R411-E424 IonicContact NH2-OE1 3.95Å; R411-E424 PolarHBondContact NH2-OE1 3.16Å; R411-E424 IonicContact NH2-OE2 3.2Å
412	A	93.3	Very high	91.6	Very high	34 Å²	34	55.7 Å²	55.7	28%	0.281	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	136.9	165.4	0	0	0	0	0	109.1	I400 Y401 I414 V466	I400-A412 WeakPolarHBondContact O-CA 3.49Å; Y401-A412 HydrophobicContact CD1-CB 4.11Å; Y401-A412 HydrophobicContact CE1-CB 4.1Å; A412-I414 HydrophobicContact CB-CD1 4.26Å; A412-I414 HydrophobicContact CB-CG1 4.33Å; A412-V466 HydrophobicContact CB-CG2 3.76Å
413	V	93.3	Very high	91.5	Very high	9 Å²	9	57 Å²	57	6%	0.055	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.1	167.4	178.5	0	0	0	0	106.8	L394 G399 I400 V402 R411 E416 Y418	L394-V413 HydrophobicContact CD1-CG1 4.47Å; G399-V413 CarbonylContact C-O 3.38Å; G399-V413 WeakPolarHBondContact CA-O 3.31Å; I400-V413 HydrophobicContact CG1-CB 4.31Å; I400-V413 PolarHBondContact N-O 3.33Å; I400-V413 PolarHBondContact O-N 3.1Å; V402-V413 HydrophobicContact CB-CG2 4.49Å; V402-V413 HydrophobicContact CG2-CB 4.4Å; V402-V413 HydrophobicContact CG2-CG2 3.78Å; R411-V413 HydrophobicContact CG-CG2 4.49Å; V413-E416 HydrophobicContact CG1-CG 3.69Å; V413-E416 WeakPolarHBondContact CG1-OE1 3.44Å; V413-Y418 HydrophobicContact CG1-CD2 3.69Å; V413-Y418 HydrophobicContact CG1-CE2 4.35Å; V413-Y418 HydrophobicContact CG1-CG 3.87Å; V413-Y418 HydrophobicContact CG2-CD2 4.42Å; V413-Y418 HydrophobicContact CG2-CE2 4.4Å
414	I	92.3	Very high	91.4	Very high	69 Å²	69	52.9 Å²	52.9	35%	0.354	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	136.3	-167.3	-58.7	172.7	0	0	0	108.5	E398 A412 E416 V466 M497	E398-I414 WeakPolarHBondContact O-CA 3.34Å; E398-I414 WeakPolarHBondContact O-CG2 3.22Å; A412-I414 HydrophobicContact CB-CD1 4.26Å; A412-I414 HydrophobicContact CB-CG1 4.33Å; I414-E416 VanDerWaalsContact C-N 3.28Å; I414-E416 PolarHBondContact O-N 3.08Å; I414-V466 HydrophobicContact CD1-CG1 4.31Å; I414-V466 HydrophobicContact CG1-CG2 4.2Å; I414-M497 HydrophobicContact CD1-CB 4.43Å; I414-M497 HydrophobicContact CD1-SD 4.09Å; I414-M497 HydrophobicContact CG2-CE 4.06Å; I414-M497 HydrophobicContact CG2-SD 3.71Å
415	G	88.8	Confident	91.4	Very high	39 Å²	39	55 Å²	55	40%	0.402	31%	0.308	S	S	.	.	S	Bend	trans	72	9	169.6	0	0	0	0	0	117.5	L394 D395 E398	L394-G415 CarbonylContact O-C 3.57Å; D395-G415 VanDerWaalsContact O-CA 3.32Å; D395-G415 WeakPolarHBondContact O-CA 3.25Å; D395-G415 PolarHBondContact O-N 2.94Å; E398-G415 PolarHBondContact O-N 3.04Å; E398-G415 VanDerWaalsContact O-N 3.12Å
416	E	90.1	Very high	91.6	Very high	110 Å²	110	54.9 Å²	54.9	51%	0.514	30%	0.304	S	S	.	.	S	Bend	trans	-133.7	139.5	175.6	63.5	178.9	-171.9	0	0	111.1	L394 V413 I414 Y418	L394-E416 WeakPolarHBondContact CB-O 3.34Å; L394-E416 WeakPolarHBondContact CD1-O 3.32Å; V413-E416 HydrophobicContact CG1-CG 3.69Å; V413-E416 WeakPolarHBondContact CG1-OE1 3.44Å; I414-E416 VanDerWaalsContact C-N 3.28Å; I414-E416 PolarHBondContact O-N 3.08Å; E416-Y418 PolarHBondContact O-N 3.11Å
417	A	88.9	Confident	91.9	Very high	70 Å²	70	51.4 Å²	51.4	58%	0.579	29%	0.285	S	S	*	.			trans	-69.8	114	179.3	0	0	0	0	0	109.9	V391 I392	V391-A417 HydrophobicContact CG1-CB 3.55Å; I392-A417 CarbonylContact O-C 3.46Å; I392-A417 WeakPolarHBondContact O-CA 3.28Å
418	Y	91.6	Very high	91.9	Very high	42 Å²	42	52.4 Å²	52.4	17%	0.165	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-118	130.6	-164	-159.9	-97	0	0	0	113.5	I392 I400 V402 R411 V413 E416 L420 E424	I392-Y418 PolarHBondContact N-O 3.4Å; I392-Y418 PolarHBondContact O-N 3.34Å; I400-Y418 HydrophobicContact CD1-CD1 4.31Å; V402-Y418 HydrophobicContact CG2-CD1 4.38Å; V402-Y418 HydrophobicContact CG2-CE1 4.27Å; R411-Y418 PolarHBondContact NH2-OH 3.14Å; V413-Y418 HydrophobicContact CG1-CD2 3.69Å; V413-Y418 HydrophobicContact CG1-CE2 4.35Å; V413-Y418 HydrophobicContact CG1-CG 3.87Å; V413-Y418 HydrophobicContact CG2-CD2 4.42Å; V413-Y418 HydrophobicContact CG2-CE2 4.4Å; E416-Y418 PolarHBondContact O-N 3.11Å; Y418-L420 HydrophobicContact CD1-CD2 4.32Å; Y418-L420 HydrophobicContact CE1-CD2 4.27Å; Y418-E424 PolarHBondContact OH-OE2 3.33Å
419	M	91.6	Very high	92.1	Very high	10 Å²	10	51.3 Å²	51.3	5%	0.049	27%	0.268	C	S	.	.			trans	-112.1	112.4	172.3	-174.3	-164.8	-67.1	0	0	110.1	D330 E331 M370 R372 R389 V391 N421	D330-M419 VanDerWaalsContact C-CE 3.41Å; D330-M419 VanDerWaalsContact O-CE 3.31Å; D330-M419 WeakPolarHBondContact O-CE 3.49Å; E331-M419 VanDerWaalsContact C-CE 3.45Å; M370-M419 HydrophobicContact CE-CG 3.95Å; M370-M419 HydrophobicContact CE-SD 3.66Å; M370-M419 HydrophobicContact SD-CG 4.27Å; M370-M419 HydrophobicContact SD-SD 3.53Å; R372-M419 PolarHBondContact NH1-SD 2.93Å; R372-M419 VanDerWaalsContact NH1-SD 3.44Å; R389-M419 HydrophobicContact CB-CG 4.14Å; V391-M419 HydrophobicContact CG2-CB 3.99Å; V391-M419 HydrophobicContact CG2-CE 3.72Å; M419-N421 PolarHBondContact O-N 3.34Å
420	L	92.4	Very high	92	Very high	12 Å²	12	53.8 Å²	53.8	6%	0.063	28%	0.277	C	S	.	.			trans	-57.4	121	177.4	-61.7	165.2	0	0	0	111.1	M370 I392 I400 V402 Y418 E424 L426	M370-L420 WeakPolarHBondContact CE-O 3.49Å; I392-L420 HydrophobicContact CD1-CD1 4.25Å; I400-L420 HydrophobicContact CD1-CD2 4.48Å; V402-L420 HydrophobicContact CB-CD2 4.27Å; V402-L420 HydrophobicContact CG1-CD2 3.66Å; V402-L420 HydrophobicContact CG2-CD2 3.77Å; Y418-L420 HydrophobicContact CD1-CD2 4.32Å; Y418-L420 HydrophobicContact CE1-CD2 4.27Å; L420-E424 HydrophobicContact CB-CB 4.2Å; L420-E424 HydrophobicContact CD2-CB 4.11Å; L420-L426 HydrophobicContact CD1-CD2 3.95Å; L420-L426 HydrophobicContact CD1-CG 3.83Å; L420-L426 HydrophobicContact CD2-CD2 4.45Å
421	N	90.5	Very high	91.9	Very high	35 Å²	35	53.6 Å²	53.6	19%	0.187	28%	0.275	C	S	.	.			trans	-71.8	179.3	178.8	69.2	47.5	0	0	0	113	M419 D423 E424	M419-N421 PolarHBondContact O-N 3.34Å; N421-D423 PolarHBondContact O-N 3.23Å; N421-D423 VanDerWaalsContact O-N 3.08Å; N421-D423 WeakPolarHBondContact OD1-CA 3.46Å; N421-D423 PolarHBondContact OD1-N 2.82Å; N421-E424 PolarHBondContact N-OE2 3.14Å; N421-E424 PolarHBondContact ND2-OE1 2.79Å; N421-E424 PolarHBondContact ND2-OE2 2.98Å; N421-E424 VanDerWaalsContact ND2-OE2 3.09Å; N421-E424 PolarHBondContact O-N 2.81Å; N421-E424 VanDerWaalsContact O-N 3.07Å; N421-E424 WeakPolarHBondContact OD1-CG 3.03Å; N421-E424 PolarHBondContact OD1-N 2.81Å
422	Q	88.8	Confident	91.7	Very high	51 Å²	51	53 Å²	53	24%	0.238	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.6	-177.2	71.1	-76	-20.2	0	0	115.1	I334 R368	I334-Q422 HydrophobicContact CG1-CB 4.4Å; I334-Q422 HydrophobicContact CG2-CB 4.05Å; R368-Q422 HydrophobicContact CB-CB 4.27Å; R368-Q422 HydrophobicContact CB-CG 4.23Å
423	D	91.5	Very high	91.4	Very high	27 Å²	27	55.4 Å²	55.4	14%	0.144	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	10.7	-178.2	-62	-61	0	0	0	111.9	N404 T405 Q406 N421	N404-D423 CarbonylContact C-O 3.6Å; N404-D423 WeakPolarHBondContact CA-O 3.32Å; T405-D423 WeakPolarHBondContact CB-O 3.32Å; T405-D423 PolarHBondContact N-O 3.46Å; T405-D423 VanDerWaalsContact OG1-C 3.28Å; T405-D423 WeakPolarHBondContact OG1-CA 3.34Å; T405-D423 PolarHBondContact OG1-O 3.48Å; Q406-D423 HydrophobicContact CG-CB 4.2Å; Q406-D423 PolarHBondContact NE2-OD1 2.57Å; Q406-D423 PolarHBondContact NE2-OD2 3.22Å; N421-D423 PolarHBondContact O-N 3.23Å; N421-D423 VanDerWaalsContact O-N 3.08Å; N421-D423 WeakPolarHBondContact OD1-CA 3.46Å; N421-D423 PolarHBondContact OD1-N 2.82Å
424	E	93.5	Very high	91	Very high	10 Å²	10	57.8 Å²	57.8	5%	0.047	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.4	-174.7	-77.3	175	169.7	0	0	114.1	R389 V402 R403 R411 Y418 L420 N421	R389-E424 PolarHBondContact NH1-O 2.67Å; V402-E424 HydrophobicContact CG1-CB 3.86Å; V402-E424 HydrophobicContact CG1-CG 3.74Å; R403-E424 WeakPolarHBondContact O-CA 3.38Å; R411-E424 IonicContact CZ-OE1 2.7Å; R411-E424 VanDerWaalsContact CZ-OE1 3.29Å; R411-E424 IonicContact NH1-OE1 3.98Å; R411-E424 PolarHBondContact NH1-OE1 3.02Å; R411-E424 IonicContact NH2-OE1 3.95Å; R411-E424 PolarHBondContact NH2-OE1 3.16Å; R411-E424 IonicContact NH2-OE2 3.2Å; Y418-E424 PolarHBondContact OH-OE2 3.33Å; L420-E424 HydrophobicContact CB-CB 4.2Å; L420-E424 HydrophobicContact CD2-CB 4.11Å; N421-E424 PolarHBondContact N-OE2 3.14Å; N421-E424 PolarHBondContact ND2-OE1 2.79Å; N421-E424 PolarHBondContact ND2-OE2 2.98Å; N421-E424 VanDerWaalsContact ND2-OE2 3.09Å; N421-E424 PolarHBondContact O-N 2.81Å; N421-E424 VanDerWaalsContact O-N 3.07Å; N421-E424 WeakPolarHBondContact OD1-CG 3.03Å; N421-E424 PolarHBondContact OD1-N 2.81Å
425	E	93.3	Very high	90.8	Very high	71 Å²	71	54.7 Å²	54.7	33%	0.332	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	156.4	176.3	67.2	-175.5	-172.5	0	0	110.8	R403 T405	R403-E425 HydrophobicContact CB-CG 3.97Å; R403-E425 WeakPolarHBondContact CD-OE1 3.21Å; R403-E425 HydrophobicContact CG-CG 4.38Å; R403-E425 IonicContact CZ-OE1 2.75Å; R403-E425 PolarHBondContact N-O 2.9Å; R403-E425 IonicContact NE-OE1 3.87Å; R403-E425 IonicContact NH1-OE1 3.88Å; R403-E425 PolarHBondContact NH1-OE1 3.2Å; R403-E425 PolarHBondContact O-N 3.31Å; T405-E425 HydrophobicContact CG2-CB 4.25Å; T405-E425 HydrophobicContact CG2-CG 3.87Å
426	L	94.5	Very high	90.8	Very high	66 Å²	66	54.4 Å²	54.4	35%	0.346	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	138.3	167.2	-69	178.2	0	0	0	109.7	I392 I400 Y401 L420 T464	I392-L426 HydrophobicContact CD1-CD2 4.16Å; I400-L426 HydrophobicContact CB-CD2 3.95Å; I400-L426 HydrophobicContact CD1-CD2 3.94Å; I400-L426 HydrophobicContact CG1-CD2 4.41Å; I400-L426 HydrophobicContact CG2-CD2 4.17Å; Y401-L426 WeakPolarHBondContact O-CA 3.28Å; L420-L426 HydrophobicContact CD1-CD2 3.95Å; L420-L426 HydrophobicContact CD1-CG 3.83Å; L420-L426 HydrophobicContact CD2-CD2 4.45Å; L426-T464 HydrophobicContact CB-CG2 3.93Å; L426-T464 HydrophobicContact CD1-CG2 4.37Å
427	W	95.3	Very high	90.5	Very high	70 Å²	70	55.1 Å²	55.1	27%	0.265	28%	0.284	S	S	.	.			trans	-112.2	126	-179.1	-178.4	77.2	0	0	0	112.3	Y401 R403 V410 K429 P500	Y401-W427 WeakPolarHBondContact CB-O 3.47Å; Y401-W427 HydrophobicContact CD2-CE3 4.25Å; Y401-W427 AromaticContact CG-CE3 3.97Å; Y401-W427 HydrophobicContact CG-CE3 3.97Å; Y401-W427 HydrophobicContact CG-CZ3 4.44Å; Y401-W427 PolarHBondContact O-N 3.35Å; R403-W427 HydrophobicContact CB-CB 3.93Å; R403-W427 HydrophobicContact CB-CG 4.39Å; V410-W427 HydrophobicContact CG1-CB 4.06Å; V410-W427 HydrophobicContact CG1-CD2 3.71Å; V410-W427 HydrophobicContact CG1-CE3 3.73Å; V410-W427 HydrophobicContact CG1-CG 3.87Å; V410-W427 HydrophobicContact CG1-CZ3 4.36Å; V410-W427 HydrophobicContact CG2-CD2 4.26Å; V410-W427 HydrophobicContact CG2-CG 4.15Å; W427-K429 HydrophobicContact CE3-CB 4.15Å; W427-K429 HydrophobicContact CH2-CB 4.32Å; W427-K429 HydrophobicContact CH2-CG 4.3Å; W427-K429 VanDerWaalsContact CZ3-CA 3.46Å; W427-K429 HydrophobicContact CZ3-CB 3.61Å; W427-K429 HydrophobicContact CZ3-CG 3.87Å; W427-K429 PolarHBondContact O-N 3.48Å; W427-P500 HydrophobicContact CZ3-CB 4.24Å
428	E	93.5	Very high	90.3	Very high	117 Å²	117	53.6 Å²	53.6	55%	0.547	27%	0.266	S	S	.	.			trans	-79.3	112.5	178	-63.4	-179.2	176.8	0	0	111.9	K430 P463 T464	E428-K430 PolarHBondContact O-N 2.91Å; E428-P463 WeakPolarHBondContact CA-O 3.17Å; E428-P463 HydrophobicContact CB-CB 4.09Å; E428-P463 HydrophobicContact CB-CG 4.27Å; E428-P463 HydrophobicContact CG-CB 4.39Å; E428-P463 HydrophobicContact CG-CG 4.04Å; E428-T464 HydrophobicContact CG-CG2 4.05Å
429	K	93.1	Very high	90	Very high	12 Å²	12	52.7 Å²	52.7	5%	0.052	26%	0.264	C	S	.	.			trans	-73.7	121.7	173.5	-173.7	179.6	-177.3	80.3	0	111.3	Y401 W427 L431 P463 V467 G499 P500 E502	Y401-K429 HydrophobicContact CD2-CB 3.83Å; Y401-K429 HydrophobicContact CE2-CB 3.56Å; Y401-K429 HydrophobicContact CE2-CD 3.57Å; Y401-K429 HydrophobicContact CE2-CG 4.17Å; Y401-K429 WeakPolarHBondContact OH-CD 3.38Å; W427-K429 HydrophobicContact CE3-CB 4.15Å; W427-K429 HydrophobicContact CH2-CB 4.32Å; W427-K429 HydrophobicContact CH2-CG 4.3Å; W427-K429 VanDerWaalsContact CZ3-CA 3.46Å; W427-K429 HydrophobicContact CZ3-CB 3.61Å; W427-K429 HydrophobicContact CZ3-CG 3.87Å; W427-K429 PolarHBondContact O-N 3.48Å; K429-L431 HydrophobicContact CD-CD2 4.46Å; K429-L431 HydrophobicContact CD-CG 4.44Å; K429-L431 HydrophobicContact CG-CG 4.44Å; K429-P463 PolarHBondContact N-O 2.84Å; K429-V467 HydrophobicContact CD-CG2 3.99Å; K429-G499 PolarHBondContact NZ-O 2.8Å; K429-P500 PolarHBondContact NZ-O 3.27Å; K429-E502 WeakPolarHBondContact CE-O 3.5Å; K429-E502 PolarHBondContact NZ-O 2.84Å
430	K	90.5	Very high	89.5	Confident	171 Å²	171	54.6 Å²	54.6	74%	0.743	27%	0.273	S	S	*	.			trans	-88.9	114.8	175.1	-60.5	-171.7	179.8	-175	0	110.7	E428	E428-K430 PolarHBondContact O-N 2.91Å
431	L	89.5	Confident	88.4	Confident	26 Å²	26	55.5 Å²	55.5	14%	0.136	28%	0.28	C	S	.	.			trans	-110.3	153	172.4	-72.4	177.6	0	0	0	111	K429 V435 V436 L439 L461 V467 L498 Q503	K429-L431 HydrophobicContact CD-CD2 4.46Å; K429-L431 HydrophobicContact CD-CG 4.44Å; K429-L431 HydrophobicContact CG-CG 4.44Å; L431-V435 HydrophobicContact CD1-CG1 4.44Å; L431-V436 HydrophobicContact CB-CG2 3.72Å; L431-L439 HydrophobicContact CD1-CD1 3.92Å; L431-L461 HydrophobicContact CD1-CD2 4.17Å; L431-V467 HydrophobicContact CD1-CB 4.44Å; L431-V467 HydrophobicContact CD1-CG1 4Å; L431-V467 HydrophobicContact CD1-CG2 3.98Å; L431-L498 HydrophobicContact CD2-CD1 4.43Å; L431-Q503 HydrophobicContact CD2-CB 4.33Å; L431-Q503 HydrophobicContact CD2-CG 3.97Å
432	P	90.3	Very high	87	Confident	62 Å²	62	60.5 Å²	60.5	40%	0.403	31%	0.307	S	S	.	.			trans	-59.4	139.2	170.1	-21.4	33	0	0	0	111.1	E434 V435 V436	P432-E434 PolarHBondContact O-N 3.14Å; P432-E434 VanDerWaalsContact O-N 3.14Å; P432-V435 HydrophobicContact CB-CG2 4.22Å; P432-V435 HydrophobicContact CG-CG2 4.26Å; P432-V435 WeakPolarHBondContact O-CA 3.3Å; P432-V435 WeakPolarHBondContact O-CB 3.29Å; P432-V435 PolarHBondContact O-N 3.33Å; P432-V436 PolarHBondContact O-N 3.4Å; P432-V436 VanDerWaalsContact O-N 3.1Å
433	S	86.8	Confident	85.8	Confident	85 Å²	85	61.9 Å²	61.9	59%	0.594	32%	0.315	S	S	*	.	H	α-helix	trans	-55.2	-35.6	-176.5	51.7	0	0	0	0	113.8	V435 V436 Q437	S433-V435 VanDerWaalsContact C-N 3.33Å; S433-V435 PolarHBondContact O-N 2.94Å; S433-V436 PolarHBondContact O-N 2.93Å; S433-Q437 WeakPolarHBondContact O-CB 3.27Å; S433-Q437 VanDerWaalsContact O-CG 3.29Å; S433-Q437 WeakPolarHBondContact O-CG 3.32Å; S433-Q437 PolarHBondContact O-N 2.96Å
434	E	84.9	Confident	84.5	Confident	58 Å²	58	63.7 Å²	63.7	27%	0.271	33%	0.325	S	S	.	.	H	α-helix	trans	-67.5	-30.5	175.6	-61.6	-167.1	-149.2	0	0	113.7	P432 L438 R506 K521	P432-E434 PolarHBondContact O-N 3.14Å; P432-E434 VanDerWaalsContact O-N 3.14Å; E434-L438 VanDerWaalsContact O-CG 3.3Å; E434-L438 WeakPolarHBondContact O-CG 3.46Å; E434-L438 PolarHBondContact O-N 3.45Å; E434-R506 IonicContact OE1-NH1 2.61Å; E434-R506 PolarHBondContact OE1-NH1 3.43Å; E434-R506 VanDerWaalsContact OE1-NH1 3.14Å; E434-R506 IonicContact OE2-CZ 3.13Å; E434-R506 IonicContact OE2-NE 3.75Å; E434-R506 IonicContact OE2-NH1 2.63Å; E434-R506 PolarHBondContact OE2-NH1 2.7Å; E434-K521 IonicContact OE1-NZ 3.84Å; E434-K521 PolarHBondContact OE1-NZ 3.02Å; E434-K521 WeakPolarHBondContact OE2-CD 3.5Å; E434-K521 WeakPolarHBondContact OE2-CE 3.5Å; E434-K521 IonicContact OE2-NZ 3.89Å; E434-K521 PolarHBondContact OE2-NZ 3.44Å
435	V	87.6	Confident	82.9	Confident	5 Å²	5	64.5 Å²	64.5	3%	0.03	33%	0.331	C	S	.	.	H	α-helix	trans	-75	-41.9	175.8	176.4	0	0	0	0	109.5	L431 P432 S433 Q437 L438 L439 F504 L523	L431-V435 HydrophobicContact CD1-CG1 4.44Å; P432-V435 HydrophobicContact CB-CG2 4.22Å; P432-V435 HydrophobicContact CG-CG2 4.26Å; P432-V435 WeakPolarHBondContact O-CA 3.3Å; P432-V435 WeakPolarHBondContact O-CB 3.29Å; P432-V435 PolarHBondContact O-N 3.33Å; S433-V435 VanDerWaalsContact C-N 3.33Å; S433-V435 PolarHBondContact O-N 2.94Å; V435-Q437 PolarHBondContact O-N 2.88Å; V435-L438 PolarHBondContact O-N 3.33Å; V435-L439 HydrophobicContact CG1-CD1 4.08Å; V435-L439 WeakPolarHBondContact O-CG 3.49Å; V435-L439 PolarHBondContact O-N 2.92Å; V435-F504 HydrophobicContact CG1-CB 4.36Å; V435-F504 HydrophobicContact CG1-CD2 4.3Å; V435-L523 HydrophobicContact CG1-CD1 4.34Å; V435-L523 HydrophobicContact CG1-CD2 4.11Å; V435-L523 HydrophobicContact CG2-CD2 4.33Å
436	V	87.7	Confident	81.4	Confident	33 Å²	33	65.9 Å²	65.9	20%	0.2	34%	0.336	C	S	.	.	H	α-helix	trans	-57.9	-48.6	173.5	179.7	0	0	0	0	110.4	L431 P432 S433 L438 L439 E440	L431-V436 HydrophobicContact CB-CG2 3.72Å; P432-V436 PolarHBondContact O-N 3.4Å; P432-V436 VanDerWaalsContact O-N 3.1Å; S433-V436 PolarHBondContact O-N 2.93Å; V436-L438 VanDerWaalsContact C-N 3.32Å; V436-L438 PolarHBondContact O-N 3.43Å; V436-L439 PolarHBondContact O-N 3.01Å; V436-L439 VanDerWaalsContact O-N 3.14Å; V436-E440 HydrophobicContact CG1-CG 4.03Å; V436-E440 WeakPolarHBondContact O-CB 3.44Å; V436-E440 WeakPolarHBondContact O-CG 3.49Å; V436-E440 PolarHBondContact O-N 3.46Å
437	Q	84.3	Confident	79.6	Confident	124 Å²	124	66.1 Å²	66.1	58%	0.579	35%	0.347	S	S	*	.	H	α-helix	trans	-56.6	-41.5	175.9	-75.9	170.7	-1.2	0	0	113.1	S433 V435 S441	S433-Q437 WeakPolarHBondContact O-CB 3.27Å; S433-Q437 VanDerWaalsContact O-CG 3.29Å; S433-Q437 WeakPolarHBondContact O-CG 3.32Å; S433-Q437 PolarHBondContact O-N 2.96Å; V435-Q437 PolarHBondContact O-N 2.88Å; Q437-S441 WeakPolarHBondContact O-CB 3.49Å; Q437-S441 PolarHBondContact O-N 3.04Å; Q437-S441 PolarHBondContact O-OG 3.45Å
438	L	84.2	Confident	77.7	Confident	38 Å²	38	65.3 Å²	65.3	20%	0.199	35%	0.349	C	S	.	.	H	α-helix	trans	-68.7	-37	178.2	-72	168.7	0	0	0	112.3	E434 V435 V436 S441 R506 K521 L523	E434-L438 VanDerWaalsContact O-CG 3.3Å; E434-L438 WeakPolarHBondContact O-CG 3.46Å; E434-L438 PolarHBondContact O-N 3.45Å; V435-L438 PolarHBondContact O-N 3.33Å; V436-L438 VanDerWaalsContact C-N 3.32Å; V436-L438 PolarHBondContact O-N 3.43Å; L438-S441 PolarHBondContact O-OG 3.16Å; L438-R506 HydrophobicContact CD1-CG 4.08Å; L438-K521 HydrophobicContact CD1-CB 4.31Å; L438-K521 HydrophobicContact CD2-CB 4.4Å; L438-L523 HydrophobicContact CB-CD1 3.94Å; L438-L523 HydrophobicContact CB-CD2 4.27Å; L438-L523 HydrophobicContact CB-CG 3.84Å; L438-L523 HydrophobicContact CD1-CD2 3.72Å; L438-L523 HydrophobicContact CD1-CG 3.95Å
439	L	85.4	Confident	76	Confident	23 Å²	23	66 Å²	66	12%	0.12	35%	0.346	C	S	.	.	H	α-helix	trans	-67.4	-50.4	174.4	-66.8	167	0	0	0	111.6	L431 V435 V436 S441 N442 L461 V467 F469 F504 L523	L431-L439 HydrophobicContact CD1-CD1 3.92Å; V435-L439 HydrophobicContact CG1-CD1 4.08Å; V435-L439 WeakPolarHBondContact O-CG 3.49Å; V435-L439 PolarHBondContact O-N 2.92Å; V436-L439 PolarHBondContact O-N 3.01Å; V436-L439 VanDerWaalsContact O-N 3.14Å; L439-S441 VanDerWaalsContact C-N 3.32Å; L439-S441 PolarHBondContact O-N 3.35Å; L439-N442 PolarHBondContact O-N 3.11Å; L439-L461 HydrophobicContact CD1-CD2 4.02Å; L439-V467 HydrophobicContact CD1-CG1 3.52Å; L439-V467 HydrophobicContact CD2-CG1 4.47Å; L439-F469 HydrophobicContact CD2-CB 4.14Å; L439-F469 HydrophobicContact CD2-CD2 3.76Å; L439-F469 HydrophobicContact CD2-CG 4.34Å; L439-F504 HydrophobicContact CD1-CD2 4.48Å; L439-F504 HydrophobicContact CD1-CE2 4.48Å; L439-F504 HydrophobicContact CD2-CD2 4.17Å; L439-F504 HydrophobicContact CD2-CE2 3.87Å; L439-L523 HydrophobicContact CD2-CD1 3.64Å; L439-L523 HydrophobicContact CG-CD1 3.82Å
440	E	82.4	Confident	74	Confident	51 Å²	51	68.7 Å²	68.7	24%	0.238	38%	0.377	C	S	.	.	H	α-helix	trans	-66.6	-30.1	-178.5	-76.6	-174.5	156.5	0	0	113.3	V436 N442 V458 R460 L461	V436-E440 HydrophobicContact CG1-CG 4.03Å; V436-E440 WeakPolarHBondContact O-CB 3.44Å; V436-E440 WeakPolarHBondContact O-CG 3.49Å; V436-E440 PolarHBondContact O-N 3.46Å; E440-N442 PolarHBondContact O-N 2.96Å; E440-V458 HydrophobicContact CB-CG1 3.9Å; E440-V458 HydrophobicContact CG-CG1 4.17Å; E440-R460 WeakPolarHBondContact OE1-CA 3.34Å; E440-L461 HydrophobicContact CG-CB 4.21Å; E440-L461 PolarHBondContact OE1-N 2.85Å
441	S	69.3	Low	72.2	Confident	31 Å²	31	63.9 Å²	63.9	22%	0.217	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-20.7	-179	67.5	0	0	0	0	114.2	Q437 L438 L439 I443	Q437-S441 WeakPolarHBondContact O-CB 3.49Å; Q437-S441 PolarHBondContact O-N 3.04Å; Q437-S441 PolarHBondContact O-OG 3.45Å; L438-S441 PolarHBondContact O-OG 3.16Å; L439-S441 VanDerWaalsContact C-N 3.32Å; L439-S441 PolarHBondContact O-N 3.35Å; S441-I443 PolarHBondContact O-N 3.44Å; S441-I443 WeakPolarHBondContact OG-CD1 3.49Å; S441-I443 WeakPolarHBondContact OG-CG1 3.34Å
442	N	61.4	Low	70.3	Confident	140 Å²	140	74 Å²	74	75%	0.749	40%	0.398	S	S	*	.			trans	47.7	24.7	179.5	-135.2	-0.9	0	0	0	115.1	L439 E440 D444	L439-N442 PolarHBondContact O-N 3.11Å; E440-N442 PolarHBondContact O-N 2.96Å; N442-D444 PolarHBondContact O-N 3.04Å
443	I	62	Low	68.3	Low	80 Å²	80	75.2 Å²	75.2	41%	0.41	41%	0.408	S	S	.	.			trans	-62	124.1	-178.4	-69.9	172.1	0	0	0	109.1	S441 P445 D448	S441-I443 PolarHBondContact O-N 3.44Å; S441-I443 WeakPolarHBondContact OG-CD1 3.49Å; S441-I443 WeakPolarHBondContact OG-CG1 3.34Å; I443-P445 WeakPolarHBondContact O-CD 3.29Å; I443-D448 HydrophobicContact CB-CB 4.45Å; I443-D448 HydrophobicContact CG2-CB 3.57Å
444	D	64.2	Low	66.5	Low	65 Å²	65	76.6 Å²	76.6	35%	0.348	41%	0.408	S	S	.	.			trans	-69	116.9	171	176.6	5.9	0	0	0	109.3	N442 F446 A447 D448	N442-D444 PolarHBondContact O-N 3.04Å; D444-F446 PolarHBondContact O-N 2.94Å; D444-F446 PolarHBondContact OD1-N 3.48Å; D444-A447 HydrophobicContact CB-CB 4.03Å; D444-A447 PolarHBondContact O-N 3.41Å; D444-A447 VanDerWaalsContact OD2-CB 3.27Å; D444-A447 WeakPolarHBondContact OD2-CB 3.08Å; D444-A447 PolarHBondContact OD2-N 2.96Å; D444-D448 PolarHBondContact N-OD2 3.26Å; D444-D448 WeakPolarHBondContact O-CB 3.35Å; D444-D448 PolarHBondContact O-N 2.95Å
445	P	61.1	Low	64.7	Low	26 Å²	26	81.2 Å²	81.2	17%	0.169	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.1	-179.6	-24.5	38.7	0	0	0	114.2	I443 R449 P472 C524 L526	I443-P445 WeakPolarHBondContact O-CD 3.29Å; P445-R449 VanDerWaalsContact O-CG 3.23Å; P445-R449 WeakPolarHBondContact O-CG 3.33Å; P445-R449 PolarHBondContact O-NE 2.88Å; P445-P472 HydrophobicContact CG-CG 3.91Å; P445-C524 WeakPolarHBondContact CG-SG 3.45Å; P445-L526 HydrophobicContact CB-CD1 3.96Å; P445-L526 HydrophobicContact CB-CD2 4.14Å; P445-L526 HydrophobicContact CB-CG 4.46Å; P445-L526 VanDerWaalsContact O-CD1 3.28Å; P445-L526 WeakPolarHBondContact O-CD1 3.42Å
446	F	62	Low	62.9	Low	100 Å²	100	88.7 Å²	88.7	44%	0.439	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-59.5	171	-71.9	-80.8	0	0	0	112.5	D444 P472 H473 L526	D444-F446 PolarHBondContact O-N 2.94Å; D444-F446 PolarHBondContact OD1-N 3.48Å; F446-P472 HydrophobicContact CD2-CB 4.18Å; F446-P472 HydrophobicContact CE2-CB 3.74Å; F446-H473 WeakPolarHBondContact CE2-O 3.28Å; F446-H473 WeakPolarHBondContact CZ-O 3.46Å; F446-L526 HydrophobicContact CD2-CD2 4.43Å; F446-L526 HydrophobicContact CE1-CD2 4.4Å; F446-L526 HydrophobicContact CE2-CD2 3.83Å; F446-L526 HydrophobicContact CZ-CD2 3.81Å
447	A	55.8	Low	61.1	Low	71 Å²	71	91.9 Å²	91.9	59%	0.587	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-41.7	-173.4	0	0	0	0	0	114	D444 R449	D444-A447 HydrophobicContact CB-CB 4.03Å; D444-A447 PolarHBondContact O-N 3.41Å; D444-A447 VanDerWaalsContact OD2-CB 3.27Å; D444-A447 WeakPolarHBondContact OD2-CB 3.08Å; D444-A447 PolarHBondContact OD2-N 2.96Å; A447-R449 PolarHBondContact O-N 2.84Å
448	D	56.7	Low	59.6	Low	54 Å²	54	88.5 Å²	88.5	29%	0.289	48%	0.48	S	S	.	.			trans	-95.3	14.9	-163.2	-68.6	-42.5	0	0	0	114.5	I443 D444 G450 V451	I443-D448 HydrophobicContact CB-CB 4.45Å; I443-D448 HydrophobicContact CG2-CB 3.57Å; D444-D448 PolarHBondContact N-OD2 3.26Å; D444-D448 WeakPolarHBondContact O-CB 3.35Å; D444-D448 PolarHBondContact O-N 2.95Å; D448-G450 PolarHBondContact O-N 3.48Å; D448-V451 HydrophobicContact CB-CB 4.11Å; D448-V451 HydrophobicContact CB-CG2 4.29Å; D448-V451 PolarHBondContact O-N 3.23Å; D448-V451 WeakPolarHBondContact OD1-CG2 3.43Å
449	R	57.4	Low	58.5	Low	132 Å²	132	93.3 Å²	93.3	50%	0.498	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-17.7	180	-68.1	175.5	164.7	-153.9	-2.4	115.2	P445 A447 D530	P445-R449 VanDerWaalsContact O-CG 3.23Å; P445-R449 WeakPolarHBondContact O-CG 3.33Å; P445-R449 PolarHBondContact O-NE 2.88Å; A447-R449 PolarHBondContact O-N 2.84Å; R449-D530 IonicContact CZ-OD1 3.4Å; R449-D530 IonicContact CZ-OD2 2.79Å; R449-D530 VanDerWaalsContact NH1-CG 3.25Å; R449-D530 IonicContact NH1-OD1 3.84Å; R449-D530 PolarHBondContact NH1-OD1 3.25Å; R449-D530 IonicContact NH1-OD2 2.79Å; R449-D530 PolarHBondContact NH1-OD2 2.85Å; R449-D530 IonicContact NH2-OD1 3.92Å; R449-D530 IonicContact NH2-OD2 3.28Å; R449-D530 PolarHBondContact NH2-OD2 2.86Å
450	G	51.5	Low	57.9	Low	67 Å²	67	102.6 Å²	102.6	69%	0.691	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-11.8	173.3	0	0	0	0	0	115.4	D448 R452	D448-G450 PolarHBondContact O-N 3.48Å; G450-R452 PolarHBondContact O-N 2.85Å
451	V	51.1	Low	57.9	Low	70 Å²	70	102.8 Å²	102.8	42%	0.424	54%	0.542	S	S	.	.			trans	-83.3	110.8	-173.2	-177.4	0	0	0	0	109.4	D448	D448-V451 HydrophobicContact CB-CB 4.11Å; D448-V451 HydrophobicContact CB-CG2 4.29Å; D448-V451 PolarHBondContact O-N 3.23Å; D448-V451 WeakPolarHBondContact OD1-CG2 3.43Å
452	R	50.4	Low	58.8	Low	238 Å²	238	104.3 Å²	104.3	90%	0.898	55%	0.548	S	S	*	.			trans	-96.7	-1.7	175.3	-63.9	-176.3	-179.8	178.6	0.3	113.5	G450 I454	G450-R452 PolarHBondContact O-N 2.85Å; R452-I454 PolarHBondContact O-N 2.85Å
453	S	47.4	Very low	60.1	Low	89 Å²	89	100.1 Å²	100.1	62%	0.622	53%	0.528	S	S	*	.			trans	-90.4	104.3	179.6	-162.4	0	0	0	0	108.6	Q455	S453-Q455 PolarHBondContact O-N 2.84Å
454	I	50.8	Low	61.5	Low	113 Å²	113	97.3 Å²	97.3	58%	0.579	52%	0.515	S	S	*	.			trans	-60.5	119.1	163.9	-56.4	166.5	0	0	0	105.7	R452 V458	R452-I454 PolarHBondContact O-N 2.85Å; I454-V458 HydrophobicContact CG2-CG2 4.22Å
455	Q	46.8	Very low	62.8	Low	155 Å²	155	98.3 Å²	98.3	72%	0.724	51%	0.514	S	S	*	.			trans	-80.7	139.9	170.6	-70.5	-173	-7.7	0	0	108.5	S453 S457	S453-Q455 PolarHBondContact O-N 2.84Å; Q455-S457 PolarHBondContact O-N 2.99Å
456	D	49.3	Very low	64.4	Low	163 Å²	163	97.5 Å²	97.5	87%	0.872	51%	0.509	S	S	*	.	S	Bend	trans	-68.6	3.5	-166.3	-71.6	-52.8	0	0	0	115.7	V458	D456-V458 PolarHBondContact O-N 3.03Å
457	S	49.3	Very low	65.8	Low	100 Å²	100	92.9 Å²	92.9	70%	0.699	49%	0.488	S	S	*	.			trans	-79.1	58.8	171.9	61.9	0	0	0	0	111.5	Q455 D459	Q455-S457 PolarHBondContact O-N 2.99Å; S457-D459 PolarHBondContact O-N 2.69Å
458	V	54.4	Low	67.4	Low	52 Å²	52	92.1 Å²	92.1	32%	0.315	48%	0.477	S	S	.	.			trans	-81	96.7	174	180	0	0	0	0	109	E440 I454 D456 R460	E440-V458 HydrophobicContact CB-CG1 3.9Å; E440-V458 HydrophobicContact CG-CG1 4.17Å; I454-V458 HydrophobicContact CG2-CG2 4.22Å; D456-V458 PolarHBondContact O-N 3.03Å; V458-R460 VanDerWaalsContact C-N 3.27Å; V458-R460 HydrophobicContact CG1-CG 4.2Å; V458-R460 PolarHBondContact O-N 3.18Å
459	D	60.4	Low	69	Low	139 Å²	139	91.2 Å²	91.2	74%	0.743	47%	0.47	S	S	*	.			trans	-62.4	94	159.9	-75.8	-34	0	0	0	107.8	S457 L461	S457-D459 PolarHBondContact O-N 2.69Å; D459-L461 PolarHBondContact O-N 2.7Å
460	R	73.2	Confident	70.5	Confident	218 Å²	218	94.1 Å²	94.1	82%	0.823	48%	0.481	S	S	*	.			trans	-60.1	129.6	-178.1	-70.5	-175.9	-178.7	172.6	1.8	109.7	E440 V458 D462	E440-R460 WeakPolarHBondContact OE1-CA 3.34Å; V458-R460 VanDerWaalsContact C-N 3.27Å; V458-R460 HydrophobicContact CG1-CG 4.2Å; V458-R460 PolarHBondContact O-N 3.18Å; R460-D462 PolarHBondContact O-N 2.77Å; R460-D462 VanDerWaalsContact O-N 3.11Å
461	L	81.1	Confident	72.3	Confident	56 Å²	56	91 Å²	91	29%	0.293	45%	0.448	S	S	.	.			trans	-66.9	113	-176.6	-175.4	68.3	0	0	0	110.1	L431 L439 E440 D459 P463 V467	L431-L461 HydrophobicContact CD1-CD2 4.17Å; L439-L461 HydrophobicContact CD1-CD2 4.02Å; E440-L461 HydrophobicContact CG-CB 4.21Å; E440-L461 PolarHBondContact OE1-N 2.85Å; D459-L461 PolarHBondContact O-N 2.7Å; L461-P463 VanDerWaalsContact O-CD 3.28Å; L461-P463 WeakPolarHBondContact O-CD 3.41Å; L461-V467 HydrophobicContact CD1-CG1 4.48Å; L461-V467 HydrophobicContact CD1-CG2 4.37Å; L461-V467 HydrophobicContact CD2-CG1 4.31Å; L461-V467 HydrophobicContact CD2-CG2 4.07Å
462	D	87.7	Confident	74	Confident	63 Å²	63	88.6 Å²	88.6	34%	0.337	44%	0.435	S	S	.	.			trans	-65.9	112.9	169.7	178.2	-9.3	0	0	0	109	R460 T464 R465	R460-D462 PolarHBondContact O-N 2.77Å; R460-D462 VanDerWaalsContact O-N 3.11Å; D462-T464 VanDerWaalsContact CG-OG1 3.29Å; D462-T464 PolarHBondContact O-N 3.01Å; D462-T464 WeakPolarHBondContact OD1-CB 3.34Å; D462-T464 PolarHBondContact OD1-N 2.82Å; D462-T464 PolarHBondContact OD1-OG1 3.45Å; D462-T464 PolarHBondContact OD2-OG1 3.01Å; D462-R465 HydrophobicContact CB-CB 4.26Å; D462-R465 HydrophobicContact CB-CG 4.25Å; D462-R465 PolarHBondContact O-N 3.25Å; D462-R465 WeakPolarHBondContact OD2-CD 3.11Å; D462-R465 WeakPolarHBondContact OD2-CG 3.3Å; D462-R465 IonicContact OD2-NE 3.15Å
463	P	89.6	Confident	75.8	Confident	51 Å²	51	83.1 Å²	83.1	33%	0.331	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-14.7	-175.9	30.7	-36.5	0	0	0	112.9	E428 K429 L461	E428-P463 WeakPolarHBondContact CA-O 3.17Å; E428-P463 HydrophobicContact CB-CB 4.09Å; E428-P463 HydrophobicContact CB-CG 4.27Å; E428-P463 HydrophobicContact CG-CB 4.39Å; E428-P463 HydrophobicContact CG-CG 4.04Å; K429-P463 PolarHBondContact N-O 2.84Å; L461-P463 VanDerWaalsContact O-CD 3.28Å; L461-P463 WeakPolarHBondContact O-CD 3.41Å
464	T	91.5	Very high	77.8	Confident	22 Å²	22	82.8 Å²	82.8	14%	0.135	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-20.4	177.2	70.8	0	0	0	0	113.2	I400 Y401 L426 E428 D462	I400-T464 WeakPolarHBondContact CA-O 3.29Å; Y401-T464 PolarHBondContact N-O 3.05Å; L426-T464 HydrophobicContact CB-CG2 3.93Å; L426-T464 HydrophobicContact CD1-CG2 4.37Å; E428-T464 HydrophobicContact CG-CG2 4.05Å; D462-T464 VanDerWaalsContact CG-OG1 3.29Å; D462-T464 PolarHBondContact O-N 3.01Å; D462-T464 WeakPolarHBondContact OD1-CB 3.34Å; D462-T464 PolarHBondContact OD1-N 2.82Å; D462-T464 PolarHBondContact OD1-OG1 3.45Å; D462-T464 PolarHBondContact OD2-OG1 3.01Å
465	R	92.5	Very high	79.7	Confident	86 Å²	86	77.4 Å²	77.4	33%	0.325	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-85.9	149.7	178.3	-75.4	176.7	168.5	-95.1	1.5	111.5	E398 G399 I400 Y401 D462 V467	E398-R465 IonicContact OE2-CZ 2.77Å; E398-R465 IonicContact OE2-NH1 2.78Å; E398-R465 PolarHBondContact OE2-NH1 3.44Å; E398-R465 IonicContact OE2-NH2 3.01Å; G399-R465 CarbonylContact O-C 3.47Å; G399-R465 WeakPolarHBondContact O-CA 3.41Å; I400-R465 HydrophobicContact CG2-CG 4.34Å; Y401-R465 WeakPolarHBondContact CE2-O 3.23Å; D462-R465 HydrophobicContact CB-CB 4.26Å; D462-R465 HydrophobicContact CB-CG 4.25Å; D462-R465 PolarHBondContact O-N 3.25Å; D462-R465 WeakPolarHBondContact OD2-CD 3.11Å; D462-R465 WeakPolarHBondContact OD2-CG 3.3Å; D462-R465 IonicContact OD2-NE 3.15Å; R465-V467 PolarHBondContact O-N 3.39Å
466	V	93.6	Very high	81.8	Confident	9 Å²	9	70 Å²	70	6%	0.055	35%	0.348	C	S	.	.			trans	-61.1	124.3	175.9	167.9	0	0	0	0	108.9	G399 Y401 A412 I414 T468 M497	G399-V466 VanDerWaalsContact C-CG2 3.49Å; G399-V466 PolarHBondContact O-N 2.89Å; Y401-V466 HydrophobicContact CD1-CG2 4.19Å; Y401-V466 HydrophobicContact CE1-CG2 3.88Å; A412-V466 HydrophobicContact CB-CG2 3.76Å; I414-V466 HydrophobicContact CD1-CG1 4.31Å; I414-V466 HydrophobicContact CG1-CG2 4.2Å; V466-T468 HydrophobicContact CG1-CG2 4.4Å; V466-T468 WeakPolarHBondContact O-CG2 3.18Å; V466-T468 PolarHBondContact O-N 2.88Å; V466-M497 HydrophobicContact CG1-CB 3.94Å
467	V	91.6	Very high	83.9	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.012	31%	0.307	C	S	.	.			trans	-77.1	115.9	-176.8	-179.9	0	0	0	0	108.9	Y401 K429 L431 L439 L461 R465 L498 F504	Y401-V467 HydrophobicContact CE2-CG2 4.44Å; Y401-V467 PolarHBondContact OH-N 2.96Å; Y401-V467 VanDerWaalsContact OH-N 3.15Å; K429-V467 HydrophobicContact CD-CG2 3.99Å; L431-V467 HydrophobicContact CD1-CB 4.44Å; L431-V467 HydrophobicContact CD1-CG1 4Å; L431-V467 HydrophobicContact CD1-CG2 3.98Å; L439-V467 HydrophobicContact CD1-CG1 3.52Å; L439-V467 HydrophobicContact CD2-CG1 4.47Å; L461-V467 HydrophobicContact CD1-CG1 4.48Å; L461-V467 HydrophobicContact CD1-CG2 4.37Å; L461-V467 HydrophobicContact CD2-CG1 4.31Å; L461-V467 HydrophobicContact CD2-CG2 4.07Å; R465-V467 PolarHBondContact O-N 3.39Å; V467-L498 HydrophobicContact CB-CB 4.43Å; V467-L498 HydrophobicContact CB-CD1 4.11Å; V467-L498 HydrophobicContact CB-CG 4.43Å; V467-L498 HydrophobicContact CG1-CD1 4.14Å; V467-L498 PolarHBondContact O-N 2.85Å; V467-F504 HydrophobicContact CG1-CE2 4.13Å
468	T	89.8	Confident	86	Confident	56 Å²	56	58.8 Å²	58.8	34%	0.344	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	144.7	-178.7	66.5	0	0	0	0	111	V466 L495 A496 M497	V466-T468 HydrophobicContact CG1-CG2 4.4Å; V466-T468 WeakPolarHBondContact O-CG2 3.18Å; V466-T468 PolarHBondContact O-N 2.88Å; T468-L495 HydrophobicContact CG2-CD2 4.42Å; T468-A496 CarbonylContact C-O 3.58Å; T468-A496 WeakPolarHBondContact CA-O 3.34Å; T468-M497 HydrophobicContact CG2-CG 3.86Å; T468-M497 HydrophobicContact CG2-SD 4.26Å
469	F	88.9	Confident	87.9	Confident	34 Å²	34	56.3 Å²	56.3	15%	0.149	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	122.4	172.4	-178.6	-99.2	0	0	0	109.8	L439 V471 V477 A496 F504 L523 C524	L439-F469 HydrophobicContact CD2-CB 4.14Å; L439-F469 HydrophobicContact CD2-CD2 3.76Å; L439-F469 HydrophobicContact CD2-CG 4.34Å; F469-V471 HydrophobicContact CD1-CG2 4.26Å; F469-V471 PolarHBondContact O-N 2.9Å; F469-V477 HydrophobicContact CD1-CG2 3.84Å; F469-V477 HydrophobicContact CE1-CG2 3.61Å; F469-A496 PolarHBondContact N-O 2.99Å; F469-A496 WeakPolarHBondContact O-CB 3.42Å; F469-A496 PolarHBondContact O-N 2.83Å; F469-F504 HydrophobicContact CB-CE1 4.02Å; F469-F504 HydrophobicContact CB-CE2 3.8Å; F469-F504 HydrophobicContact CB-CZ 3.36Å; F469-F504 HydrophobicContact CG-CZ 4.33Å; F469-L523 HydrophobicContact CD2-CD1 4.38Å; F469-L523 HydrophobicContact CE2-CD1 4.42Å; F469-L523 HydrophobicContact CZ-CB 4.4Å; F469-C524 HydrophobicContact CE1-CB 4.16Å; F469-C524 HydrophobicContact CZ-CB 4.39Å
470	R	88.9	Confident	89.4	Confident	193 Å²	193	53.3 Å²	53.3	73%	0.728	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	103.9	177.9	-173.4	178	-175.6	172.6	2.4	109.2	P472 L495	R470-P472 VanDerWaalsContact O-CD 3.32Å; R470-P472 WeakPolarHBondContact O-CD 3.34Å; R470-L495 HydrophobicContact CB-CD1 4.22Å
471	V	89.7	Confident	90.3	Very high	1 Å²	1	44 Å²	44	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	121.4	177.7	-171.2	0	0	0	0	108.8	F469 A475 V477 E490 P493 N494 A496	F469-V471 HydrophobicContact CD1-CG2 4.26Å; F469-V471 PolarHBondContact O-N 2.9Å; V471-A475 HydrophobicContact CG1-CB 4.13Å; V471-V477 HydrophobicContact CB-CG2 4.44Å; V471-V477 HydrophobicContact CG1-CG2 4Å; V471-V477 HydrophobicContact CG2-CB 4.1Å; V471-V477 HydrophobicContact CG2-CG2 3.83Å; V471-E490 HydrophobicContact CG2-CB 4.33Å; V471-P493 WeakPolarHBondContact O-CA 3.35Å; V471-N494 PolarHBondContact N-O 2.87Å; V471-A496 HydrophobicContact CG2-CB 4.02Å
472	P	88.3	Confident	90.6	Very high	21 Å²	21	47.9 Å²	47.9	14%	0.136	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-62	158.7	179.2	-23.7	33.8	0	0	0	113	P445 F446 R470 N474 A475 G492	P445-P472 HydrophobicContact CG-CG 3.91Å; F446-P472 HydrophobicContact CD2-CB 4.18Å; F446-P472 HydrophobicContact CE2-CB 3.74Å; R470-P472 VanDerWaalsContact O-CD 3.32Å; R470-P472 WeakPolarHBondContact O-CD 3.34Å; P472-N474 PolarHBondContact O-N 3.23Å; P472-A475 HydrophobicContact CB-CB 4.06Å; P472-A475 HydrophobicContact CG-CB 4.37Å; P472-A475 VanDerWaalsContact O-CB 3.27Å; P472-A475 WeakPolarHBondContact O-CB 3.49Å; P472-A475 PolarHBondContact O-N 2.93Å; P472-G492 VanDerWaalsContact O-CA 3.29Å; P472-G492 WeakPolarHBondContact O-CA 3.33Å
473	H	87.2	Confident	90.7	Very high	122 Å²	122	51.3 Å²	51.3	57%	0.565	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	138.7	171.1	-67.7	91	0	0	0	110.7	F446 A475 P493	F446-H473 WeakPolarHBondContact CE2-O 3.28Å; F446-H473 WeakPolarHBondContact CZ-O 3.46Å; H473-A475 PolarHBondContact O-N 3.45Å; H473-P493 WeakPolarHBondContact NE2-CG 3.14Å
474	N	89	Confident	90.7	Very high	83 Å²	83	53.7 Å²	53.7	44%	0.444	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	35	176.4	-160.5	24.1	0	0	0	113.1	P472 L527 G528	P472-N474 PolarHBondContact O-N 3.23Å; N474-L527 WeakPolarHBondContact O-CB 3.34Å; N474-L527 WeakPolarHBondContact O-CG 2.94Å; N474-L527 PolarHBondContact O-N 2.96Å; N474-G528 PolarHBondContact ND2-O 2.92Å
475	A	91.1	Very high	90.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	160.1	174.5	0	0	0	0	0	110.2	V471 P472 H473 G492 C524 L525 L526	V471-A475 HydrophobicContact CG1-CB 4.13Å; P472-A475 HydrophobicContact CB-CB 4.06Å; P472-A475 HydrophobicContact CG-CB 4.37Å; P472-A475 VanDerWaalsContact O-CB 3.27Å; P472-A475 WeakPolarHBondContact O-CB 3.49Å; P472-A475 PolarHBondContact O-N 2.93Å; H473-A475 PolarHBondContact O-N 3.45Å; A475-G492 PolarHBondContact O-N 2.93Å; A475-C524 HydrophobicContact CB-CB 4.41Å; A475-L525 CarbonylContact C-O 3.56Å; A475-L525 WeakPolarHBondContact CA-O 3.19Å; A475-L525 WeakPolarHBondContact CB-O 3.43Å; A475-L526 HydrophobicContact CB-CD2 3.72Å
476	A	91.8	Very high	90.4	Very high	0 Å²	0	65 Å²	65	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	149.6	172.9	0	0	0	0	0	110.4	V489 E490 F491 C524 L525 L527 L570 F571	A476-V489 HydrophobicContact CB-CG1 3.94Å; A476-E490 CarbonylContact C-O 3.57Å; A476-E490 WeakPolarHBondContact CA-O 3.41Å; A476-F491 HydrophobicContact CB-CD1 3.87Å; A476-F491 HydrophobicContact CB-CE1 3.89Å; A476-C524 CarbonylContact O-C 3.51Å; A476-C524 WeakPolarHBondContact O-CA 3.44Å; A476-L525 PolarHBondContact N-O 2.82Å; A476-L525 PolarHBondContact O-N 3.13Å; A476-L527 HydrophobicContact CB-CD2 4.28Å; A476-L570 HydrophobicContact CB-CD1 4.17Å; A476-F571 HydrophobicContact CB-CE2 3.96Å; A476-F571 HydrophobicContact CB-CZ 4.07Å
477	V	92.7	Very high	90.2	Very high	0 Å²	0	67 Å²	67	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.8	173	171.7	0	0	0	0	109	F469 V471 I479 V489 E490 F504 C524	F469-V477 HydrophobicContact CD1-CG2 3.84Å; F469-V477 HydrophobicContact CE1-CG2 3.61Å; V471-V477 HydrophobicContact CB-CG2 4.44Å; V471-V477 HydrophobicContact CG1-CG2 4Å; V471-V477 HydrophobicContact CG2-CB 4.1Å; V471-V477 HydrophobicContact CG2-CG2 3.83Å; V477-I479 HydrophobicContact CG1-CG1 4.38Å; V477-V489 CarbonylContact O-C 3.3Å; V477-V489 WeakPolarHBondContact O-CA 3.15Å; V477-E490 PolarHBondContact N-O 2.82Å; V477-E490 PolarHBondContact O-N 3.15Å; V477-F504 HydrophobicContact CG1-CD1 3.43Å; V477-F504 VanDerWaalsContact CG1-CD1 3.43Å; V477-F504 HydrophobicContact CG1-CE1 3.76Å; V477-C524 HydrophobicContact CG2-CB 3.61Å
478	Q	93.5	Very high	90.2	Very high	27 Å²	27	71.3 Å²	71.3	13%	0.126	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	123.3	174.7	-176	176.9	55.8	0	0	110.9	A487 R488 V489 T505 F571	Q478-A487 HydrophobicContact CG-CB 4.05Å; Q478-R488 WeakPolarHBondContact CA-O 3.34Å; Q478-V489 HydrophobicContact CB-CG2 4.28Å; Q478-V489 HydrophobicContact CG-CG2 4.25Å; Q478-T505 WeakPolarHBondContact O-CB 3.3Å; Q478-T505 PolarHBondContact O-N 2.69Å; Q478-T505 PolarHBondContact O-OG1 2.7Å; Q478-F571 HydrophobicContact CB-CB 4.44Å; Q478-F571 HydrophobicContact CB-CD1 3.53Å; Q478-F571 HydrophobicContact CB-CD2 3.85Å; Q478-F571 HydrophobicContact CB-CE1 3.64Å; Q478-F571 HydrophobicContact CB-CE2 3.96Å; Q478-F571 HydrophobicContact CB-CG 3.67Å; Q478-F571 HydrophobicContact CB-CZ 3.86Å; Q478-F571 HydrophobicContact CG-CD1 4.49Å; Q478-F571 HydrophobicContact CG-CG 4.3Å; Q478-F571 VanDerWaalsContact OE1-CB 3.28Å
479	I	94.2	Very high	90.3	Very high	0 Å²	0	70 Å²	70	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129	176.4	-57.1	168.4	0	0	0	107.8	V477 A487 R488 E490 A496 L498 E502 Q503 F504	V477-I479 HydrophobicContact CG1-CG1 4.38Å; I479-A487 CarbonylContact O-C 3.59Å; I479-A487 VanDerWaalsContact O-CA 3.29Å; I479-A487 WeakPolarHBondContact O-CA 3.45Å; I479-R488 HydrophobicContact CB-CG 3.92Å; I479-R488 HydrophobicContact CD1-CG 4.46Å; I479-R488 HydrophobicContact CG2-CG 4.48Å; I479-R488 PolarHBondContact N-O 3.5Å; I479-R488 PolarHBondContact O-N 3.01Å; I479-E490 HydrophobicContact CD1-CG 3.79Å; I479-A496 HydrophobicContact CD1-CB 3.98Å; I479-L498 HydrophobicContact CB-CD2 4.41Å; I479-L498 HydrophobicContact CD1-CD2 4.2Å; I479-L498 HydrophobicContact CG1-CD2 4.08Å; I479-L498 HydrophobicContact CG2-CD2 3.51Å; I479-E502 HydrophobicContact CG2-CB 3.69Å; I479-E502 HydrophobicContact CG2-CG 4.01Å; I479-Q503 CarbonylContact C-O 3.51Å; I479-Q503 WeakPolarHBondContact CA-O 3.31Å; I479-F504 HydrophobicContact CD1-CE1 4.24Å; I479-F504 HydrophobicContact CG1-CD1 3.95Å; I479-F504 HydrophobicContact CG1-CE1 3.9Å
480	Y	92.2	Very high	90.4	Very high	75 Å²	75	70.1 Å²	70.1	29%	0.294	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.4	178.6	-168.2	-90.7	0	0	0	111.1	Y482 A487 E502 Q503	Y480-Y482 AromaticContact CD1-CD1 3.93Å; Y480-Y482 HydrophobicContact CD1-CD1 3.93Å; Y480-Y482 AromaticContact CD1-CD2 3.93Å; Y480-Y482 HydrophobicContact CD1-CD2 3.93Å; Y480-Y482 AromaticContact CD1-CE1 3.91Å; Y480-Y482 HydrophobicContact CD1-CE1 3.91Å; Y480-Y482 AromaticContact CD1-CE2 3.9Å; Y480-Y482 HydrophobicContact CD1-CE2 3.9Å; Y480-Y482 AromaticContact CD1-CG 3.94Å; Y480-Y482 HydrophobicContact CD1-CG 3.94Å; Y480-Y482 AromaticContact CD1-CZ 3.9Å; Y480-Y482 AromaticContact CE1-CD1 3.82Å; Y480-Y482 HydrophobicContact CE1-CD1 3.82Å; Y480-Y482 HydrophobicContact CE1-CE1 4.01Å; Y480-Y482 HydrophobicContact CE1-CG 4.12Å; Y480-A487 HydrophobicContact CD2-CB 4.08Å; Y480-E502 CarbonylContact O-C 3.56Å; Y480-E502 VanDerWaalsContact O-CA 3.29Å; Y480-E502 WeakPolarHBondContact O-CA 3.08Å; Y480-Q503 PolarHBondContact N-O 3.19Å; Y480-Q503 PolarHBondContact O-N 2.97Å
481	D	92.2	Very high	90.5	Very high	24 Å²	24	62.6 Å²	62.6	13%	0.128	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	111.6	171.6	-179.5	-23.3	0	0	0	109.5	K483 N484 K485 R486 E502	D481-K483 VanDerWaalsContact C-N 3.34Å; D481-K483 WeakPolarHBondContact OD1-CA 3.17Å; D481-K483 WeakPolarHBondContact OD1-CB 3.46Å; D481-K483 PolarHBondContact OD1-N 3.42Å; D481-N484 HydrophobicContact CB-CB 4.49Å; D481-N484 PolarHBondContact OD1-N 3.05Å; D481-N484 WeakPolarHBondContact OD2-CB 3.47Å; D481-N484 PolarHBondContact OD2-ND2 2.99Å; D481-K485 WeakPolarHBondContact O-CA 3.43Å; D481-K485 PolarHBondContact O-N 3.24Å; D481-R486 PolarHBondContact N-O 2.94Å; D481-R486 PolarHBondContact O-N 3.06Å; D481-E502 HydrophobicContact CB-CG 4.01Å
482	Y	87.8	Confident	90.4	Very high	136 Å²	136	63.4 Å²	63.4	53%	0.533	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-22.8	-179	-75.8	-85.8	0	0	0	114.1	Y480 D501 Q503	Y480-Y482 AromaticContact CD1-CD1 3.93Å; Y480-Y482 HydrophobicContact CD1-CD1 3.93Å; Y480-Y482 AromaticContact CD1-CD2 3.93Å; Y480-Y482 HydrophobicContact CD1-CD2 3.93Å; Y480-Y482 AromaticContact CD1-CE1 3.91Å; Y480-Y482 HydrophobicContact CD1-CE1 3.91Å; Y480-Y482 AromaticContact CD1-CE2 3.9Å; Y480-Y482 HydrophobicContact CD1-CE2 3.9Å; Y480-Y482 AromaticContact CD1-CG 3.94Å; Y480-Y482 HydrophobicContact CD1-CG 3.94Å; Y480-Y482 AromaticContact CD1-CZ 3.9Å; Y480-Y482 AromaticContact CE1-CD1 3.82Å; Y480-Y482 HydrophobicContact CE1-CD1 3.82Å; Y480-Y482 HydrophobicContact CE1-CE1 4.01Å; Y480-Y482 HydrophobicContact CE1-CG 4.12Å; Y482-D501 PolarHBondContact N-O 3.24Å; Y482-Q503 HydrophobicContact CD2-CG 4.19Å; Y482-Q503 HydrophobicContact CE2-CB 3.97Å; Y482-Q503 HydrophobicContact CE2-CG 3.75Å
483	K	88.4	Confident	90.4	Very high	135 Å²	135	66.4 Å²	66.4	59%	0.587	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-47.2	-179.5	175	174.7	177.3	179.4	0	111.1	D481 D501	D481-K483 VanDerWaalsContact C-N 3.34Å; D481-K483 WeakPolarHBondContact OD1-CA 3.17Å; D481-K483 WeakPolarHBondContact OD1-CB 3.46Å; D481-K483 PolarHBondContact OD1-N 3.42Å; K483-D501 HydrophobicContact CB-CB 3.68Å; K483-D501 HydrophobicContact CD-CB 4.31Å; K483-D501 WeakPolarHBondContact CD-OD2 3.13Å; K483-D501 IonicContact NZ-OD2 2.96Å; K483-D501 PolarHBondContact NZ-OD2 2.91Å
484	N	89.5	Confident	90.5	Very high	101 Å²	101	64 Å²	64	54%	0.54	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-9.9	176.6	-67	-56.1	0	0	0	113.5	D481 R486	D481-N484 HydrophobicContact CB-CB 4.49Å; D481-N484 PolarHBondContact OD1-N 3.05Å; D481-N484 WeakPolarHBondContact OD2-CB 3.47Å; D481-N484 PolarHBondContact OD2-ND2 2.99Å; N484-R486 VanDerWaalsContact C-N 3.34Å; N484-R486 HydrophobicContact CB-CG 4.45Å; N484-R486 PolarHBondContact O-N 2.7Å
485	K	88.8	Confident	90.6	Very high	161 Å²	161	62 Å²	62	70%	0.7	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	44.8	-175.9	-59.4	-178.6	-179.2	178.2	0	112.7	D481	D481-K485 WeakPolarHBondContact O-CA 3.43Å; D481-K485 PolarHBondContact O-N 3.24Å
486	R	89.6	Confident	90.6	Very high	185 Å²	185	62.1 Å²	62.1	70%	0.698	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.3	141	-177.3	-70.8	178.4	-175.5	-162.8	-0.1	110.4	D481 N484	D481-R486 PolarHBondContact N-O 2.94Å; D481-R486 PolarHBondContact O-N 3.06Å; N484-R486 VanDerWaalsContact C-N 3.34Å; N484-R486 HydrophobicContact CB-CG 4.45Å; N484-R486 PolarHBondContact O-N 2.7Å
487	A	89.3	Confident	90.6	Very high	51 Å²	51	64.1 Å²	64.1	42%	0.421	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135.6	167.5	0	0	0	0	0	109.6	Q478 I479 Y480	Q478-A487 HydrophobicContact CG-CB 4.05Å; I479-A487 CarbonylContact O-C 3.59Å; I479-A487 VanDerWaalsContact O-CA 3.29Å; I479-A487 WeakPolarHBondContact O-CA 3.45Å; Y480-A487 HydrophobicContact CD2-CB 4.08Å
488	R	91.1	Very high	90.6	Very high	93 Å²	93	64.2 Å²	64.2	35%	0.351	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	152.1	162.4	63.1	176.8	169.7	136.2	-6.6	109.7	Q478 I479 E490 M497 E502	Q478-R488 WeakPolarHBondContact CA-O 3.34Å; I479-R488 HydrophobicContact CB-CG 3.92Å; I479-R488 HydrophobicContact CD1-CG 4.46Å; I479-R488 HydrophobicContact CG2-CG 4.48Å; I479-R488 PolarHBondContact N-O 3.5Å; I479-R488 PolarHBondContact O-N 3.01Å; R488-E490 IonicContact CZ-OE1 2.67Å; R488-E490 IonicContact NH1-OE1 3.47Å; R488-E490 PolarHBondContact NH1-OE1 2.94Å; R488-M497 PolarHBondContact NH2-O 2.72Å; R488-M497 VanDerWaalsContact NH2-O 3.11Å; R488-E502 IonicContact CZ-OE1 2.84Å; R488-E502 IonicContact CZ-OE2 2.68Å; R488-E502 IonicContact NE-OE1 2.81Å; R488-E502 PolarHBondContact NE-OE1 3.37Å; R488-E502 IonicContact NE-OE2 3.13Å; R488-E502 VanDerWaalsContact NH2-CD 3.34Å; R488-E502 IonicContact NH2-OE1 3.16Å; R488-E502 PolarHBondContact NH2-OE1 3.1Å; R488-E502 VanDerWaalsContact NH2-OE1 3.15Å; R488-E502 IonicContact NH2-OE2 3.07Å; R488-E502 PolarHBondContact NH2-OE2 2.78Å
489	V	91.7	Very high	90.6	Very high	27 Å²	27	63.8 Å²	63.8	16%	0.164	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122.3	177.6	176.4	0	0	0	0	107.8	A476 V477 Q478 F491 A567 F571	A476-V489 HydrophobicContact CB-CG1 3.94Å; V477-V489 CarbonylContact O-C 3.3Å; V477-V489 WeakPolarHBondContact O-CA 3.15Å; Q478-V489 HydrophobicContact CB-CG2 4.28Å; Q478-V489 HydrophobicContact CG-CG2 4.25Å; V489-F491 HydrophobicContact CG1-CE2 4.21Å; V489-F491 HydrophobicContact CG1-CZ 4.19Å; V489-A567 HydrophobicContact CB-CB 3.94Å; V489-A567 HydrophobicContact CG1-CB 4.19Å; V489-A567 HydrophobicContact CG2-CB 4.3Å; V489-F571 HydrophobicContact CG1-CD2 4.48Å; V489-F571 HydrophobicContact CG1-CE2 3.81Å; V489-F571 HydrophobicContact CG2-CD2 3.98Å; V489-F571 HydrophobicContact CG2-CE2 4.06Å
490	E	91.1	Very high	90.4	Very high	38 Å²	38	64.8 Å²	64.8	18%	0.178	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.1	176.6	-65.2	-65.8	163.6	0	0	108.8	V471 A476 V477 I479 R488 N494 A496	V471-E490 HydrophobicContact CG2-CB 4.33Å; A476-E490 CarbonylContact C-O 3.57Å; A476-E490 WeakPolarHBondContact CA-O 3.41Å; V477-E490 PolarHBondContact N-O 2.82Å; V477-E490 PolarHBondContact O-N 3.15Å; I479-E490 HydrophobicContact CD1-CG 3.79Å; R488-E490 IonicContact CZ-OE1 2.67Å; R488-E490 IonicContact NH1-OE1 3.47Å; R488-E490 PolarHBondContact NH1-OE1 2.94Å; E490-N494 PolarHBondContact OE2-ND2 2.9Å; E490-A496 HydrophobicContact CG-CB 4.38Å
491	F	91.8	Very high	90.4	Very high	35 Å²	35	64.2 Å²	64.2	15%	0.154	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	141.1	176.1	-69.2	-81.5	0	0	0	110.5	A476 V489 N494 L527 V558 A567 L570	A476-F491 HydrophobicContact CB-CD1 3.87Å; A476-F491 HydrophobicContact CB-CE1 3.89Å; V489-F491 HydrophobicContact CG1-CE2 4.21Å; V489-F491 HydrophobicContact CG1-CZ 4.19Å; F491-N494 VanDerWaalsContact O-CB 3.26Å; F491-N494 WeakPolarHBondContact O-CB 3.36Å; F491-L527 HydrophobicContact CD1-CD1 4.1Å; F491-L527 HydrophobicContact CE1-CD1 4.12Å; F491-V558 HydrophobicContact CE1-CG1 4.5Å; F491-V558 HydrophobicContact CZ-CG1 4.19Å; F491-A567 HydrophobicContact CE2-CB 3.85Å; F491-A567 HydrophobicContact CZ-CB 3.89Å; F491-L570 HydrophobicContact CE1-CD1 3.67Å; F491-L570 HydrophobicContact CZ-CD1 3.83Å
492	G	87.3	Confident	90.5	Very high	17 Å²	17	64 Å²	64	18%	0.175	32%	0.316	C	S	.	.	S	Bend	trans	-88.3	154.6	179	0	0	0	0	0	114.3	P472 A475	P472-G492 VanDerWaalsContact O-CA 3.29Å; P472-G492 WeakPolarHBondContact O-CA 3.33Å; A475-G492 PolarHBondContact O-N 2.93Å
493	P	88.9	Confident	90.8	Very high	84 Å²	84	59.7 Å²	59.7	55%	0.545	30%	0.3	S	S	.	.	S	Bend	cis	-84.6	109.7	8.3	33.9	-35.7	0	0	0	112.8	V471 H473	V471-P493 WeakPolarHBondContact O-CA 3.35Å; H473-P493 WeakPolarHBondContact NE2-CG 3.14Å
494	N	88.6	Confident	91	Very high	72 Å²	72	53.7 Å²	53.7	39%	0.385	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	153.2	177.3	-167.1	17.6	0	0	0	110	V471 E490 F491	V471-N494 PolarHBondContact N-O 2.87Å; E490-N494 PolarHBondContact OE2-ND2 2.9Å; F491-N494 VanDerWaalsContact O-CB 3.26Å; F491-N494 WeakPolarHBondContact O-CB 3.36Å
495	L	90.4	Very high	91	Very high	42 Å²	42	51 Å²	51	22%	0.22	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	102.7	173.4	-170.5	65.2	0	0	0	109.4	N397 T468 R470 M497	N397-L495 HydrophobicContact CB-CD2 3.57Å; N397-L495 WeakPolarHBondContact OD1-CD2 3.49Å; T468-L495 HydrophobicContact CG2-CD2 4.42Å; R470-L495 HydrophobicContact CB-CD1 4.22Å; L495-M497 HydrophobicContact CD2-CE 4.25Å; L495-M497 HydrophobicContact CD2-CG 4.37Å; L495-M497 HydrophobicContact CD2-SD 4.49Å; L495-M497 HydrophobicContact CG-CG 4.22Å; L495-M497 PolarHBondContact O-N 2.93Å
496	A	90.8	Very high	91	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	110.4	174.8	0	0	0	0	0	109.8	T468 F469 V471 I479 E490 F504	T468-A496 CarbonylContact C-O 3.58Å; T468-A496 WeakPolarHBondContact CA-O 3.34Å; F469-A496 PolarHBondContact N-O 2.99Å; F469-A496 WeakPolarHBondContact O-CB 3.42Å; F469-A496 PolarHBondContact O-N 2.83Å; V471-A496 HydrophobicContact CG2-CB 4.02Å; I479-A496 HydrophobicContact CD1-CB 3.98Å; E490-A496 HydrophobicContact CG-CB 4.38Å; A496-F504 HydrophobicContact CB-CE1 3.96Å; A496-F504 HydrophobicContact CB-CZ 4.29Å
497	M	92.4	Very high	91	Very high	43 Å²	43	39.8 Å²	39.8	21%	0.212	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	125.8	174.9	-55.7	-164.6	-122	0	0	110.3	C396 I414 V466 T468 R488 L495	C396-M497 WeakPolarHBondContact O-CE 3.4Å; I414-M497 HydrophobicContact CD1-CB 4.43Å; I414-M497 HydrophobicContact CD1-SD 4.09Å; I414-M497 HydrophobicContact CG2-CE 4.06Å; I414-M497 HydrophobicContact CG2-SD 3.71Å; V466-M497 HydrophobicContact CG1-CB 3.94Å; T468-M497 HydrophobicContact CG2-CG 3.86Å; T468-M497 HydrophobicContact CG2-SD 4.26Å; R488-M497 PolarHBondContact NH2-O 2.72Å; R488-M497 VanDerWaalsContact NH2-O 3.11Å; L495-M497 HydrophobicContact CD2-CE 4.25Å; L495-M497 HydrophobicContact CD2-CG 4.37Å; L495-M497 HydrophobicContact CD2-SD 4.49Å; L495-M497 HydrophobicContact CG-CG 4.22Å; L495-M497 PolarHBondContact O-N 2.93Å
498	L	93.9	Very high	91.1	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	20%	0.201	C	C	.	.			trans	-83	130.3	-178.4	-64.8	-173.7	0	0	0	112.5	Y401 L431 V467 I479 E502 F504	Y401-L498 WeakPolarHBondContact CE1-O 3.46Å; Y401-L498 PolarHBondContact OH-O 2.9Å; L431-L498 HydrophobicContact CD2-CD1 4.43Å; V467-L498 HydrophobicContact CB-CB 4.43Å; V467-L498 HydrophobicContact CB-CD1 4.11Å; V467-L498 HydrophobicContact CB-CG 4.43Å; V467-L498 HydrophobicContact CG1-CD1 4.14Å; V467-L498 PolarHBondContact O-N 2.85Å; I479-L498 HydrophobicContact CB-CD2 4.41Å; I479-L498 HydrophobicContact CD1-CD2 4.2Å; I479-L498 HydrophobicContact CG1-CD2 4.08Å; I479-L498 HydrophobicContact CG2-CD2 3.51Å; L498-E502 HydrophobicContact CB-CB 4.4Å; L498-E502 HydrophobicContact CD2-CB 4.08Å; L498-F504 HydrophobicContact CD1-CD2 3.81Å; L498-F504 HydrophobicContact CD1-CE2 3.62Å; L498-F504 HydrophobicContact CD1-CG 4.41Å; L498-F504 HydrophobicContact CD1-CZ 4.08Å; L498-F504 HydrophobicContact CD2-CD1 4.08Å; L498-F504 HydrophobicContact CD2-CD2 4.45Å; L498-F504 HydrophobicContact CD2-CE1 3.75Å; L498-F504 HydrophobicContact CD2-CE2 4.14Å; L498-F504 HydrophobicContact CD2-CG 4.41Å; L498-F504 HydrophobicContact CD2-CZ 3.77Å; L498-F504 HydrophobicContact CG-CD2 4.37Å; L498-F504 HydrophobicContact CG-CE1 4.26Å; L498-F504 HydrophobicContact CG-CE2 3.81Å; L498-F504 HydrophobicContact CG-CZ 3.73Å
499	G	92.1	Very high	91.1	Very high	17 Å²	17	34.7 Å²	34.7	18%	0.175	19%	0.189	C	C	.	.			trans	-67.5	170	162	0	0	0	0	0	112.9	K429 D501 E502	K429-G499 PolarHBondContact NZ-O 2.8Å; G499-D501 VanDerWaalsContact C-N 3.32Å; G499-D501 PolarHBondContact O-N 3.42Å; G499-E502 PolarHBondContact N-OE2 2.79Å; G499-E502 PolarHBondContact O-N 3.28Å
500	P	91.5	Very high	91.2	Very high	21 Å²	21	33.8 Å²	33.8	14%	0.136	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-43	-177.8	-25.2	33.5	0	0	0	113.7	Y401 V410 W427 K429	Y401-P500 HydrophobicContact CD1-CB 4.46Å; Y401-P500 HydrophobicContact CD1-CG 4.02Å; Y401-P500 HydrophobicContact CE1-CG 4.33Å; V410-P500 HydrophobicContact CB-CB 4.15Å; V410-P500 HydrophobicContact CB-CG 4.35Å; V410-P500 HydrophobicContact CG1-CB 3.76Å; V410-P500 HydrophobicContact CG1-CG 3.87Å; W427-P500 HydrophobicContact CZ3-CB 4.24Å; K429-P500 PolarHBondContact NZ-O 3.27Å
501	D	91.7	Very high	91	Very high	64 Å²	64	32 Å²	32	34%	0.342	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	2.4	-176	-58.1	-68.7	0	0	0	113.9	Y482 K483 G499	Y482-D501 PolarHBondContact N-O 3.24Å; K483-D501 HydrophobicContact CB-CB 3.68Å; K483-D501 HydrophobicContact CD-CB 4.31Å; K483-D501 WeakPolarHBondContact CD-OD2 3.13Å; K483-D501 IonicContact NZ-OD2 2.96Å; K483-D501 PolarHBondContact NZ-OD2 2.91Å; G499-D501 VanDerWaalsContact C-N 3.32Å; G499-D501 PolarHBondContact O-N 3.42Å
502	E	94	Very high	90.9	Very high	20 Å²	20	32.5 Å²	32.5	9%	0.093	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	149.2	-177.2	-68.3	-169.6	129.1	0	0	113.5	K429 I479 Y480 D481 R488 L498 G499	K429-E502 WeakPolarHBondContact CE-O 3.5Å; K429-E502 PolarHBondContact NZ-O 2.84Å; I479-E502 HydrophobicContact CG2-CB 3.69Å; I479-E502 HydrophobicContact CG2-CG 4.01Å; Y480-E502 CarbonylContact O-C 3.56Å; Y480-E502 VanDerWaalsContact O-CA 3.29Å; Y480-E502 WeakPolarHBondContact O-CA 3.08Å; D481-E502 HydrophobicContact CB-CG 4.01Å; R488-E502 IonicContact CZ-OE1 2.84Å; R488-E502 IonicContact CZ-OE2 2.68Å; R488-E502 IonicContact NE-OE1 2.81Å; R488-E502 PolarHBondContact NE-OE1 3.37Å; R488-E502 IonicContact NE-OE2 3.13Å; R488-E502 VanDerWaalsContact NH2-CD 3.34Å; R488-E502 IonicContact NH2-OE1 3.16Å; R488-E502 PolarHBondContact NH2-OE1 3.1Å; R488-E502 VanDerWaalsContact NH2-OE1 3.15Å; R488-E502 IonicContact NH2-OE2 3.07Å; R488-E502 PolarHBondContact NH2-OE2 2.78Å; L498-E502 HydrophobicContact CB-CB 4.4Å; L498-E502 HydrophobicContact CD2-CB 4.08Å; G499-E502 PolarHBondContact N-OE2 2.79Å; G499-E502 PolarHBondContact O-N 3.28Å
503	Q	93	Very high	91	Very high	45 Å²	45	36.8 Å²	36.8	21%	0.21	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	155.9	169.6	-54.6	-175.2	-1.5	0	0	112.1	L431 I479 Y480 Y482	L431-Q503 HydrophobicContact CD2-CB 4.33Å; L431-Q503 HydrophobicContact CD2-CG 3.97Å; I479-Q503 CarbonylContact C-O 3.51Å; I479-Q503 WeakPolarHBondContact CA-O 3.31Å; Y480-Q503 PolarHBondContact N-O 3.19Å; Y480-Q503 PolarHBondContact O-N 2.97Å; Y482-Q503 HydrophobicContact CD2-CG 4.19Å; Y482-Q503 HydrophobicContact CE2-CB 3.97Å; Y482-Q503 HydrophobicContact CE2-CG 3.75Å
504	F	92.7	Very high	91	Very high	8 Å²	8	36 Å²	36	4%	0.035	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	137.9	170.7	-65.1	-59.7	0	0	0	112	V435 L439 V467 F469 V477 I479 A496 L498 R506 L523	V435-F504 HydrophobicContact CG1-CB 4.36Å; V435-F504 HydrophobicContact CG1-CD2 4.3Å; L439-F504 HydrophobicContact CD1-CD2 4.48Å; L439-F504 HydrophobicContact CD1-CE2 4.48Å; L439-F504 HydrophobicContact CD2-CD2 4.17Å; L439-F504 HydrophobicContact CD2-CE2 3.87Å; V467-F504 HydrophobicContact CG1-CE2 4.13Å; F469-F504 HydrophobicContact CB-CE1 4.02Å; F469-F504 HydrophobicContact CB-CE2 3.8Å; F469-F504 HydrophobicContact CB-CZ 3.36Å; F469-F504 HydrophobicContact CG-CZ 4.33Å; V477-F504 HydrophobicContact CG1-CD1 3.43Å; V477-F504 VanDerWaalsContact CG1-CD1 3.43Å; V477-F504 HydrophobicContact CG1-CE1 3.76Å; I479-F504 HydrophobicContact CD1-CE1 4.24Å; I479-F504 HydrophobicContact CG1-CD1 3.95Å; I479-F504 HydrophobicContact CG1-CE1 3.9Å; A496-F504 HydrophobicContact CB-CE1 3.96Å; A496-F504 HydrophobicContact CB-CZ 4.29Å; L498-F504 HydrophobicContact CD1-CD2 3.81Å; L498-F504 HydrophobicContact CD1-CE2 3.62Å; L498-F504 HydrophobicContact CD1-CG 4.41Å; L498-F504 HydrophobicContact CD1-CZ 4.08Å; L498-F504 HydrophobicContact CD2-CD1 4.08Å; L498-F504 HydrophobicContact CD2-CD2 4.45Å; L498-F504 HydrophobicContact CD2-CE1 3.75Å; L498-F504 HydrophobicContact CD2-CE2 4.14Å; L498-F504 HydrophobicContact CD2-CG 4.41Å; L498-F504 HydrophobicContact CD2-CZ 3.77Å; L498-F504 HydrophobicContact CG-CD2 4.37Å; L498-F504 HydrophobicContact CG-CE1 4.26Å; L498-F504 HydrophobicContact CG-CE2 3.81Å; L498-F504 HydrophobicContact CG-CZ 3.73Å; F504-R506 PolarHBondContact O-N 3Å; F504-L523 HydrophobicContact CB-CD1 4.49Å; F504-L523 HydrophobicContact CB-CD2 4.02Å; F504-L523 HydrophobicContact CD2-CD1 4.16Å; F504-L523 HydrophobicContact CG-CD1 4.46Å
505	T	89.9	Confident	91.1	Very high	44 Å²	44	34.7 Å²	34.7	27%	0.27	19%	0.19	S	C	.	.			trans	-83	106.5	174.7	-51.2	0	0	0	0	109.5	Q478 L507	Q478-T505 WeakPolarHBondContact O-CB 3.3Å; Q478-T505 PolarHBondContact O-N 2.69Å; Q478-T505 PolarHBondContact O-OG1 2.7Å; T505-L507 PolarHBondContact O-N 3.14Å
506	R	89.7	Confident	91.2	Very high	103 Å²	103	39 Å²	39	39%	0.389	21%	0.208	S	C	.	.			trans	-70.8	114.2	179.2	-176	-153.3	65.3	-167.8	-8.3	111.3	E434 L438 F504 L523	E434-R506 IonicContact OE1-NH1 2.61Å; E434-R506 PolarHBondContact OE1-NH1 3.43Å; E434-R506 VanDerWaalsContact OE1-NH1 3.14Å; E434-R506 IonicContact OE2-CZ 3.13Å; E434-R506 IonicContact OE2-NE 3.75Å; E434-R506 IonicContact OE2-NH1 2.63Å; E434-R506 PolarHBondContact OE2-NH1 2.7Å; L438-R506 HydrophobicContact CD1-CG 4.08Å; F504-R506 PolarHBondContact O-N 3Å; R506-L523 HydrophobicContact CB-CD2 4.48Å
507	L	89.8	Confident	91.2	Very high	9 Å²	9	43.2 Å²	43.2	5%	0.047	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	142.9	168.9	-63.1	171.5	0	0	0	110.7	T505 K521 S522 L525 F571	T505-L507 PolarHBondContact O-N 3.14Å; L507-K521 WeakPolarHBondContact O-CA 3.28Å; L507-S522 PolarHBondContact N-O 2.83Å; L507-S522 PolarHBondContact O-N 3.08Å; L507-L525 HydrophobicContact CD1-CB 3.77Å; L507-L525 HydrophobicContact CD1-CD1 4.09Å; L507-F571 HydrophobicContact CD1-CE1 4.17Å; L507-F571 HydrophobicContact CD2-CD1 3.87Å; L507-F571 HydrophobicContact CD2-CE1 4.1Å; L507-F571 HydrophobicContact CG-CE1 4.35Å
508	S	90.5	Very high	91	Very high	16 Å²	16	46.3 Å²	46.3	11%	0.112	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	100.9	172.9	-146	0	0	0	0	109	N518 I520 D575	S508-N518 WeakPolarHBondContact OG-CA 3.32Å; S508-N518 PolarHBondContact OG-OD1 3.49Å; S508-I520 CarbonylContact C-O 3.57Å; S508-I520 WeakPolarHBondContact CA-O 3.38Å; S508-D575 WeakPolarHBondContact O-CB 3.38Å
509	L	91.4	Very high	90.6	Very high	21 Å²	21	49.9 Å²	49.9	11%	0.11	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	149.9	-170.8	-53.1	177	0	0	0	111.5	V519 I520 P574 D575 F576 V577	L509-V519 PolarHBondContact O-N 2.94Å; L509-I520 HydrophobicContact CB-CB 4.17Å; L509-I520 PolarHBondContact N-O 3.27Å; L509-I520 PolarHBondContact O-N 3.47Å; L509-P574 WeakPolarHBondContact CD2-O 3.3Å; L509-D575 WeakPolarHBondContact CA-OD1 3.48Å; L509-F576 HydrophobicContact CD1-CE1 3.88Å; L509-F576 HydrophobicContact CD2-CD1 3.74Å; L509-F576 HydrophobicContact CD2-CE1 3.87Å; L509-V577 HydrophobicContact CB-CG2 4.31Å; L509-V577 HydrophobicContact CD1-CG2 4.35Å
510	S	92.8	Very high	90.4	Very high	7 Å²	7	53 Å²	53	5%	0.049	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	132.5	174.4	-80.8	0	0	0	0	112.4	K515 K516 P517 D575 V577 G578	S510-K515 WeakPolarHBondContact O-CD 3.41Å; S510-K516 CarbonylContact C-O 3.49Å; S510-K516 WeakPolarHBondContact CA-O 3.45Å; S510-P517 WeakPolarHBondContact OG-CA 3.44Å; S510-D575 WeakPolarHBondContact CB-OD2 3.32Å; S510-D575 VanDerWaalsContact N-CG 3.3Å; S510-D575 PolarHBondContact N-OD1 3.43Å; S510-D575 PolarHBondContact N-OD2 2.61Å; S510-D575 PolarHBondContact OG-OD2 2.99Å; S510-V577 WeakPolarHBondContact O-CG1 3.17Å; S510-G578 VanDerWaalsContact OG-CA 3.32Å; S510-G578 WeakPolarHBondContact OG-CA 3.14Å
511	G	88.4	Confident	90.2	Very high	2 Å²	2	56.5 Å²	56.5	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	171.8	-177.4	0	0	0	0	0	113.3	K515 K516	G511-K515 WeakPolarHBondContact O-CA 3.46Å; G511-K516 PolarHBondContact N-O 3.45Å; G511-K516 PolarHBondContact O-N 2.89Å
512	G	88.9	Confident	90.1	Very high	45 Å²	45	54.5 Å²	54.5	46%	0.464	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	-176.3	-177.5	0	0	0	0	0	114.9	P514 K515	G512-P514 CarbonylContact C-O 3.54Å; G512-K515 PolarHBondContact O-NZ 3.06Å
513	K	89.6	Confident	89.9	Confident	106 Å²	106	53.8 Å²	53.8	46%	0.461	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	113.2	175.8	-52	-167.3	-155.9	-160	0	108.2	T533 V535	K513-T533 WeakPolarHBondContact CE-OG1 3.44Å; K513-T533 PolarHBondContact NZ-OG1 2.78Å; K513-T533 VanDerWaalsContact NZ-OG1 3.14Å; K513-V535 HydrophobicContact CB-CG2 3.92Å
514	P	89.9	Confident	89.7	Confident	68 Å²	68	51.8 Å²	51.8	44%	0.442	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	cis	-58.7	160.8	-11	29.7	-37.6	0	0	0	112.3	G512 K516 D534 V535	G512-P514 CarbonylContact C-O 3.54Å; P514-K516 PolarHBondContact O-N 2.89Å; P514-D534 WeakPolarHBondContact CA-OD1 3.5Å; P514-V535 HydrophobicContact CB-CB 4.37Å; P514-V535 WeakPolarHBondContact CB-O 3.32Å
515	K	90.8	Very high	89.6	Confident	44 Å²	44	51.5 Å²	51.5	19%	0.191	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	130.4	177.8	-75	-81.5	174.7	-92.2	0	111.7	S510 G511 G512 T533 D534 V577 C581	S510-K515 WeakPolarHBondContact O-CD 3.41Å; G511-K515 WeakPolarHBondContact O-CA 3.46Å; G512-K515 PolarHBondContact O-NZ 3.06Å; K515-T533 WeakPolarHBondContact CE-O 3.47Å; K515-T533 PolarHBondContact NZ-O 3.43Å; K515-D534 HydrophobicContact CG-CB 3.96Å; K515-D534 WeakPolarHBondContact CG-OD1 3.43Å; K515-D534 PolarHBondContact N-OD1 2.82Å; K515-V577 HydrophobicContact CD-CG1 3.91Å; K515-C581 HydrophobicContact CG-CB 4.24Å
516	K	91.6	Very high	89.7	Confident	134 Å²	134	50.4 Å²	50.4	58%	0.583	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.7	173.5	-62.3	179.9	-176.7	-179.6	0	109.1	S510 G511 P514 V519	S510-K516 CarbonylContact C-O 3.49Å; S510-K516 WeakPolarHBondContact CA-O 3.45Å; G511-K516 PolarHBondContact N-O 3.45Å; G511-K516 PolarHBondContact O-N 2.89Å; P514-K516 PolarHBondContact O-N 2.89Å; K516-V519 HydrophobicContact CB-CG2 3.91Å; K516-V519 VanDerWaalsContact O-CG2 3.28Å; K516-V519 WeakPolarHBondContact O-CG2 3.46Å
517	P	91.1	Very high	89.8	Confident	89 Å²	89	45.9 Å²	45.9	58%	0.578	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	158.7	-178.3	29.4	-36	0	0	0	112.6	S510 V519	S510-P517 WeakPolarHBondContact OG-CA 3.44Å; P517-V519 PolarHBondContact O-N 3.48Å
518	N	87.3	Confident	89.6	Confident	107 Å²	107	46 Å²	46	57%	0.572	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58	25.3	174.1	-54.2	-24.7	0	0	0	115.7	S508	S508-N518 WeakPolarHBondContact OG-CA 3.32Å; S508-N518 PolarHBondContact OG-OD1 3.49Å
519	V	87	Confident	89.7	Confident	77 Å²	77	50.9 Å²	50.9	47%	0.467	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-38.8	-179.3	172.3	0	0	0	0	111.9	L509 K516 P517	L509-V519 PolarHBondContact O-N 2.94Å; K516-V519 HydrophobicContact CB-CG2 3.91Å; K516-V519 VanDerWaalsContact O-CG2 3.28Å; K516-V519 WeakPolarHBondContact O-CG2 3.46Å; P517-V519 PolarHBondContact O-N 3.48Å
520	I	86.9	Confident	89.7	Confident	83 Å²	83	51.3 Å²	51.3	43%	0.426	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.7	-179.1	-60.2	169.1	0	0	0	107.5	S508 L509	S508-I520 CarbonylContact C-O 3.57Å; S508-I520 WeakPolarHBondContact CA-O 3.38Å; L509-I520 HydrophobicContact CB-CB 4.17Å; L509-I520 PolarHBondContact N-O 3.27Å; L509-I520 PolarHBondContact O-N 3.47Å
521	K	88.1	Confident	89.6	Confident	95 Å²	95	56.6 Å²	56.6	41%	0.413	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133	174.7	-60.7	-177.9	-179.4	-172.6	0	108.3	E434 L438 L507	E434-K521 IonicContact OE1-NZ 3.84Å; E434-K521 PolarHBondContact OE1-NZ 3.02Å; E434-K521 WeakPolarHBondContact OE2-CD 3.5Å; E434-K521 WeakPolarHBondContact OE2-CE 3.5Å; E434-K521 IonicContact OE2-NZ 3.89Å; E434-K521 PolarHBondContact OE2-NZ 3.44Å; L438-K521 HydrophobicContact CD1-CB 4.31Å; L438-K521 HydrophobicContact CD2-CB 4.4Å; L507-K521 WeakPolarHBondContact O-CA 3.28Å
522	S	88.6	Confident	89.7	Confident	21 Å²	21	57.2 Å²	57.2	15%	0.147	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	155.1	-178.3	-177.5	0	0	0	0	110.7	L507 C524	L507-S522 PolarHBondContact N-O 2.83Å; L507-S522 PolarHBondContact O-N 3.08Å; S522-C524 PolarHBondContact OG-N 3.41Å; S522-C524 VanDerWaalsContact OG-N 3.1Å; S522-C524 PolarHBondContact OG-O 3.45Å
523	L	89.2	Confident	89.9	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	30%	0.297	C	S	.	.	S	Bend	trans	-92.9	-23.5	167.9	-57.8	-178.4	0	0	0	112.3	V435 L438 L439 F469 F504 R506	V435-L523 HydrophobicContact CG1-CD1 4.34Å; V435-L523 HydrophobicContact CG1-CD2 4.11Å; V435-L523 HydrophobicContact CG2-CD2 4.33Å; L438-L523 HydrophobicContact CB-CD1 3.94Å; L438-L523 HydrophobicContact CB-CD2 4.27Å; L438-L523 HydrophobicContact CB-CG 3.84Å; L438-L523 HydrophobicContact CD1-CD2 3.72Å; L438-L523 HydrophobicContact CD1-CG 3.95Å; L439-L523 HydrophobicContact CD2-CD1 3.64Å; L439-L523 HydrophobicContact CG-CD1 3.82Å; F469-L523 HydrophobicContact CD2-CD1 4.38Å; F469-L523 HydrophobicContact CE2-CD1 4.42Å; F469-L523 HydrophobicContact CZ-CB 4.4Å; F504-L523 HydrophobicContact CB-CD1 4.49Å; F504-L523 HydrophobicContact CB-CD2 4.02Å; F504-L523 HydrophobicContact CD2-CD1 4.16Å; F504-L523 HydrophobicContact CG-CD1 4.46Å; R506-L523 HydrophobicContact CB-CD2 4.48Å
524	C	89.7	Confident	90.1	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.02	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	140.1	179.5	65.4	0	0	0	0	113	P445 F469 A475 A476 V477 S522	P445-C524 WeakPolarHBondContact CG-SG 3.45Å; F469-C524 HydrophobicContact CE1-CB 4.16Å; F469-C524 HydrophobicContact CZ-CB 4.39Å; A475-C524 HydrophobicContact CB-CB 4.41Å; A476-C524 CarbonylContact O-C 3.51Å; A476-C524 WeakPolarHBondContact O-CA 3.44Å; V477-C524 HydrophobicContact CG2-CB 3.61Å; S522-C524 PolarHBondContact OG-N 3.41Å; S522-C524 VanDerWaalsContact OG-N 3.1Å; S522-C524 PolarHBondContact OG-O 3.45Å
525	L	91.2	Very high	90.3	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.016	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.5	165.7	-174.4	69.1	0	0	0	108.5	A475 A476 L507 L527 F556 L570 F571 F576	A475-L525 CarbonylContact C-O 3.56Å; A475-L525 WeakPolarHBondContact CA-O 3.19Å; A475-L525 WeakPolarHBondContact CB-O 3.43Å; A476-L525 PolarHBondContact N-O 2.82Å; A476-L525 PolarHBondContact O-N 3.13Å; L507-L525 HydrophobicContact CD1-CB 3.77Å; L507-L525 HydrophobicContact CD1-CD1 4.09Å; L525-L527 HydrophobicContact CD2-CD2 4.3Å; L525-F556 HydrophobicContact CD1-CE2 4.05Å; L525-F556 HydrophobicContact CD1-CZ 4.07Å; L525-F556 HydrophobicContact CD2-CE1 4.32Å; L525-F556 HydrophobicContact CD2-CE2 4.12Å; L525-F556 HydrophobicContact CD2-CZ 3.98Å; L525-F556 HydrophobicContact CG-CE2 4.17Å; L525-F556 HydrophobicContact CG-CZ 4.37Å; L525-L570 HydrophobicContact CD2-CB 3.76Å; L525-L570 HydrophobicContact CD2-CD2 4.2Å; L525-L570 HydrophobicContact CD2-CG 4.47Å; L525-F571 HydrophobicContact CB-CE1 4.07Å; L525-F571 HydrophobicContact CB-CZ 3.84Å; L525-F576 HydrophobicContact CD1-CD1 3.76Å; L525-F576 HydrophobicContact CD1-CE1 3.42Å; L525-F576 VanDerWaalsContact CD1-CE1 3.42Å; L525-F576 HydrophobicContact CD1-CZ 4.31Å
526	L	91.1	Very high	90.3	Very high	20 Å²	20	47.6 Å²	47.6	11%	0.105	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	130.4	174.4	-61.5	172.1	0	0	0	108.5	P445 F446 A475 G528 W554	P445-L526 HydrophobicContact CB-CD1 3.96Å; P445-L526 HydrophobicContact CB-CD2 4.14Å; P445-L526 HydrophobicContact CB-CG 4.46Å; P445-L526 VanDerWaalsContact O-CD1 3.28Å; P445-L526 WeakPolarHBondContact O-CD1 3.42Å; F446-L526 HydrophobicContact CD2-CD2 4.43Å; F446-L526 HydrophobicContact CE1-CD2 4.4Å; F446-L526 HydrophobicContact CE2-CD2 3.83Å; F446-L526 HydrophobicContact CZ-CD2 3.81Å; A475-L526 HydrophobicContact CB-CD2 3.72Å; L526-G528 VanDerWaalsContact C-N 3.35Å; L526-W554 WeakPolarHBondContact O-CH2 3.06Å; L526-W554 VanDerWaalsContact O-CZ3 3.32Å; L526-W554 WeakPolarHBondContact O-CZ3 3.32Å
527	L	91.1	Very high	90.4	Very high	9 Å²	9	45.5 Å²	45.5	5%	0.047	25%	0.252	C	S	.	.			trans	-84.4	-8.9	-169.4	-58.3	177.3	0	0	0	113.4	N474 A476 F491 L525 V555 F556 L570	N474-L527 WeakPolarHBondContact O-CB 3.34Å; N474-L527 WeakPolarHBondContact O-CG 2.94Å; N474-L527 PolarHBondContact O-N 2.96Å; A476-L527 HydrophobicContact CB-CD2 4.28Å; F491-L527 HydrophobicContact CD1-CD1 4.1Å; F491-L527 HydrophobicContact CE1-CD1 4.12Å; L525-L527 HydrophobicContact CD2-CD2 4.3Å; L527-V555 CarbonylContact O-C 3.5Å; L527-V555 WeakPolarHBondContact O-CA 3.46Å; L527-F556 HydrophobicContact CB-CB 4.34Å; L527-F556 HydrophobicContact CD2-CB 4.09Å; L527-F556 HydrophobicContact CD2-CD2 4.39Å; L527-F556 HydrophobicContact CD2-CG 4.35Å; L527-F556 PolarHBondContact O-N 2.86Å; L527-L570 HydrophobicContact CD2-CD1 3.99Å; L527-L570 HydrophobicContact CD2-CD2 3.94Å
528	G	87.3	Confident	90.4	Very high	11 Å²	11	41.4 Å²	41.4	11%	0.113	23%	0.226	C	C	.	.	S	Bend	trans	75.1	179.4	-174.2	0	0	0	0	0	112.8	N474 L526	N474-G528 PolarHBondContact ND2-O 2.92Å; L526-G528 VanDerWaalsContact C-N 3.35Å
529	P	91.8	Very high	90.5	Very high	118 Å²	118	40.4 Å²	40.4	77%	0.766	22%	0.218	S	C	*	.	S	Bend	cis	-68	133.4	12	27.9	-35.8	0	0	0	112.5	W554	P529-W554 WeakPolarHBondContact CA-O 3.4Å
530	D	91.6	Very high	90.7	Very high	30 Å²	30	36.9 Å²	36.9	16%	0.16	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	176.9	-178.1	-173.2	18.4	0	0	0	108.8	R449 N553 W554	R449-D530 IonicContact CZ-OD1 3.4Å; R449-D530 IonicContact CZ-OD2 2.79Å; R449-D530 VanDerWaalsContact NH1-CG 3.25Å; R449-D530 IonicContact NH1-OD1 3.84Å; R449-D530 PolarHBondContact NH1-OD1 3.25Å; R449-D530 IonicContact NH1-OD2 2.79Å; R449-D530 PolarHBondContact NH1-OD2 2.85Å; R449-D530 IonicContact NH2-OD1 3.92Å; R449-D530 IonicContact NH2-OD2 3.28Å; R449-D530 PolarHBondContact NH2-OD2 2.86Å; D530-N553 WeakPolarHBondContact O-CA 3.42Å; D530-W554 HydrophobicContact CB-CD2 4.37Å; D530-W554 HydrophobicContact CB-CH2 3.89Å; D530-W554 HydrophobicContact CB-CZ2 3.59Å; D530-W554 HydrophobicContact CB-CZ3 4.39Å; D530-W554 PolarHBondContact N-O 2.74Å; D530-W554 PolarHBondContact O-N 2.78Å; D530-W554 WeakPolarHBondContact OD2-CZ2 3.35Å
531	F	91.2	Very high	90.8	Very high	118 Å²	118	34.8 Å²	34.8	52%	0.518	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.8	-180	71.6	-83.2	0	0	0	113	T533 Y552 N553	F531-T533 HydrophobicContact CD2-CG2 4.26Å; F531-T533 HydrophobicContact CE2-CG2 4.35Å; F531-Y552 CarbonylContact C-O 3.58Å; F531-Y552 VanDerWaalsContact CA-O 3.25Å; F531-Y552 WeakPolarHBondContact CA-O 3.39Å; F531-N553 WeakPolarHBondContact CB-OD1 3.45Å
532	C	90.9	Very high	90.9	Very high	15 Å²	15	33.6 Å²	33.6	10%	0.101	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.6	171.6	64.4	0	0	0	0	110.3	Y552 V577	C532-Y552 PolarHBondContact N-O 2.85Å; C532-Y552 PolarHBondContact O-N 3.26Å; C532-V577 HydrophobicContact CB-CG1 4.16Å
533	T	91.9	Very high	90.7	Very high	15 Å²	15	39.4 Å²	39.4	9%	0.092	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	139.6	177.8	47	0	0	0	0	111.2	K513 K515 F531 L550 S551	K513-T533 WeakPolarHBondContact CE-OG1 3.44Å; K513-T533 PolarHBondContact NZ-OG1 2.78Å; K513-T533 VanDerWaalsContact NZ-OG1 3.14Å; K515-T533 WeakPolarHBondContact CE-O 3.47Å; K515-T533 PolarHBondContact NZ-O 3.43Å; F531-T533 HydrophobicContact CD2-CG2 4.26Å; F531-T533 HydrophobicContact CE2-CG2 4.35Å; T533-L550 CarbonylContact C-O 3.6Å; T533-L550 WeakPolarHBondContact CA-O 3.41Å; T533-S551 WeakPolarHBondContact CG2-OG 3.49Å
534	D	94.1	Very high	90.5	Very high	12 Å²	12	40.5 Å²	40.5	6%	0.064	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	162.6	175.2	-164.3	15.9	0	0	0	110.8	P514 K515 L550 Y552 C581	P514-D534 WeakPolarHBondContact CA-OD1 3.5Å; K515-D534 HydrophobicContact CG-CB 3.96Å; K515-D534 WeakPolarHBondContact CG-OD1 3.43Å; K515-D534 PolarHBondContact N-OD1 2.82Å; D534-L550 PolarHBondContact N-O 3.11Å; D534-L550 PolarHBondContact O-N 2.96Å; D534-Y552 HydrophobicContact CB-CE2 4.01Å; D534-C581 HydrophobicContact CB-CB 4.45Å
535	V	94.3	Very high	90.5	Very high	28 Å²	28	46.6 Å²	46.6	17%	0.17	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	109.8	175.4	170.5	0	0	0	0	108.3	K513 P514 S547 L548 Q549	K513-V535 HydrophobicContact CB-CG2 3.92Å; P514-V535 HydrophobicContact CB-CB 4.37Å; P514-V535 WeakPolarHBondContact CB-O 3.32Å; V535-S547 WeakPolarHBondContact CG1-OG 3.36Å; V535-L548 CarbonylContact C-O 3.56Å; V535-L548 WeakPolarHBondContact CA-O 3.42Å; V535-Q549 HydrophobicContact CG2-CB 4.29Å; V535-Q549 HydrophobicContact CG2-CG 4.12Å
536	V	91.5	Very high	90.4	Very high	7 Å²	7	46.5 Å²	46.5	4%	0.042	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	118	-176.9	-174.8	0	0	0	0	108.9	V538 L548 L550 A585 R589	V536-V538 HydrophobicContact CG1-CG1 3.9Å; V536-L548 PolarHBondContact N-O 3.42Å; V536-L548 PolarHBondContact O-N 3.28Å; V536-L550 HydrophobicContact CG2-CD1 4.35Å; V536-A585 HydrophobicContact CB-CB 4.4Å; V536-A585 HydrophobicContact CG1-CB 3.79Å; V536-A585 HydrophobicContact CG2-CB 3.64Å; V536-R589 HydrophobicContact CG1-CG 4.25Å
537	I	91.8	Very high	90.5	Very high	89 Å²	89	47 Å²	47	46%	0.456	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	124	169.7	-58.7	174.1	0	0	0	108.2	L546 V645	I537-L546 CarbonylContact C-O 3.6Å; I537-L546 WeakPolarHBondContact CA-O 3.48Å; I537-V645 HydrophobicContact CG2-CG2 4.31Å
538	V	91.2	Very high	90.5	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.024	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	164.1	178.4	-56.2	0	0	0	0	110.2	V536 R545 L546 L548 V588 R589 V592	V536-V538 HydrophobicContact CG1-CG1 3.9Å; V538-R545 WeakPolarHBondContact O-CA 3.49Å; V538-L546 HydrophobicContact CG2-CB 3.82Å; V538-L546 PolarHBondContact N-O 3.48Å; V538-L546 PolarHBondContact O-N 2.88Å; V538-L548 HydrophobicContact CB-CD1 4.39Å; V538-L548 HydrophobicContact CG1-CD1 3.61Å; V538-L548 HydrophobicContact CG1-CG 4.12Å; V538-L548 HydrophobicContact CG2-CD1 3.81Å; V538-L548 HydrophobicContact CG2-CD2 4.15Å; V538-L548 HydrophobicContact CG2-CG 3.82Å; V538-V588 HydrophobicContact CG1-CG1 4.2Å; V538-R589 HydrophobicContact CB-CG 4.44Å; V538-R589 HydrophobicContact CG1-CG 3.85Å; V538-V592 HydrophobicContact CB-CB 4.27Å; V538-V592 HydrophobicContact CB-CG1 4.07Å; V538-V592 HydrophobicContact CG2-CB 4.39Å; V538-V592 HydrophobicContact CG2-CG1 3.79Å
539	E	90.9	Very high	90.9	Very high	85 Å²	85	48.6 Å²	48.6	40%	0.397	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	133.2	173.6	-168.1	171.9	142.4	0	0	107.8	H543 A544 R545 A593	E539-H543 IonicContact OE1-CE1 2.67Å; E539-H543 IonicContact OE1-CG 3.85Å; E539-H543 IonicContact OE1-ND1 3.87Å; E539-H543 PolarHBondContact OE1-ND1 3.2Å; E539-A544 WeakPolarHBondContact CA-O 3.35Å; E539-R545 HydrophobicContact CB-CG 4.48Å; E539-R545 HydrophobicContact CG-CG 4.1Å; E539-A593 WeakPolarHBondContact O-CA 3.37Å; E539-A593 PolarHBondContact O-N 3.27Å
540	T	90.1	Very high	91	Very high	4 Å²	4	43 Å²	43	3%	0.025	22%	0.219	C	C	.	.			trans	-82.9	170.7	178.8	57.9	0	0	0	0	111.4	D542 H543 A544 L546 V592 V595 F597	T540-D542 WeakPolarHBondContact CB-OD1 3.28Å; T540-D542 PolarHBondContact O-N 3.42Å; T540-D542 VanDerWaalsContact O-N 3.14Å; T540-D542 PolarHBondContact OG1-OD1 3.31Å; T540-H543 PolarHBondContact O-N 3.37Å; T540-A544 HydrophobicContact CG2-CB 4.49Å; T540-A544 PolarHBondContact N-O 2.89Å; T540-A544 VanDerWaalsContact N-O 3.08Å; T540-A544 WeakPolarHBondContact OG1-CA 3.47Å; T540-A544 VanDerWaalsContact OG1-CB 3.25Å; T540-A544 WeakPolarHBondContact OG1-CB 3.28Å; T540-A544 PolarHBondContact OG1-N 2.87Å; T540-A544 PolarHBondContact OG1-O 3.42Å; T540-L546 HydrophobicContact CG2-CD1 3.96Å; T540-V592 HydrophobicContact CG2-CG1 3.79Å; T540-V595 WeakPolarHBondContact CB-O 3.28Å; T540-F597 HydrophobicContact CG2-CB 4.48Å
541	A	90.2	Very high	91.1	Very high	39 Å²	39	41.7 Å²	41.7	32%	0.322	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.9	178.2	0	0	0	0	0	114.2	A593 V595	A541-A593 WeakPolarHBondContact CB-O 3.33Å; A541-V595 WeakPolarHBondContact CB-O 3.41Å; A541-V595 PolarHBondContact N-O 2.82Å
542	D	89	Confident	91.2	Very high	70 Å²	70	36.1 Å²	36.1	37%	0.374	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	23.2	173.8	56.2	-25	0	0	0	113.4	T540 A544 F597	T540-D542 WeakPolarHBondContact CB-OD1 3.28Å; T540-D542 PolarHBondContact O-N 3.42Å; T540-D542 VanDerWaalsContact O-N 3.14Å; T540-D542 PolarHBondContact OG1-OD1 3.31Å; D542-A544 PolarHBondContact O-N 2.97Å; D542-F597 PolarHBondContact OD1-N 2.95Å; D542-F597 WeakPolarHBondContact OD2-CB 3.46Å; D542-F597 PolarHBondContact OD2-N 3.27Å
543	H	83.8	Confident	91.4	Very high	143 Å²	143	37.5 Å²	37.5	66%	0.662	19%	0.194	S	C	*	.			trans	62.6	18.3	175.1	-58.4	-68.5	0	0	0	115.8	E539 T540 R545	E539-H543 IonicContact OE1-CE1 2.67Å; E539-H543 IonicContact OE1-CG 3.85Å; E539-H543 IonicContact OE1-ND1 3.87Å; E539-H543 PolarHBondContact OE1-ND1 3.2Å; T540-H543 PolarHBondContact O-N 3.37Å; H543-R545 PolarHBondContact O-N 2.77Å
544	A	85	Confident	91.5	Very high	27 Å²	27	37.4 Å²	37.4	22%	0.223	19%	0.192	C	C	.	.			trans	-76.1	116.9	172.4	0	0	0	0	0	109.9	E539 T540 D542 F597	E539-A544 WeakPolarHBondContact CA-O 3.35Å; T540-A544 HydrophobicContact CG2-CB 4.49Å; T540-A544 PolarHBondContact N-O 2.89Å; T540-A544 VanDerWaalsContact N-O 3.08Å; T540-A544 WeakPolarHBondContact OG1-CA 3.47Å; T540-A544 VanDerWaalsContact OG1-CB 3.25Å; T540-A544 WeakPolarHBondContact OG1-CB 3.28Å; T540-A544 PolarHBondContact OG1-N 2.87Å; T540-A544 PolarHBondContact OG1-O 3.42Å; D542-A544 PolarHBondContact O-N 2.97Å; A544-F597 HydrophobicContact CB-CB 3.98Å; A544-F597 HydrophobicContact CB-CD2 3.94Å; A544-F597 HydrophobicContact CB-CG 4.12Å
545	R	90.1	Very high	91.6	Very high	132 Å²	132	38.7 Å²	38.7	50%	0.498	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	119.7	179	-67.7	-178.8	63.4	-148.9	-2.5	110.6	V538 E539 H543 V645	V538-R545 WeakPolarHBondContact O-CA 3.49Å; E539-R545 HydrophobicContact CB-CG 4.48Å; E539-R545 HydrophobicContact CG-CG 4.1Å; H543-R545 PolarHBondContact O-N 2.77Å; R545-V645 HydrophobicContact CB-CB 4.17Å; R545-V645 HydrophobicContact CB-CG2 4.21Å; R545-V645 WeakPolarHBondContact O-CG2 3.47Å; R545-V645 PolarHBondContact O-N 2.96Å
546	L	90	Very high	91.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.6	-176.7	-48.7	177.4	0	0	0	110.7	I537 V538 T540 L548 F597 F600 V642 E643 P644	I537-L546 CarbonylContact C-O 3.6Å; I537-L546 WeakPolarHBondContact CA-O 3.48Å; V538-L546 HydrophobicContact CG2-CB 3.82Å; V538-L546 PolarHBondContact N-O 3.48Å; V538-L546 PolarHBondContact O-N 2.88Å; T540-L546 HydrophobicContact CG2-CD1 3.96Å; L546-L548 HydrophobicContact CB-CD2 4.24Å; L546-F597 HydrophobicContact CD1-CD2 4.11Å; L546-F597 HydrophobicContact CD1-CE2 4.29Å; L546-F597 HydrophobicContact CD2-CD2 3.95Å; L546-F597 HydrophobicContact CD2-CE2 3.71Å; L546-F600 HydrophobicContact CD1-CD1 3.41Å; L546-F600 VanDerWaalsContact CD1-CD1 3.41Å; L546-F600 HydrophobicContact CD1-CE1 3.43Å; L546-F600 VanDerWaalsContact CD1-CE1 3.43Å; L546-V642 HydrophobicContact CD1-CG1 4.27Å; L546-E643 CarbonylContact C-O 3.46Å; L546-E643 WeakPolarHBondContact CA-O 3.5Å; L546-P644 HydrophobicContact CD2-CB 4.31Å; L546-P644 HydrophobicContact CD2-CG 4.42Å
547	S	92.6	Very high	91.4	Very high	29 Å²	29	41.8 Å²	41.8	20%	0.203	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	113.5	169.1	-175.6	0	0	0	0	108.3	V535 E643	V535-S547 WeakPolarHBondContact CG1-OG 3.36Å; S547-E643 PolarHBondContact N-O 2.89Å; S547-E643 PolarHBondContact O-N 3.14Å
548	L	92.3	Very high	91	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	116.7	177.4	-50.1	-176.4	0	0	0	109.3	V535 V536 V538 L546 L550 V588 F600 I608 V642	V535-L548 CarbonylContact C-O 3.56Å; V535-L548 WeakPolarHBondContact CA-O 3.42Å; V536-L548 PolarHBondContact N-O 3.42Å; V536-L548 PolarHBondContact O-N 3.28Å; V538-L548 HydrophobicContact CB-CD1 4.39Å; V538-L548 HydrophobicContact CG1-CD1 3.61Å; V538-L548 HydrophobicContact CG1-CG 4.12Å; V538-L548 HydrophobicContact CG2-CD1 3.81Å; V538-L548 HydrophobicContact CG2-CD2 4.15Å; V538-L548 HydrophobicContact CG2-CG 3.82Å; L546-L548 HydrophobicContact CB-CD2 4.24Å; L548-L550 HydrophobicContact CB-CD1 4.39Å; L548-L550 HydrophobicContact CB-CD2 4.13Å; L548-L550 HydrophobicContact CB-CG 4.04Å; L548-V588 HydrophobicContact CD1-CG1 3.7Å; L548-F600 HydrophobicContact CD1-CZ 4.12Å; L548-F600 HydrophobicContact CD2-CE1 3.91Å; L548-F600 HydrophobicContact CD2-CZ 3.85Å; L548-I608 HydrophobicContact CD1-CD1 4.15Å; L548-V642 HydrophobicContact CD2-CB 4.23Å; L548-V642 HydrophobicContact CD2-CG1 3.76Å; L548-V642 HydrophobicContact CD2-CG2 3.95Å
549	Q	94.7	Very high	90.5	Very high	55 Å²	55	41.3 Å²	41.3	26%	0.257	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	110.1	167.2	-170.9	168.1	-51.4	0	0	108.9	V535 Q640 S641	V535-Q549 HydrophobicContact CG2-CB 4.29Å; V535-Q549 HydrophobicContact CG2-CG 4.12Å; Q549-Q640 HydrophobicContact CB-CB 4.27Å; Q549-Q640 HydrophobicContact CG-CB 4.12Å; Q549-Q640 PolarHBondContact O-N 3.23Å; Q549-S641 WeakPolarHBondContact CB-OG 3.45Å; Q549-S641 PolarHBondContact N-O 3.09Å; Q549-S641 PolarHBondContact O-N 2.74Å
550	L	93.4	Very high	89.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	141.1	-175.2	-57.4	-179.3	0	0	0	110.1	T533 D534 V536 L548 Y552 V588 I608 V639	T533-L550 CarbonylContact C-O 3.6Å; T533-L550 WeakPolarHBondContact CA-O 3.41Å; D534-L550 PolarHBondContact N-O 3.11Å; D534-L550 PolarHBondContact O-N 2.96Å; V536-L550 HydrophobicContact CG2-CD1 4.35Å; L548-L550 HydrophobicContact CB-CD1 4.39Å; L548-L550 HydrophobicContact CB-CD2 4.13Å; L548-L550 HydrophobicContact CB-CG 4.04Å; L550-Y552 HydrophobicContact CB-CD1 4.48Å; L550-Y552 HydrophobicContact CB-CE1 3.58Å; L550-Y552 HydrophobicContact CD1-CE1 4.09Å; L550-Y552 WeakPolarHBondContact CD1-OH 3.41Å; L550-Y552 HydrophobicContact CG-CE1 4.47Å; L550-V588 HydrophobicContact CD1-CG2 4.35Å; L550-I608 HydrophobicContact CD1-CG2 4.37Å; L550-I608 HydrophobicContact CD2-CD1 4.16Å; L550-I608 HydrophobicContact CD2-CG2 4.18Å; L550-V639 HydrophobicContact CD2-CB 4.31Å; L550-V639 HydrophobicContact CD2-CG1 4.13Å; L550-V639 HydrophobicContact CD2-CG2 3.98Å
551	S	94.3	Very high	89.1	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.5	169.3	-161.5	0	0	0	0	109.2	T533 V637 D638	T533-S551 WeakPolarHBondContact CG2-OG 3.49Å; S551-V637 CarbonylContact O-C 3.55Å; S551-V637 WeakPolarHBondContact O-CA 3.35Å; S551-D638 PolarHBondContact N-O 3.21Å; S551-D638 PolarHBondContact O-N 3.33Å
552	Y	93.6	Very high	88.6	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	117.2	177.8	-43.7	-54	0	0	0	108.2	F531 C532 D534 L550 C581 I584 V637	F531-Y552 CarbonylContact C-O 3.58Å; F531-Y552 VanDerWaalsContact CA-O 3.25Å; F531-Y552 WeakPolarHBondContact CA-O 3.39Å; C532-Y552 PolarHBondContact N-O 2.85Å; C532-Y552 PolarHBondContact O-N 3.26Å; D534-Y552 HydrophobicContact CB-CE2 4.01Å; L550-Y552 HydrophobicContact CB-CD1 4.48Å; L550-Y552 HydrophobicContact CB-CE1 3.58Å; L550-Y552 HydrophobicContact CD1-CE1 4.09Å; L550-Y552 WeakPolarHBondContact CD1-OH 3.41Å; L550-Y552 HydrophobicContact CG-CE1 4.47Å; Y552-C581 HydrophobicContact CE2-CB 4.33Å; Y552-I584 HydrophobicContact CD1-CD1 4.01Å; Y552-I584 HydrophobicContact CD1-CG2 4.26Å; Y552-I584 HydrophobicContact CD2-CD1 3.99Å; Y552-I584 HydrophobicContact CE1-CB 4.43Å; Y552-I584 HydrophobicContact CE1-CD1 4.21Å; Y552-I584 HydrophobicContact CE1-CG2 3.49Å; Y552-I584 VanDerWaalsContact CE1-CG2 3.49Å; Y552-I584 HydrophobicContact CE2-CD1 4.19Å; Y552-I584 HydrophobicContact CE2-CG2 4.39Å; Y552-I584 HydrophobicContact CG-CD1 3.89Å; Y552-V637 HydrophobicContact CD1-CB 4.48Å; Y552-V637 HydrophobicContact CD1-CG1 3.96Å; Y552-V637 HydrophobicContact CD1-CG2 4.06Å; Y552-V637 HydrophobicContact CE1-CG1 4.01Å
553	N	94.6	Very high	88.4	Confident	44 Å²	44	46.4 Å²	46.4	24%	0.235	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	130.9	173.3	-62.9	-21.9	0	0	0	107.9	D530 F531 I634 T635 S636 D638	D530-N553 WeakPolarHBondContact O-CA 3.42Å; F531-N553 WeakPolarHBondContact CB-OD1 3.45Å; N553-I634 CarbonylContact O-C 3.37Å; N553-I634 WeakPolarHBondContact O-CA 3.12Å; N553-T635 PolarHBondContact O-N 3.2Å; N553-T635 PolarHBondContact O-OG1 2.87Å; N553-S636 PolarHBondContact N-O 3.24Å; N553-S636 PolarHBondContact ND2-OG 3.11Å; N553-D638 PolarHBondContact ND2-OD2 3.31Å; N553-D638 VanDerWaalsContact ND2-OD2 3.13Å
554	W	94.6	Very high	88.2	Confident	12 Å²	12	43.9 Å²	43.9	5%	0.045	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	155	-169.4	63.5	-96.1	0	0	0	113.1	L526 P529 D530 F556 F576 L632 H633 I634	L526-W554 WeakPolarHBondContact O-CH2 3.06Å; L526-W554 VanDerWaalsContact O-CZ3 3.32Å; L526-W554 WeakPolarHBondContact O-CZ3 3.32Å; P529-W554 WeakPolarHBondContact CA-O 3.4Å; D530-W554 HydrophobicContact CB-CD2 4.37Å; D530-W554 HydrophobicContact CB-CH2 3.89Å; D530-W554 HydrophobicContact CB-CZ2 3.59Å; D530-W554 HydrophobicContact CB-CZ3 4.39Å; D530-W554 PolarHBondContact N-O 2.74Å; D530-W554 PolarHBondContact O-N 2.78Å; D530-W554 WeakPolarHBondContact OD2-CZ2 3.35Å; W554-F556 HydrophobicContact CE3-CD2 4.12Å; W554-F556 HydrophobicContact CE3-CE2 4.08Å; W554-F556 HydrophobicContact CH2-CE2 4.44Å; W554-F556 AromaticContact CZ3-CD2 3.71Å; W554-F556 HydrophobicContact CZ3-CD2 3.71Å; W554-F556 AromaticContact CZ3-CE2 3.62Å; W554-F556 HydrophobicContact CZ3-CE2 3.62Å; W554-F576 HydrophobicContact CD2-CE2 4.11Å; W554-F576 HydrophobicContact CE3-CE2 4.08Å; W554-F576 HydrophobicContact CE3-CZ 4.48Å; W554-F576 HydrophobicContact CH2-CE2 4.04Å; W554-F576 AromaticContact CH2-CZ 3.66Å; W554-F576 HydrophobicContact CH2-CZ 3.66Å; W554-F576 HydrophobicContact CZ2-CE2 4.02Å; W554-F576 AromaticContact CZ2-CZ 3.81Å; W554-F576 HydrophobicContact CZ2-CZ 3.81Å; W554-F576 HydrophobicContact CZ3-CE2 4.07Å; W554-F576 HydrophobicContact CZ3-CZ 4.01Å; W554-L632 HydrophobicContact CB-CD1 4.03Å; W554-L632 HydrophobicContact CD2-CD1 4.13Å; W554-L632 HydrophobicContact CE3-CD1 3.73Å; W554-L632 HydrophobicContact CG-CD1 4.29Å; W554-H633 CarbonylContact C-O 3.56Å; W554-H633 VanDerWaalsContact CA-O 3.24Å; W554-H633 WeakPolarHBondContact CA-O 3.44Å; W554-I634 HydrophobicContact CB-CD1 3.74Å
555	V	95.1	Very high	88.1	Confident	40 Å²	40	45.9 Å²	45.9	24%	0.242	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	149.9	176.4	65.1	0	0	0	0	109.3	L527 H633 T635	L527-V555 CarbonylContact O-C 3.5Å; L527-V555 WeakPolarHBondContact O-CA 3.46Å; V555-H633 HydrophobicContact CG1-CB 4.1Å; V555-H633 PolarHBondContact N-O 3.38Å; V555-H633 PolarHBondContact O-N 2.99Å; V555-T635 HydrophobicContact CG1-CG2 3.98Å
556	F	93.5	Very high	87.9	Confident	8 Å²	8	42 Å²	42	4%	0.035	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	120.5	169.2	-75	-86.4	0	0	0	109.7	L525 L527 W554 V558 L570 F576 N630 L632	L525-F556 HydrophobicContact CD1-CE2 4.05Å; L525-F556 HydrophobicContact CD1-CZ 4.07Å; L525-F556 HydrophobicContact CD2-CE1 4.32Å; L525-F556 HydrophobicContact CD2-CE2 4.12Å; L525-F556 HydrophobicContact CD2-CZ 3.98Å; L525-F556 HydrophobicContact CG-CE2 4.17Å; L525-F556 HydrophobicContact CG-CZ 4.37Å; L527-F556 HydrophobicContact CB-CB 4.34Å; L527-F556 HydrophobicContact CD2-CB 4.09Å; L527-F556 HydrophobicContact CD2-CD2 4.39Å; L527-F556 HydrophobicContact CD2-CG 4.35Å; L527-F556 PolarHBondContact O-N 2.86Å; W554-F556 HydrophobicContact CE3-CD2 4.12Å; W554-F556 HydrophobicContact CE3-CE2 4.08Å; W554-F556 HydrophobicContact CH2-CE2 4.44Å; W554-F556 AromaticContact CZ3-CD2 3.71Å; W554-F556 HydrophobicContact CZ3-CD2 3.71Å; W554-F556 AromaticContact CZ3-CE2 3.62Å; W554-F556 HydrophobicContact CZ3-CE2 3.62Å; F556-V558 PolarHBondContact O-N 2.76Å; F556-V558 VanDerWaalsContact O-N 3.11Å; F556-L570 HydrophobicContact CB-CD2 3.85Å; F556-L570 HydrophobicContact CD1-CD2 3.44Å; F556-L570 VanDerWaalsContact CD1-CD2 3.44Å; F556-L570 HydrophobicContact CE1-CD2 4.13Å; F556-L570 HydrophobicContact CG-CD2 3.8Å; F556-F576 HydrophobicContact CE2-CD1 4.47Å; F556-F576 HydrophobicContact CE2-CD2 4.22Å; F556-F576 HydrophobicContact CE2-CE1 4.19Å; F556-F576 AromaticContact CE2-CE2 3.9Å; F556-F576 HydrophobicContact CE2-CE2 3.9Å; F556-F576 HydrophobicContact CE2-CG 4.48Å; F556-F576 AromaticContact CE2-CZ 3.89Å; F556-F576 HydrophobicContact CE2-CZ 3.89Å; F556-F576 HydrophobicContact CZ-CB 4.4Å; F556-F576 AromaticContact CZ-CD1 3.97Å; F556-F576 HydrophobicContact CZ-CD1 3.97Å; F556-F576 AromaticContact CZ-CD2 3.82Å; F556-F576 HydrophobicContact CZ-CD2 3.82Å; F556-F576 HydrophobicContact CZ-CE1 4.16Å; F556-F576 AromaticContact CZ-CE2 3.99Å; F556-F576 HydrophobicContact CZ-CE2 3.99Å; F556-F576 AromaticContact CZ-CG 3.79Å; F556-F576 HydrophobicContact CZ-CG 3.79Å; F556-F576 HydrophobicContact CZ-CZ 4.15Å; F556-N630 VanDerWaalsContact CD1-O 3.28Å; F556-N630 WeakPolarHBondContact CD1-O 3.44Å; F556-N630 HydrophobicContact CE1-CB 4.22Å; F556-L632 HydrophobicContact CD1-CB 4.22Å; F556-L632 HydrophobicContact CD1-CD1 4.42Å; F556-L632 HydrophobicContact CD2-CD1 4.21Å; F556-L632 HydrophobicContact CE1-CB 3.91Å; F556-L632 HydrophobicContact CE1-CD1 4.11Å; F556-L632 HydrophobicContact CE2-CD1 3.88Å; F556-L632 HydrophobicContact CG-CD1 4.5Å; F556-L632 HydrophobicContact CZ-CB 4.4Å; F556-L632 HydrophobicContact CZ-CD1 3.83Å
557	D	88.5	Confident	87.7	Confident	92 Å²	92	42.3 Å²	42.3	49%	0.492	28%	0.276	S	S	.	.			trans	-87	78.5	-179.5	-160.8	-6.7	0	0	0	110	N631 H633	D557-N631 PolarHBondContact N-O 2.88Å; D557-H633 WeakPolarHBondContact CB-CE1 3.33Å; D557-H633 WeakPolarHBondContact CB-ND1 3.34Å; D557-H633 IonicContact OD2-CE1 3.97Å; D557-H633 PolarHBondContact OD2-CE1 3.23Å; D557-H633 IonicContact OD2-ND1 3.56Å; D557-H633 PolarHBondContact OD2-ND1 2.86Å
558	V	83.7	Confident	87.5	Confident	22 Å²	22	42.9 Å²	42.9	13%	0.133	28%	0.283	C	S	.	.			trans	-141	127.6	-178.4	179.4	0	0	0	0	110	F491 F556 C562 L570 N631	F491-V558 HydrophobicContact CE1-CG1 4.5Å; F491-V558 HydrophobicContact CZ-CG1 4.19Å; F556-V558 PolarHBondContact O-N 2.76Å; F556-V558 VanDerWaalsContact O-N 3.11Å; V558-C562 HydrophobicContact CG1-CB 3.97Å; V558-C562 WeakPolarHBondContact CG1-SG 3.31Å; V558-L570 HydrophobicContact CB-CD2 4.33Å; V558-L570 HydrophobicContact CG1-CD1 4.3Å; V558-L570 HydrophobicContact CG2-CD2 3.7Å; V558-L570 HydrophobicContact CG2-CG 4.16Å; V558-N631 HydrophobicContact CG2-CB 3.96Å
559	S	81.3	Confident	87.4	Confident	61 Å²	61	46.5 Å²	46.5	43%	0.427	30%	0.299	S	S	.	.			trans	-77.2	145.7	172.9	60.9	0	0	0	0	111.5	S561 C562	S559-S561 PolarHBondContact O-N 2.69Å; S559-S561 VanDerWaalsContact O-N 3.14Å; S559-C562 WeakPolarHBondContact O-CB 2.95Å; S559-C562 PolarHBondContact O-N 3.03Å; S559-C562 PolarHBondContact O-SG 2.91Å; S559-C562 PolarHBondContact OG-N 3.21Å
560	P	72.3	Confident	87.2	Confident	106 Å²	106	44 Å²	44	69%	0.688	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.6	173.8	-25.5	35.1	0	0	0	113.8
561	S	77.7	Confident	87.1	Confident	111 Å²	111	44.8 Å²	44.8	78%	0.776	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	19.1	176	54.9	0	0	0	0	113.9	S559	S559-S561 PolarHBondContact O-N 2.69Å; S559-S561 VanDerWaalsContact O-N 3.14Å
562	C	80	Confident	86.9	Confident	32 Å²	32	47.7 Å²	47.7	22%	0.216	31%	0.311	C	S	.	.			trans	-67.8	167.8	179.8	67	0	0	0	0	113.2	V558 S559 D566	V558-C562 HydrophobicContact CG1-CB 3.97Å; V558-C562 WeakPolarHBondContact CG1-SG 3.31Å; S559-C562 WeakPolarHBondContact O-CB 2.95Å; S559-C562 PolarHBondContact O-N 3.03Å; S559-C562 PolarHBondContact O-SG 2.91Å; S559-C562 PolarHBondContact OG-N 3.21Å; C562-D566 HydrophobicContact CB-CB 4.07Å
563	S	84.6	Confident	86.8	Confident	56 Å²	56	48.5 Å²	48.5	39%	0.392	32%	0.316	S	S	.	.			trans	-67.6	151.3	174.1	83	0	0	0	0	110.8	A565 D566 A567	S563-A565 PolarHBondContact O-N 3.5Å; S563-A565 VanDerWaalsContact O-N 3.08Å; S563-A565 PolarHBondContact OG-N 3.41Å; S563-D566 WeakPolarHBondContact CB-OD2 3.31Å; S563-D566 PolarHBondContact O-N 3Å; S563-D566 VanDerWaalsContact OG-CG 3.31Å; S563-D566 PolarHBondContact OG-N 3.1Å; S563-D566 VanDerWaalsContact OG-N 3.14Å; S563-D566 PolarHBondContact OG-OD2 2.93Å; S563-A567 PolarHBondContact O-N 3.39Å
564	A	80.9	Confident	86.4	Confident	89 Å²	89	50.7 Å²	50.7	74%	0.736	33%	0.333	S	S	*	.	H	α-helix	trans	-56.9	-27	174.8	0	0	0	0	0	112.9	A568	A564-A568 WeakPolarHBondContact O-CB 3.49Å; A564-A568 PolarHBondContact O-N 3.02Å; A564-A568 VanDerWaalsContact O-N 3.1Å
565	A	82.6	Confident	86.3	Confident	69 Å²	69	51.6 Å²	51.6	57%	0.57	34%	0.338	S	S	*	.	H	α-helix	trans	-72.8	-33.8	174.8	0	0	0	0	0	112.8	S563	S563-A565 PolarHBondContact O-N 3.5Å; S563-A565 VanDerWaalsContact O-N 3.08Å; S563-A565 PolarHBondContact OG-N 3.41Å
566	D	85.1	Confident	86.2	Confident	52 Å²	52	50.1 Å²	50.1	28%	0.278	33%	0.329	S	S	.	.	H	α-helix	trans	-76.7	-40.3	174.5	-63.2	-56.7	0	0	0	111.5	C562 S563 A568 K569	C562-D566 HydrophobicContact CB-CB 4.07Å; S563-D566 WeakPolarHBondContact CB-OD2 3.31Å; S563-D566 PolarHBondContact O-N 3Å; S563-D566 VanDerWaalsContact OG-CG 3.31Å; S563-D566 PolarHBondContact OG-N 3.1Å; S563-D566 VanDerWaalsContact OG-N 3.14Å; S563-D566 PolarHBondContact OG-OD2 2.93Å; D566-A568 VanDerWaalsContact C-N 3.25Å; D566-A568 PolarHBondContact O-N 3.42Å; D566-K569 VanDerWaalsContact O-CB 3.31Å; D566-K569 WeakPolarHBondContact O-CB 3.27Å; D566-K569 PolarHBondContact O-N 3.22Å; D566-K569 IonicContact OD1-NZ 3.42Å; D566-K569 PolarHBondContact OD1-NZ 2.85Å
567	A	86.5	Confident	86.2	Confident	6 Å²	6	50.3 Å²	50.3	5%	0.05	33%	0.33	C	S	.	.	H	α-helix	trans	-58.5	-38.5	172.8	0	0	0	0	0	111.8	V489 F491 S563 K569 L570	V489-A567 HydrophobicContact CB-CB 3.94Å; V489-A567 HydrophobicContact CG1-CB 4.19Å; V489-A567 HydrophobicContact CG2-CB 4.3Å; F491-A567 HydrophobicContact CE2-CB 3.85Å; F491-A567 HydrophobicContact CZ-CB 3.89Å; S563-A567 PolarHBondContact O-N 3.39Å; A567-K569 VanDerWaalsContact C-N 3.27Å; A567-K569 PolarHBondContact O-N 3.14Å; A567-L570 WeakPolarHBondContact O-CB 3.44Å; A567-L570 PolarHBondContact O-N 2.87Å
568	A	87.5	Confident	86.3	Confident	42 Å²	42	46.5 Å²	46.5	35%	0.347	31%	0.313	S	S	.	.	H	α-helix	trans	-64.4	-26.4	175.8	0	0	0	0	0	113.8	A564 D566 L570 F571	A564-A568 WeakPolarHBondContact O-CB 3.49Å; A564-A568 PolarHBondContact O-N 3.02Å; A564-A568 VanDerWaalsContact O-N 3.1Å; D566-A568 VanDerWaalsContact C-N 3.25Å; D566-A568 PolarHBondContact O-N 3.42Å; A568-L570 VanDerWaalsContact C-N 3.29Å; A568-L570 PolarHBondContact O-N 3.38Å; A568-F571 PolarHBondContact O-N 2.88Å
569	K	89.9	Confident	86.7	Confident	75 Å²	75	48.7 Å²	48.7	33%	0.326	32%	0.324	S	S	.	.	H	α-helix	trans	-63.4	-34.4	177.2	-68.1	171.5	-173.9	163.9	0	112.2	D566 A567 F571 S572 Q629 N630	D566-K569 VanDerWaalsContact O-CB 3.31Å; D566-K569 WeakPolarHBondContact O-CB 3.27Å; D566-K569 PolarHBondContact O-N 3.22Å; D566-K569 IonicContact OD1-NZ 3.42Å; D566-K569 PolarHBondContact OD1-NZ 2.85Å; A567-K569 VanDerWaalsContact C-N 3.27Å; A567-K569 PolarHBondContact O-N 3.14Å; K569-F571 PolarHBondContact O-N 3.48Å; K569-F571 VanDerWaalsContact O-N 3.09Å; K569-S572 VanDerWaalsContact O-CB 3.31Å; K569-S572 WeakPolarHBondContact O-CB 3.31Å; K569-S572 PolarHBondContact O-N 3.19Å; K569-S572 PolarHBondContact O-OG 2.92Å; K569-Q629 WeakPolarHBondContact CB-O 3.42Å; K569-N630 VanDerWaalsContact O-CA 3.27Å; K569-N630 WeakPolarHBondContact O-CA 3.3Å; K569-N630 VanDerWaalsContact O-CB 3.29Å; K569-N630 WeakPolarHBondContact O-CB 3.25Å
570	L	90.7	Very high	87.3	Confident	2 Å²	2	46 Å²	46	1%	0.01	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-35	178.8	-70.4	172	0	0	0	112.8	A476 F491 L525 L527 F556 V558 A567 A568	A476-L570 HydrophobicContact CB-CD1 4.17Å; F491-L570 HydrophobicContact CE1-CD1 3.67Å; F491-L570 HydrophobicContact CZ-CD1 3.83Å; L525-L570 HydrophobicContact CD2-CB 3.76Å; L525-L570 HydrophobicContact CD2-CD2 4.2Å; L525-L570 HydrophobicContact CD2-CG 4.47Å; L527-L570 HydrophobicContact CD2-CD1 3.99Å; L527-L570 HydrophobicContact CD2-CD2 3.94Å; F556-L570 HydrophobicContact CB-CD2 3.85Å; F556-L570 HydrophobicContact CD1-CD2 3.44Å; F556-L570 VanDerWaalsContact CD1-CD2 3.44Å; F556-L570 HydrophobicContact CE1-CD2 4.13Å; F556-L570 HydrophobicContact CG-CD2 3.8Å; V558-L570 HydrophobicContact CB-CD2 4.33Å; V558-L570 HydrophobicContact CG1-CD1 4.3Å; V558-L570 HydrophobicContact CG2-CD2 3.7Å; V558-L570 HydrophobicContact CG2-CG 4.16Å; A567-L570 WeakPolarHBondContact O-CB 3.44Å; A567-L570 PolarHBondContact O-N 2.87Å; A568-L570 VanDerWaalsContact C-N 3.29Å; A568-L570 PolarHBondContact O-N 3.38Å
571	F	91.9	Very high	88.2	Confident	17 Å²	17	41 Å²	41	8%	0.075	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	5.7	-177.5	-64.5	-95.4	0	0	0	113.6	A476 Q478 V489 L507 L525 A568 K569 V573	A476-F571 HydrophobicContact CB-CE2 3.96Å; A476-F571 HydrophobicContact CB-CZ 4.07Å; Q478-F571 HydrophobicContact CB-CB 4.44Å; Q478-F571 HydrophobicContact CB-CD1 3.53Å; Q478-F571 HydrophobicContact CB-CD2 3.85Å; Q478-F571 HydrophobicContact CB-CE1 3.64Å; Q478-F571 HydrophobicContact CB-CE2 3.96Å; Q478-F571 HydrophobicContact CB-CG 3.67Å; Q478-F571 HydrophobicContact CB-CZ 3.86Å; Q478-F571 HydrophobicContact CG-CD1 4.49Å; Q478-F571 HydrophobicContact CG-CG 4.3Å; Q478-F571 VanDerWaalsContact OE1-CB 3.28Å; V489-F571 HydrophobicContact CG1-CD2 4.48Å; V489-F571 HydrophobicContact CG1-CE2 3.81Å; V489-F571 HydrophobicContact CG2-CD2 3.98Å; V489-F571 HydrophobicContact CG2-CE2 4.06Å; L507-F571 HydrophobicContact CD1-CE1 4.17Å; L507-F571 HydrophobicContact CD2-CD1 3.87Å; L507-F571 HydrophobicContact CD2-CE1 4.1Å; L507-F571 HydrophobicContact CG-CE1 4.35Å; L525-F571 HydrophobicContact CB-CE1 4.07Å; L525-F571 HydrophobicContact CB-CZ 3.84Å; A568-F571 PolarHBondContact O-N 2.88Å; K569-F571 PolarHBondContact O-N 3.48Å; K569-F571 VanDerWaalsContact O-N 3.09Å; F571-V573 VanDerWaalsContact C-N 3.26Å; F571-V573 PolarHBondContact O-N 3.36Å
572	S	90.2	Very high	88.9	Confident	64 Å²	64	42.9 Å²	42.9	45%	0.448	27%	0.267	S	S	.	.	S	Bend	trans	-69.1	-24	-179.7	74.6	0	0	0	0	113.3	K569 Q629	K569-S572 VanDerWaalsContact O-CB 3.31Å; K569-S572 WeakPolarHBondContact O-CB 3.31Å; K569-S572 PolarHBondContact O-N 3.19Å; K569-S572 PolarHBondContact O-OG 2.92Å; S572-Q629 PolarHBondContact OG-O 2.89Å
573	V	90.9	Very high	89.5	Confident	19 Å²	19	42.9 Å²	42.9	12%	0.115	27%	0.269	C	S	.	.	S	Bend	trans	-115	97.6	178.1	-175.4	0	0	0	0	108.6	F571 D575 F576 D579 Q629 N630	F571-V573 VanDerWaalsContact C-N 3.26Å; F571-V573 PolarHBondContact O-N 3.36Å; V573-D575 VanDerWaalsContact C-N 3.29Å; V573-D575 PolarHBondContact O-N 2.9Å; V573-F576 HydrophobicContact CG1-CB 4.33Å; V573-F576 PolarHBondContact O-N 3.3Å; V573-D579 HydrophobicContact CG1-CB 4.1Å; V573-Q629 HydrophobicContact CG2-CB 3.97Å; V573-N630 HydrophobicContact CB-CB 4.5Å; V573-N630 HydrophobicContact CG2-CB 4.15Å
574	P	87.2	Confident	89.9	Confident	90 Å²	90	40.2 Å²	40.2	58%	0.584	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.7	-171.2	-27.5	36	0	0	0	115.6	L509	L509-P574 WeakPolarHBondContact CD2-O 3.3Å
575	D	92.3	Very high	90.3	Very high	31 Å²	31	36.4 Å²	36.4	17%	0.166	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.6	71.2	172.8	-174.3	6.9	0	0	0	110.3	S508 L509 S510 V573 V577 G578 D579	S508-D575 WeakPolarHBondContact O-CB 3.38Å; L509-D575 WeakPolarHBondContact CA-OD1 3.48Å; S510-D575 WeakPolarHBondContact CB-OD2 3.32Å; S510-D575 VanDerWaalsContact N-CG 3.3Å; S510-D575 PolarHBondContact N-OD1 3.43Å; S510-D575 PolarHBondContact N-OD2 2.61Å; S510-D575 PolarHBondContact OG-OD2 2.99Å; V573-D575 VanDerWaalsContact C-N 3.29Å; V573-D575 PolarHBondContact O-N 2.9Å; D575-V577 PolarHBondContact O-N 3.35Å; D575-V577 PolarHBondContact OD1-N 3.4Å; D575-G578 PolarHBondContact O-N 2.9Å; D575-G578 PolarHBondContact OD1-N 3.35Å; D575-D579 PolarHBondContact O-N 2.95Å
576	F	93.8	Very high	90.8	Very high	8 Å²	8	36.4 Å²	36.4	4%	0.035	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-31.3	178.6	80.6	-89.1	0	0	0	112.7	L509 L525 W554 F556 V573 A580 N630 L632	L509-F576 HydrophobicContact CD1-CE1 3.88Å; L509-F576 HydrophobicContact CD2-CD1 3.74Å; L509-F576 HydrophobicContact CD2-CE1 3.87Å; L525-F576 HydrophobicContact CD1-CD1 3.76Å; L525-F576 HydrophobicContact CD1-CE1 3.42Å; L525-F576 VanDerWaalsContact CD1-CE1 3.42Å; L525-F576 HydrophobicContact CD1-CZ 4.31Å; W554-F576 HydrophobicContact CD2-CE2 4.11Å; W554-F576 HydrophobicContact CE3-CE2 4.08Å; W554-F576 HydrophobicContact CE3-CZ 4.48Å; W554-F576 HydrophobicContact CH2-CE2 4.04Å; W554-F576 AromaticContact CH2-CZ 3.66Å; W554-F576 HydrophobicContact CH2-CZ 3.66Å; W554-F576 HydrophobicContact CZ2-CE2 4.02Å; W554-F576 AromaticContact CZ2-CZ 3.81Å; W554-F576 HydrophobicContact CZ2-CZ 3.81Å; W554-F576 HydrophobicContact CZ3-CE2 4.07Å; W554-F576 HydrophobicContact CZ3-CZ 4.01Å; F556-F576 HydrophobicContact CE2-CD1 4.47Å; F556-F576 HydrophobicContact CE2-CD2 4.22Å; F556-F576 HydrophobicContact CE2-CE1 4.19Å; F556-F576 AromaticContact CE2-CE2 3.9Å; F556-F576 HydrophobicContact CE2-CE2 3.9Å; F556-F576 HydrophobicContact CE2-CG 4.48Å; F556-F576 AromaticContact CE2-CZ 3.89Å; F556-F576 HydrophobicContact CE2-CZ 3.89Å; F556-F576 HydrophobicContact CZ-CB 4.4Å; F556-F576 AromaticContact CZ-CD1 3.97Å; F556-F576 HydrophobicContact CZ-CD1 3.97Å; F556-F576 AromaticContact CZ-CD2 3.82Å; F556-F576 HydrophobicContact CZ-CD2 3.82Å; F556-F576 HydrophobicContact CZ-CE1 4.16Å; F556-F576 AromaticContact CZ-CE2 3.99Å; F556-F576 HydrophobicContact CZ-CE2 3.99Å; F556-F576 AromaticContact CZ-CG 3.79Å; F556-F576 HydrophobicContact CZ-CG 3.79Å; F556-F576 HydrophobicContact CZ-CZ 4.15Å; V573-F576 HydrophobicContact CG1-CB 4.33Å; V573-F576 PolarHBondContact O-N 3.3Å; F576-A580 WeakPolarHBondContact O-CB 3.45Å; F576-A580 PolarHBondContact O-N 3.33Å; F576-N630 WeakPolarHBondContact CB-ND2 3.48Å; F576-L632 HydrophobicContact CD2-CD1 3.79Å; F576-L632 HydrophobicContact CD2-CD2 3.78Å; F576-L632 HydrophobicContact CD2-CG 4.38Å; F576-L632 HydrophobicContact CE2-CD1 3.9Å
577	V	92.5	Very high	91.1	Very high	12 Å²	12	39 Å²	39	7%	0.073	22%	0.221	C	C	.	.	H	α-helix	trans	-68.8	-47.2	179.3	-177.1	0	0	0	0	109.9	L509 S510 K515 C532 D575 C581	L509-V577 HydrophobicContact CB-CG2 4.31Å; L509-V577 HydrophobicContact CD1-CG2 4.35Å; S510-V577 WeakPolarHBondContact O-CG1 3.17Å; K515-V577 HydrophobicContact CD-CG1 3.91Å; C532-V577 HydrophobicContact CB-CG1 4.16Å; D575-V577 PolarHBondContact O-N 3.35Å; D575-V577 PolarHBondContact OD1-N 3.4Å; V577-C581 VanDerWaalsContact O-CB 3.25Å; V577-C581 WeakPolarHBondContact O-CB 3.23Å; V577-C581 PolarHBondContact O-N 2.84Å; V577-C581 PolarHBondContact O-SG 3.42Å
578	G	91.6	Very high	91.3	Very high	13 Å²	13	38.8 Å²	38.8	13%	0.134	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-45.3	177.5	0	0	0	0	0	112.3	S510 D575 K582	S510-G578 VanDerWaalsContact OG-CA 3.32Å; S510-G578 WeakPolarHBondContact OG-CA 3.14Å; D575-G578 PolarHBondContact O-N 2.9Å; D575-G578 PolarHBondContact OD1-N 3.35Å; G578-K582 WeakPolarHBondContact O-CB 3.29Å; G578-K582 PolarHBondContact O-N 2.84Å
579	D	92.3	Very high	91.5	Very high	68 Å²	68	42.4 Å²	42.4	36%	0.364	22%	0.223	S	C	.	.	H	α-helix	trans	-66.7	-47.6	179.3	-167.1	70	0	0	0	112.1	V573 D575 K582 A583	V573-D579 HydrophobicContact CG1-CB 4.1Å; D575-D579 PolarHBondContact O-N 2.95Å; D579-K582 PolarHBondContact O-N 2.85Å; D579-A583 WeakPolarHBondContact O-CB 3.31Å; D579-A583 PolarHBondContact O-N 3.24Å
580	A	92.6	Very high	91.5	Very high	3 Å²	3	41.3 Å²	41.3	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-48.5	177.9	0	0	0	0	0	112	F576 K582 A583 I584 F627 L632	F576-A580 WeakPolarHBondContact O-CB 3.45Å; F576-A580 PolarHBondContact O-N 3.33Å; A580-K582 VanDerWaalsContact C-N 3.33Å; A580-K582 PolarHBondContact O-N 2.83Å; A580-A583 PolarHBondContact O-N 2.9Å; A580-I584 WeakPolarHBondContact O-CB 3.31Å; A580-I584 WeakPolarHBondContact O-CD1 3.26Å; A580-I584 WeakPolarHBondContact O-CG1 3.45Å; A580-I584 PolarHBondContact O-N 3.06Å; A580-F627 HydrophobicContact CB-CE1 4.35Å; A580-F627 HydrophobicContact CB-CE2 4.09Å; A580-F627 HydrophobicContact CB-CZ 3.84Å; A580-L632 HydrophobicContact CB-CD2 3.74Å
581	C	92.4	Very high	91.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-42.2	176.4	-72.5	0	0	0	0	111.8	K515 D534 Y552 V577 I584 A585	K515-C581 HydrophobicContact CG-CB 4.24Å; D534-C581 HydrophobicContact CB-CB 4.45Å; Y552-C581 HydrophobicContact CE2-CB 4.33Å; V577-C581 VanDerWaalsContact O-CB 3.25Å; V577-C581 WeakPolarHBondContact O-CB 3.23Å; V577-C581 PolarHBondContact O-N 2.84Å; V577-C581 PolarHBondContact O-SG 3.42Å; C581-I584 PolarHBondContact O-N 3.48Å; C581-A585 WeakPolarHBondContact O-CB 3.28Å; C581-A585 PolarHBondContact O-N 3.02Å
582	K	92	Very high	91.3	Very high	152 Å²	152	42.5 Å²	42.5	66%	0.661	24%	0.242	S	C	*	.	H	α-helix	trans	-65.4	-42.4	178	-176.3	-177.9	178.8	-172.8	0	112.3	G578 D579 A580 S586	G578-K582 WeakPolarHBondContact O-CB 3.29Å; G578-K582 PolarHBondContact O-N 2.84Å; D579-K582 PolarHBondContact O-N 2.85Å; A580-K582 VanDerWaalsContact C-N 3.33Å; A580-K582 PolarHBondContact O-N 2.83Å; K582-S586 WeakPolarHBondContact O-CB 3.21Å; K582-S586 PolarHBondContact O-N 2.89Å
583	A	91.5	Very high	91.3	Very high	31 Å²	31	42.3 Å²	42.3	26%	0.256	24%	0.244	S	C	.	.	H	α-helix	trans	-63.4	-46.5	176.6	0	0	0	0	0	111.3	D579 A580 S586 R587 F627	D579-A583 WeakPolarHBondContact O-CB 3.31Å; D579-A583 PolarHBondContact O-N 3.24Å; A580-A583 PolarHBondContact O-N 2.9Å; A583-S586 WeakPolarHBondContact O-CB 3.34Å; A583-S586 PolarHBondContact O-N 3.2Å; A583-R587 PolarHBondContact O-N 2.94Å; A583-R587 VanDerWaalsContact O-N 3.13Å; A583-F627 HydrophobicContact CB-CE1 3.93Å; A583-F627 HydrophobicContact CB-CZ 4.09Å
584	I	92.6	Very high	91.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-49.4	176.3	-66.1	166	0	0	0	110.7	Y552 A580 C581 S586 R587 V588 V612 L625 I634	Y552-I584 HydrophobicContact CD1-CD1 4.01Å; Y552-I584 HydrophobicContact CD1-CG2 4.26Å; Y552-I584 HydrophobicContact CD2-CD1 3.99Å; Y552-I584 HydrophobicContact CE1-CB 4.43Å; Y552-I584 HydrophobicContact CE1-CD1 4.21Å; Y552-I584 HydrophobicContact CE1-CG2 3.49Å; Y552-I584 VanDerWaalsContact CE1-CG2 3.49Å; Y552-I584 HydrophobicContact CE2-CD1 4.19Å; Y552-I584 HydrophobicContact CE2-CG2 4.39Å; Y552-I584 HydrophobicContact CG-CD1 3.89Å; A580-I584 WeakPolarHBondContact O-CB 3.31Å; A580-I584 WeakPolarHBondContact O-CD1 3.26Å; A580-I584 WeakPolarHBondContact O-CG1 3.45Å; A580-I584 PolarHBondContact O-N 3.06Å; C581-I584 PolarHBondContact O-N 3.48Å; I584-S586 PolarHBondContact O-N 3.44Å; I584-R587 PolarHBondContact O-N 3.37Å; I584-V588 HydrophobicContact CG2-CG2 4.21Å; I584-V588 WeakPolarHBondContact O-CG2 3.23Å; I584-V588 PolarHBondContact O-N 2.71Å; I584-V612 HydrophobicContact CG1-CG1 4.09Å; I584-V612 HydrophobicContact CG2-CG1 4.18Å; I584-V612 HydrophobicContact CG2-CG2 3.62Å; I584-L625 HydrophobicContact CG1-CD2 4.27Å; I584-I634 HydrophobicContact CD1-CD1 4.43Å; I584-I634 HydrophobicContact CD1-CG1 4.21Å
585	A	91.3	Very high	91.4	Very high	9 Å²	9	42.4 Å²	42.4	7%	0.074	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-28.4	177.5	0	0	0	0	0	113.1	V536 C581 R589	V536-A585 HydrophobicContact CB-CB 4.4Å; V536-A585 HydrophobicContact CG1-CB 3.79Å; V536-A585 HydrophobicContact CG2-CB 3.64Å; C581-A585 WeakPolarHBondContact O-CB 3.28Å; C581-A585 PolarHBondContact O-N 3.02Å; A585-R589 WeakPolarHBondContact O-CB 3.28Å; A585-R589 VanDerWaalsContact O-CG 3.29Å; A585-R589 WeakPolarHBondContact O-CG 3.46Å; A585-R589 PolarHBondContact O-N 2.62Å; A585-R589 VanDerWaalsContact O-N 3.17Å; A585-R589 PolarHBondContact O-NE 3.04Å
586	S	91.8	Very high	91.3	Very high	69 Å²	69	45.9 Å²	45.9	48%	0.483	26%	0.262	S	S	.	.	H	α-helix	trans	-71.1	-44.7	172.7	-158.1	0	0	0	0	112	K582 A583 I584 G590	K582-S586 WeakPolarHBondContact O-CB 3.21Å; K582-S586 PolarHBondContact O-N 2.89Å; A583-S586 WeakPolarHBondContact O-CB 3.34Å; A583-S586 PolarHBondContact O-N 3.2Å; I584-S586 PolarHBondContact O-N 3.44Å; S586-G590 PolarHBondContact O-N 3.45Å
587	R	91.1	Very high	90.9	Very high	108 Å²	108	48 Å²	48	41%	0.408	27%	0.272	S	S	.	.	H	α-helix	trans	-61	-50.9	175.6	-67.5	179	-175.6	-155.5	-1.3	111.4	A583 I584 R589 G590 T591 S611 V612 L625	A583-R587 PolarHBondContact O-N 2.94Å; A583-R587 VanDerWaalsContact O-N 3.13Å; I584-R587 PolarHBondContact O-N 3.37Å; R587-R589 PolarHBondContact O-N 3.48Å; R587-G590 PolarHBondContact O-N 2.81Å; R587-G590 VanDerWaalsContact O-N 3.11Å; R587-T591 PolarHBondContact O-N 3.23Å; R587-T591 PolarHBondContact O-OG1 3.46Å; R587-S611 PolarHBondContact O-OG 2.88Å; R587-V612 PolarHBondContact NH1-O 3.45Å; R587-L625 VanDerWaalsContact NH1-CD1 3.29Å
588	V	91.2	Very high	90.6	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-60	-46.6	-179.1	178.4	0	0	0	0	110.8	V538 L548 L550 I584 G590 T591 V592 I608 S611 V612	V538-V588 HydrophobicContact CG1-CG1 4.2Å; L548-V588 HydrophobicContact CD1-CG1 3.7Å; L550-V588 HydrophobicContact CD1-CG2 4.35Å; I584-V588 HydrophobicContact CG2-CG2 4.21Å; I584-V588 WeakPolarHBondContact O-CG2 3.23Å; I584-V588 PolarHBondContact O-N 2.71Å; V588-G590 VanDerWaalsContact C-N 3.34Å; V588-G590 PolarHBondContact O-N 3.48Å; V588-T591 PolarHBondContact O-N 3.2Å; V588-V592 HydrophobicContact CG1-CG2 4.05Å; V588-V592 WeakPolarHBondContact O-CB 3.4Å; V588-V592 VanDerWaalsContact O-CG2 3.28Å; V588-V592 WeakPolarHBondContact O-CG2 3.46Å; V588-V592 PolarHBondContact O-N 3.46Å; V588-I608 HydrophobicContact CG1-CG1 4.35Å; V588-I608 HydrophobicContact CG2-CG2 4.24Å; V588-S611 VanDerWaalsContact CA-OG 3.32Å; V588-S611 WeakPolarHBondContact CA-OG 3.38Å; V588-S611 PolarHBondContact N-OG 3.31Å; V588-V612 HydrophobicContact CG2-CG2 3.77Å
589	R	91.4	Very high	90.4	Very high	117 Å²	117	54.5 Å²	54.5	44%	0.442	30%	0.303	S	S	.	.	H	α-helix	trans	-58.3	-44.1	174.2	-79.2	179.6	-66	152.3	-0.3	112.5	V536 V538 A585 R587 T591 A593	V536-R589 HydrophobicContact CG1-CG 4.25Å; V538-R589 HydrophobicContact CB-CG 4.44Å; V538-R589 HydrophobicContact CG1-CG 3.85Å; A585-R589 WeakPolarHBondContact O-CB 3.28Å; A585-R589 VanDerWaalsContact O-CG 3.29Å; A585-R589 WeakPolarHBondContact O-CG 3.46Å; A585-R589 PolarHBondContact O-N 2.62Å; A585-R589 VanDerWaalsContact O-N 3.17Å; A585-R589 PolarHBondContact O-NE 3.04Å; R587-R589 PolarHBondContact O-N 3.48Å; R589-T591 VanDerWaalsContact C-N 3.34Å; R589-T591 PolarHBondContact O-N 2.99Å; R589-A593 VanDerWaalsContact O-CB 3.32Å; R589-A593 WeakPolarHBondContact O-CB 3.1Å; R589-A593 PolarHBondContact O-N 2.83Å; R589-A593 VanDerWaalsContact O-N 3.08Å
590	G	90.4	Very high	90.2	Very high	52 Å²	52	51.2 Å²	51.2	54%	0.536	29%	0.286	S	S	.	.	H	α-helix	trans	-62.1	-36.8	178.4	0	0	0	0	0	113.9	S586 R587 V588	S586-G590 PolarHBondContact O-N 3.45Å; R587-G590 PolarHBondContact O-N 2.81Å; R587-G590 VanDerWaalsContact O-N 3.11Å; V588-G590 VanDerWaalsContact C-N 3.34Å; V588-G590 PolarHBondContact O-N 3.48Å
591	T	88.9	Confident	89.8	Confident	44 Å²	44	55.2 Å²	55.2	27%	0.27	30%	0.303	S	S	.	.	H	α-helix	trans	-79.4	-41.1	177.2	-52	0	0	0	0	112.7	R587 V588 R589 A593 S594 I607 S611	R587-T591 PolarHBondContact O-N 3.23Å; R587-T591 PolarHBondContact O-OG1 3.46Å; V588-T591 PolarHBondContact O-N 3.2Å; R589-T591 VanDerWaalsContact C-N 3.34Å; R589-T591 PolarHBondContact O-N 2.99Å; T591-A593 VanDerWaalsContact C-N 3.31Å; T591-A593 PolarHBondContact O-N 3.23Å; T591-S594 PolarHBondContact O-N 2.81Å; T591-S594 PolarHBondContact O-OG 3.23Å; T591-I607 HydrophobicContact CG2-CG2 3.92Å; T591-S611 WeakPolarHBondContact CB-OG 3.35Å; T591-S611 VanDerWaalsContact OG1-CB 3.25Å; T591-S611 WeakPolarHBondContact OG1-CB 3.44Å; T591-S611 PolarHBondContact OG1-OG 2.84Å
592	V	89.9	Confident	89.4	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-34.6	-179.2	177.5	0	0	0	0	111.4	V538 T540 V588 S594 V595 F600	V538-V592 HydrophobicContact CB-CB 4.27Å; V538-V592 HydrophobicContact CB-CG1 4.07Å; V538-V592 HydrophobicContact CG2-CB 4.39Å; V538-V592 HydrophobicContact CG2-CG1 3.79Å; T540-V592 HydrophobicContact CG2-CG1 3.79Å; V588-V592 HydrophobicContact CG1-CG2 4.05Å; V588-V592 WeakPolarHBondContact O-CB 3.4Å; V588-V592 VanDerWaalsContact O-CG2 3.28Å; V588-V592 WeakPolarHBondContact O-CG2 3.46Å; V588-V592 PolarHBondContact O-N 3.46Å; V592-S594 PolarHBondContact O-N 2.9Å; V592-S594 VanDerWaalsContact O-N 3.08Å; V592-V595 PolarHBondContact O-N 2.93Å; V592-F600 HydrophobicContact CG1-CD2 4.29Å; V592-F600 HydrophobicContact CG1-CE2 4.34Å; V592-F600 HydrophobicContact CG1-CG 4.46Å; V592-F600 HydrophobicContact CG2-CD2 3.95Å; V592-F600 HydrophobicContact CG2-CE2 3.45Å; V592-F600 VanDerWaalsContact CG2-CE2 3.45Å; V592-F600 HydrophobicContact CG2-CZ 3.96Å
593	A	90	Very high	89.1	Confident	59 Å²	59	58.7 Å²	58.7	49%	0.488	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.8	175.3	0	0	0	0	0	114.4	E539 A541 R589 T591	E539-A593 WeakPolarHBondContact O-CA 3.37Å; E539-A593 PolarHBondContact O-N 3.27Å; A541-A593 WeakPolarHBondContact CB-O 3.33Å; R589-A593 VanDerWaalsContact O-CB 3.32Å; R589-A593 WeakPolarHBondContact O-CB 3.1Å; R589-A593 PolarHBondContact O-N 2.83Å; R589-A593 VanDerWaalsContact O-N 3.08Å; T591-A593 VanDerWaalsContact C-N 3.31Å; T591-A593 PolarHBondContact O-N 3.23Å
594	S	90.2	Very high	88.9	Confident	89 Å²	89	58.2 Å²	58.2	62%	0.622	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-2.2	174.5	62.6	0	0	0	0	114.7	T591 V592	T591-S594 PolarHBondContact O-N 2.81Å; T591-S594 PolarHBondContact O-OG 3.23Å; V592-S594 PolarHBondContact O-N 2.9Å; V592-S594 VanDerWaalsContact O-N 3.08Å
595	V	90.1	Very high	88.6	Confident	22 Å²	22	61.5 Å²	61.5	13%	0.133	34%	0.337	C	S	.	.	S	Bend	trans	-118	142.8	-175.3	-173.7	0	0	0	0	110.5	T540 A541 V592 D599 F600 I607	T540-V595 WeakPolarHBondContact CB-O 3.28Å; A541-V595 WeakPolarHBondContact CB-O 3.41Å; A541-V595 PolarHBondContact N-O 2.82Å; V592-V595 PolarHBondContact O-N 2.93Å; V595-D599 HydrophobicContact CG1-CB 3.98Å; V595-D599 WeakPolarHBondContact CG1-OD2 3.16Å; V595-F600 HydrophobicContact CG1-CB 4.06Å; V595-I607 HydrophobicContact CG1-CD1 4.11Å
596	Q	90.6	Very high	88.4	Confident	105 Å²	105	69.5 Å²	69.5	49%	0.491	37%	0.366	S	S	.	.			trans	-74.9	153	176.9	-61.3	-71.3	-53.5	0	0	111.3	D598 D599 F600	Q596-D598 PolarHBondContact O-N 3.41Å; Q596-D599 PolarHBondContact O-N 3.15Å; Q596-F600 WeakPolarHBondContact O-CB 3.39Å; Q596-F600 PolarHBondContact O-N 3.42Å
597	F	85.4	Confident	88.3	Confident	52 Å²	52	67.2 Å²	67.2	23%	0.228	35%	0.348	C	S	.	.	H	α-helix	trans	-54.1	-45.1	-178.1	172.9	-104.9	0	0	0	113.9	T540 D542 A544 L546 F600 H601 L653	T540-F597 HydrophobicContact CG2-CB 4.48Å; D542-F597 PolarHBondContact OD1-N 2.95Å; D542-F597 WeakPolarHBondContact OD2-CB 3.46Å; D542-F597 PolarHBondContact OD2-N 3.27Å; A544-F597 HydrophobicContact CB-CB 3.98Å; A544-F597 HydrophobicContact CB-CD2 3.94Å; A544-F597 HydrophobicContact CB-CG 4.12Å; L546-F597 HydrophobicContact CD1-CD2 4.11Å; L546-F597 HydrophobicContact CD1-CE2 4.29Å; L546-F597 HydrophobicContact CD2-CD2 3.95Å; L546-F597 HydrophobicContact CD2-CE2 3.71Å; F597-F600 PolarHBondContact O-N 3.31Å; F597-H601 HydrophobicContact CZ-CB 4.4Å; F597-H601 VanDerWaalsContact O-CB 3.28Å; F597-H601 WeakPolarHBondContact O-CB 3.33Å; F597-H601 PolarHBondContact O-N 2.83Å; F597-L653 HydrophobicContact CZ-CD1 4.08Å
598	D	85.5	Confident	88.1	Confident	88 Å²	88	62.1 Å²	62.1	47%	0.471	33%	0.329	S	S	.	.	H	α-helix	trans	-65.5	-44.4	-176.5	178.1	57.9	0	0	0	112.9	Q596 H601 K602	Q596-D598 PolarHBondContact O-N 3.41Å; D598-H601 PolarHBondContact O-N 3.14Å; D598-K602 WeakPolarHBondContact O-CG 3.39Å; D598-K602 PolarHBondContact O-N 2.94Å; D598-K602 VanDerWaalsContact O-N 3.09Å; D598-K602 WeakPolarHBondContact OD1-CE 3.48Å; D598-K602 IonicContact OD1-NZ 3.52Å; D598-K602 PolarHBondContact OD1-NZ 3.43Å; D598-K602 IonicContact OD2-NZ 3.9Å; D598-K602 PolarHBondContact OD2-NZ 2.67Å
599	D	87.9	Confident	88	Confident	73 Å²	73	67.2 Å²	67.2	39%	0.39	35%	0.348	S	S	.	.	H	α-helix	trans	-68.8	-40.3	176	-175.4	43.4	0	0	0	111.4	V595 Q596 H601 K602 H603	V595-D599 HydrophobicContact CG1-CB 3.98Å; V595-D599 WeakPolarHBondContact CG1-OD2 3.16Å; Q596-D599 PolarHBondContact O-N 3.15Å; D599-H601 VanDerWaalsContact C-N 3.34Å; D599-H601 PolarHBondContact O-N 3.42Å; D599-K602 PolarHBondContact O-N 3.27Å; D599-H603 WeakPolarHBondContact O-CB 3.21Å; D599-H603 PolarHBondContact O-N 3.26Å; D599-H603 IonicContact OD1-CE1 3.64Å; D599-H603 IonicContact OD1-CG 2.89Å; D599-H603 IonicContact OD1-ND1 3.67Å; D599-H603 PolarHBondContact OD1-ND1 2.95Å
600	F	87.9	Confident	87.8	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-40.5	173.2	-178.2	-101.4	0	0	0	112.1	L546 L548 V592 V595 Q596 F597 S604 I607 I608 V642	L546-F600 HydrophobicContact CD1-CD1 3.41Å; L546-F600 VanDerWaalsContact CD1-CD1 3.41Å; L546-F600 HydrophobicContact CD1-CE1 3.43Å; L546-F600 VanDerWaalsContact CD1-CE1 3.43Å; L548-F600 HydrophobicContact CD1-CZ 4.12Å; L548-F600 HydrophobicContact CD2-CE1 3.91Å; L548-F600 HydrophobicContact CD2-CZ 3.85Å; V592-F600 HydrophobicContact CG1-CD2 4.29Å; V592-F600 HydrophobicContact CG1-CE2 4.34Å; V592-F600 HydrophobicContact CG1-CG 4.46Å; V592-F600 HydrophobicContact CG2-CD2 3.95Å; V592-F600 HydrophobicContact CG2-CE2 3.45Å; V592-F600 VanDerWaalsContact CG2-CE2 3.45Å; V592-F600 HydrophobicContact CG2-CZ 3.96Å; V595-F600 HydrophobicContact CG1-CB 4.06Å; Q596-F600 WeakPolarHBondContact O-CB 3.39Å; Q596-F600 PolarHBondContact O-N 3.42Å; F597-F600 PolarHBondContact O-N 3.31Å; F600-S604 WeakPolarHBondContact O-CA 3.2Å; F600-S604 WeakPolarHBondContact O-CB 3.44Å; F600-S604 PolarHBondContact O-N 2.91Å; F600-I607 HydrophobicContact CD2-CB 4.41Å; F600-I607 HydrophobicContact CD2-CD1 4.11Å; F600-I607 HydrophobicContact CD2-CG2 4.12Å; F600-I607 HydrophobicContact CE2-CG2 4.31Å; F600-I608 HydrophobicContact CE2-CD1 4.21Å; F600-I608 HydrophobicContact CE2-CG1 4.03Å; F600-I608 HydrophobicContact CZ-CD1 3.94Å; F600-I608 HydrophobicContact CZ-CG1 4.23Å; F600-V642 HydrophobicContact CE1-CG1 3.88Å
601	H	83.5	Confident	87.7	Confident	86 Å²	86	61 Å²	61	40%	0.398	32%	0.316	S	S	.	.	H	α-helix	trans	-64.1	-45	178.7	-172.5	59.6	0	0	0	111.3	F597 D598 D599	F597-H601 HydrophobicContact CZ-CB 4.4Å; F597-H601 VanDerWaalsContact O-CB 3.28Å; F597-H601 WeakPolarHBondContact O-CB 3.33Å; F597-H601 PolarHBondContact O-N 2.83Å; D598-H601 PolarHBondContact O-N 3.14Å; D599-H601 VanDerWaalsContact C-N 3.34Å; D599-H601 PolarHBondContact O-N 3.42Å
602	K	83.8	Confident	87.7	Confident	133 Å²	133	59 Å²	59	58%	0.578	30%	0.303	S	S	*	.	H	α-helix	trans	-67.4	-38	178.5	-71.8	165.8	-178.7	163.9	0	113.8	D598 D599	D598-K602 WeakPolarHBondContact O-CG 3.39Å; D598-K602 PolarHBondContact O-N 2.94Å; D598-K602 VanDerWaalsContact O-N 3.09Å; D598-K602 WeakPolarHBondContact OD1-CE 3.48Å; D598-K602 IonicContact OD1-NZ 3.52Å; D598-K602 PolarHBondContact OD1-NZ 3.43Å; D598-K602 IonicContact OD2-NZ 3.9Å; D598-K602 PolarHBondContact OD2-NZ 2.67Å; D599-K602 PolarHBondContact O-N 3.27Å
603	H	87.1	Confident	87.7	Confident	93 Å²	93	59.3 Å²	59.3	43%	0.431	31%	0.305	S	S	.	.	H	α-helix	trans	-119.3	15	-170.4	-57.3	121.3	0	0	0	114.6	D599 S605 R606 I607	D599-H603 WeakPolarHBondContact O-CB 3.21Å; D599-H603 PolarHBondContact O-N 3.26Å; D599-H603 IonicContact OD1-CE1 3.64Å; D599-H603 IonicContact OD1-CG 2.89Å; D599-H603 IonicContact OD1-ND1 3.67Å; D599-H603 PolarHBondContact OD1-ND1 2.95Å; H603-S605 VanDerWaalsContact C-N 3.35Å; H603-S605 PolarHBondContact O-N 3.27Å; H603-S605 VanDerWaalsContact O-N 3.16Å; H603-R606 PolarHBondContact O-N 3.19Å; H603-I607 HydrophobicContact CB-CD1 3.78Å; H603-I607 HydrophobicContact CB-CG1 4.18Å; H603-I607 WeakPolarHBondContact O-CG1 3.21Å; H603-I607 PolarHBondContact O-N 2.87Å
604	S	86.4	Confident	87.5	Confident	22 Å²	22	57.7 Å²	57.7	15%	0.154	29%	0.294	C	S	.	.	H	α-helix	trans	-43.1	-52.2	-173.9	49.4	0	0	0	0	114.1	F600 R606 I607 I608	F600-S604 WeakPolarHBondContact O-CA 3.2Å; F600-S604 WeakPolarHBondContact O-CB 3.44Å; F600-S604 PolarHBondContact O-N 2.91Å; S604-R606 PolarHBondContact O-N 3.49Å; S604-I607 PolarHBondContact O-N 3.22Å; S604-I608 WeakPolarHBondContact O-CB 3.42Å; S604-I608 WeakPolarHBondContact O-CD1 3.33Å; S604-I608 VanDerWaalsContact O-CG1 3.25Å; S604-I608 WeakPolarHBondContact O-CG1 3.48Å; S604-I608 PolarHBondContact O-N 2.95Å
605	S	87	Confident	87.1	Confident	68 Å²	68	57.7 Å²	57.7	48%	0.476	29%	0.286	S	S	.	.	H	α-helix	trans	-60	-41.2	-178.9	61.2	0	0	0	0	113.1	H603 R609	H603-S605 VanDerWaalsContact C-N 3.35Å; H603-S605 PolarHBondContact O-N 3.27Å; H603-S605 VanDerWaalsContact O-N 3.16Å; S605-R609 WeakPolarHBondContact O-CB 3.28Å; S605-R609 VanDerWaalsContact O-CG 3.29Å; S605-R609 WeakPolarHBondContact O-CG 3.32Å; S605-R609 PolarHBondContact O-N 2.94Å; S605-R609 VanDerWaalsContact O-N 3.14Å
606	R	87.5	Confident	86.7	Confident	177 Å²	177	59.6 Å²	59.6	67%	0.668	30%	0.296	S	S	*	.	H	α-helix	trans	-70.4	-44.5	176.5	-177	177.3	177.3	170.3	-0.4	111.2	H603 S604 R609 A610	H603-R606 PolarHBondContact O-N 3.19Å; S604-R606 PolarHBondContact O-N 3.49Å; R606-R609 PolarHBondContact O-N 3.1Å; R606-A610 VanDerWaalsContact O-CB 3.25Å; R606-A610 WeakPolarHBondContact O-CB 3.42Å; R606-A610 PolarHBondContact O-N 3.32Å
607	I	87.9	Confident	86.1	Confident	22 Å²	22	64.8 Å²	64.8	11%	0.113	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-46.7	-179	-66	162	0	0	0	110.7	T591 V595 F600 H603 S604 A610 S611	T591-I607 HydrophobicContact CG2-CG2 3.92Å; V595-I607 HydrophobicContact CG1-CD1 4.11Å; F600-I607 HydrophobicContact CD2-CB 4.41Å; F600-I607 HydrophobicContact CD2-CD1 4.11Å; F600-I607 HydrophobicContact CD2-CG2 4.12Å; F600-I607 HydrophobicContact CE2-CG2 4.31Å; H603-I607 HydrophobicContact CB-CD1 3.78Å; H603-I607 HydrophobicContact CB-CG1 4.18Å; H603-I607 WeakPolarHBondContact O-CG1 3.21Å; H603-I607 PolarHBondContact O-N 2.87Å; S604-I607 PolarHBondContact O-N 3.22Å; I607-A610 PolarHBondContact O-N 3.44Å; I607-S611 WeakPolarHBondContact O-CB 3.34Å; I607-S611 PolarHBondContact O-N 3.49Å
608	I	88.6	Confident	85.8	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.3	-48.4	178.3	-67.4	161.2	0	0	0	110.3	L548 L550 V588 F600 S604 A610 S611 V612 V637 V639	L548-I608 HydrophobicContact CD1-CD1 4.15Å; L550-I608 HydrophobicContact CD1-CG2 4.37Å; L550-I608 HydrophobicContact CD2-CD1 4.16Å; L550-I608 HydrophobicContact CD2-CG2 4.18Å; V588-I608 HydrophobicContact CG1-CG1 4.35Å; V588-I608 HydrophobicContact CG2-CG2 4.24Å; F600-I608 HydrophobicContact CE2-CD1 4.21Å; F600-I608 HydrophobicContact CE2-CG1 4.03Å; F600-I608 HydrophobicContact CZ-CD1 3.94Å; F600-I608 HydrophobicContact CZ-CG1 4.23Å; S604-I608 WeakPolarHBondContact O-CB 3.42Å; S604-I608 WeakPolarHBondContact O-CD1 3.33Å; S604-I608 VanDerWaalsContact O-CG1 3.25Å; S604-I608 WeakPolarHBondContact O-CG1 3.48Å; S604-I608 PolarHBondContact O-N 2.95Å; I608-A610 PolarHBondContact O-N 3.28Å; I608-S611 WeakPolarHBondContact O-CB 3.48Å; I608-S611 PolarHBondContact O-N 2.68Å; I608-S611 VanDerWaalsContact O-N 3.16Å; I608-V612 WeakPolarHBondContact O-CG2 3.44Å; I608-V612 PolarHBondContact O-N 2.84Å; I608-V637 HydrophobicContact CG2-CG1 3.97Å; I608-V639 HydrophobicContact CB-CG2 4.26Å; I608-V639 HydrophobicContact CD1-CG1 4.02Å; I608-V639 HydrophobicContact CD1-CG2 3.62Å; I608-V639 HydrophobicContact CG2-CG2 4.22Å
609	R	88.6	Confident	85.3	Confident	108 Å²	108	64.2 Å²	64.2	41%	0.408	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-42	178.5	-73.8	-179.1	63	177.4	1.2	112.5	S605 R606 S611 V612 F613 V621 V637	S605-R609 WeakPolarHBondContact O-CB 3.28Å; S605-R609 VanDerWaalsContact O-CG 3.29Å; S605-R609 WeakPolarHBondContact O-CG 3.32Å; S605-R609 PolarHBondContact O-N 2.94Å; S605-R609 VanDerWaalsContact O-N 3.14Å; R606-R609 PolarHBondContact O-N 3.1Å; R609-S611 VanDerWaalsContact C-N 3.32Å; R609-S611 PolarHBondContact O-N 3.43Å; R609-V612 PolarHBondContact O-N 3.2Å; R609-F613 HydrophobicContact CB-CD2 4.48Å; R609-F613 WeakPolarHBondContact O-CD2 3.15Å; R609-F613 PolarHBondContact O-N 2.8Å; R609-V621 HydrophobicContact CB-CG1 4.14Å; R609-V621 WeakPolarHBondContact O-CG1 3.1Å; R609-V637 HydrophobicContact CG-CB 4.49Å
610	A	87.8	Confident	85.1	Confident	26 Å²	26	66.7 Å²	66.7	22%	0.215	35%	0.348	C	S	.	.	H	α-helix	trans	-61.9	-38.8	174.5	0	0	0	0	0	112.3	R606 I607 I608 G614 L615 V621	R606-A610 VanDerWaalsContact O-CB 3.25Å; R606-A610 WeakPolarHBondContact O-CB 3.42Å; R606-A610 PolarHBondContact O-N 3.32Å; I607-A610 PolarHBondContact O-N 3.44Å; I608-A610 PolarHBondContact O-N 3.28Å; A610-G614 WeakPolarHBondContact O-CA 3.4Å; A610-G614 PolarHBondContact O-N 2.7Å; A610-L615 HydrophobicContact CB-CD2 4.1Å; A610-V621 HydrophobicContact CB-CG2 3.81Å
611	S	87.6	Confident	84.8	Confident	14 Å²	14	67.8 Å²	67.8	10%	0.098	36%	0.355	C	S	.	.	H	α-helix	trans	-63.6	-44	176.1	-177.1	0	0	0	0	113	R587 V588 T591 I607 I608 R609	R587-S611 PolarHBondContact O-OG 2.88Å; V588-S611 VanDerWaalsContact CA-OG 3.32Å; V588-S611 WeakPolarHBondContact CA-OG 3.38Å; V588-S611 PolarHBondContact N-OG 3.31Å; T591-S611 WeakPolarHBondContact CB-OG 3.35Å; T591-S611 VanDerWaalsContact OG1-CB 3.25Å; T591-S611 WeakPolarHBondContact OG1-CB 3.44Å; T591-S611 PolarHBondContact OG1-OG 2.84Å; I607-S611 WeakPolarHBondContact O-CB 3.34Å; I607-S611 PolarHBondContact O-N 3.49Å; I608-S611 WeakPolarHBondContact O-CB 3.48Å; I608-S611 PolarHBondContact O-N 2.68Å; I608-S611 VanDerWaalsContact O-N 3.16Å; R609-S611 VanDerWaalsContact C-N 3.32Å; R609-S611 PolarHBondContact O-N 3.43Å
612	V	88	Confident	85	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-74.3	-52.5	-176.8	-178.3	0	0	0	0	111.8	I584 R587 V588 I608 R609 L625 V637	I584-V612 HydrophobicContact CG1-CG1 4.09Å; I584-V612 HydrophobicContact CG2-CG1 4.18Å; I584-V612 HydrophobicContact CG2-CG2 3.62Å; R587-V612 PolarHBondContact NH1-O 3.45Å; V588-V612 HydrophobicContact CG2-CG2 3.77Å; I608-V612 WeakPolarHBondContact O-CG2 3.44Å; I608-V612 PolarHBondContact O-N 2.84Å; R609-V612 PolarHBondContact O-N 3.2Å; V612-L625 HydrophobicContact CG1-CD2 3.94Å; V612-V637 HydrophobicContact CB-CG2 4.07Å; V612-V637 HydrophobicContact CG1-CG2 3.87Å; V612-V637 HydrophobicContact CG2-CG2 4.12Å
613	F	89.9	Confident	85	Confident	8 Å²	8	69 Å²	69	4%	0.035	36%	0.361	C	S	.	.	H	α-helix	trans	-87.6	-20.2	-172.8	-59.9	-51.6	0	0	0	114	R609 V621 R622 R624 L625 I634 V637	R609-F613 HydrophobicContact CB-CD2 4.48Å; R609-F613 WeakPolarHBondContact O-CD2 3.15Å; R609-F613 PolarHBondContact O-N 2.8Å; F613-V621 HydrophobicContact CB-CG1 4.04Å; F613-V621 HydrophobicContact CD2-CG1 4.09Å; F613-R622 HydrophobicContact CB-CB 4.11Å; F613-R622 WeakPolarHBondContact CB-O 3.42Å; F613-R622 WeakPolarHBondContact CD2-O 3.4Å; F613-R622 WeakPolarHBondContact CG-O 3.38Å; F613-R622 WeakPolarHBondContact O-CD 3.41Å; F613-R624 VanDerWaalsContact CD1-C 3.4Å; F613-L625 HydrophobicContact CD1-CB 3.82Å; F613-L625 HydrophobicContact CE1-CB 4.13Å; F613-I634 HydrophobicContact CE1-CB 4.36Å; F613-I634 HydrophobicContact CE1-CG2 4.13Å; F613-I634 WeakPolarHBondContact CE1-O 3.31Å; F613-I634 HydrophobicContact CZ-CG2 4.43Å; F613-V637 HydrophobicContact CE1-CG2 4.36Å; F613-V637 HydrophobicContact CE2-CB 4.49Å; F613-V637 HydrophobicContact CE2-CG2 4Å; F613-V637 HydrophobicContact CZ-CG2 3.71Å
614	G	85.6	Confident	85.1	Confident	25 Å²	25	71.4 Å²	71.4	26%	0.258	37%	0.366	S	S	.	.			trans	76.1	175	-169.4	0	0	0	0	0	112.7	A610 R622	A610-G614 WeakPolarHBondContact O-CA 3.4Å; A610-G614 PolarHBondContact O-N 2.7Å; G614-R622 PolarHBondContact O-N 3.26Å
615	L	83.2	Confident	85.2	Confident	89 Å²	89	71.1 Å²	71.1	47%	0.466	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-99.2	150.7	175.3	-59	173.3	0	0	0	110.5	A610 K620 V621 R622	A610-L615 HydrophobicContact CB-CD2 4.1Å; L615-K620 CarbonylContact C-O 3.58Å; L615-K620 VanDerWaalsContact CA-O 3.31Å; L615-K620 WeakPolarHBondContact CA-O 3.46Å; L615-V621 HydrophobicContact CD2-CG2 3.96Å; L615-R622 PolarHBondContact O-NE 2.92Å; L615-R622 PolarHBondContact O-NH2 2.85Å
616	D	81.1	Confident	85.4	Confident	63 Å²	63	70.9 Å²	70.9	34%	0.337	36%	0.358	S	S	.	.			trans	-83.3	-179.4	164.3	71.9	10	0	0	0	111.4	A618 G619 K620 R622	D616-A618 PolarHBondContact O-N 3.18Å; D616-A618 WeakPolarHBondContact OD1-CA 3.43Å; D616-A618 WeakPolarHBondContact OD1-CB 3.42Å; D616-A618 PolarHBondContact OD1-N 3.28Å; D616-G619 PolarHBondContact O-N 3.12Å; D616-G619 VanDerWaalsContact O-N 3.1Å; D616-G619 PolarHBondContact OD1-N 3.43Å; D616-K620 PolarHBondContact N-O 2.92Å; D616-K620 PolarHBondContact OD1-N 2.89Å; D616-R622 HydrophobicContact CB-CG 4.39Å
617	E	78.7	Confident	85.7	Confident	213 Å²	213	63.8 Å²	63.8	100%	0.995	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.3	180	-63.4	175.2	-175.4	0	0	113.2
618	A	77.7	Confident	85.7	Confident	90 Å²	90	67.6 Å²	67.6	74%	0.744	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	2.3	176	0	0	0	0	0	113.1	D616 K620	D616-A618 PolarHBondContact O-N 3.18Å; D616-A618 WeakPolarHBondContact OD1-CA 3.43Å; D616-A618 WeakPolarHBondContact OD1-CB 3.42Å; D616-A618 PolarHBondContact OD1-N 3.28Å; A618-K620 VanDerWaalsContact C-N 3.29Å; A618-K620 PolarHBondContact O-N 3.04Å
619	G	76.8	Confident	85.8	Confident	39 Å²	39	73.5 Å²	73.5	40%	0.402	39%	0.386	S	S	.	.	S	Bend	trans	74.8	14.3	-177.2	0	0	0	0	0	114.5	D616	D616-G619 PolarHBondContact O-N 3.12Å; D616-G619 VanDerWaalsContact O-N 3.1Å; D616-G619 PolarHBondContact OD1-N 3.43Å
620	K	82.4	Confident	85.9	Confident	124 Å²	124	68.5 Å²	68.5	54%	0.539	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-85.8	146.8	171.2	-170.6	-167.2	172.1	-156.9	0	109.4	L615 D616 A618	L615-K620 CarbonylContact C-O 3.58Å; L615-K620 VanDerWaalsContact CA-O 3.31Å; L615-K620 WeakPolarHBondContact CA-O 3.46Å; D616-K620 PolarHBondContact N-O 2.92Å; D616-K620 PolarHBondContact OD1-N 2.89Å; A618-K620 VanDerWaalsContact C-N 3.29Å; A618-K620 PolarHBondContact O-N 3.04Å
621	V	81.9	Confident	86	Confident	24 Å²	24	68.9 Å²	68.9	15%	0.145	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-69	132.8	174.3	-177.3	0	0	0	0	109.7	R609 A610 F613 L615	R609-V621 HydrophobicContact CB-CG1 4.14Å; R609-V621 WeakPolarHBondContact O-CG1 3.1Å; A610-V621 HydrophobicContact CB-CG2 3.81Å; F613-V621 HydrophobicContact CB-CG1 4.04Å; F613-V621 HydrophobicContact CD2-CG1 4.09Å; L615-V621 HydrophobicContact CD2-CG2 3.96Å
622	R	86.8	Confident	86.3	Confident	137 Å²	137	68.3 Å²	68.3	52%	0.517	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-68.3	155.2	176.8	-58.4	-179.2	-169.4	-179	-1.3	111.3	F613 G614 L615 D616	F613-R622 HydrophobicContact CB-CB 4.11Å; F613-R622 WeakPolarHBondContact CB-O 3.42Å; F613-R622 WeakPolarHBondContact CD2-O 3.4Å; F613-R622 WeakPolarHBondContact CG-O 3.38Å; F613-R622 WeakPolarHBondContact O-CD 3.41Å; G614-R622 PolarHBondContact O-N 3.26Å; L615-R622 PolarHBondContact O-NE 2.92Å; L615-R622 PolarHBondContact O-NH2 2.85Å; D616-R622 HydrophobicContact CB-CG 4.39Å
623	D	84.8	Confident	86.6	Confident	107 Å²	107	69.1 Å²	69.1	57%	0.572	37%	0.365	S	S	*	.	S	Bend	trans	-87.6	-10.3	-173.2	-58	-53.5	0	0	0	114.6
624	R	88.1	Confident	86.8	Confident	144 Å²	144	68.9 Å²	68.9	54%	0.543	36%	0.364	S	S	.	.			trans	-154.9	154.5	-179.5	57.9	179.4	168.3	178.1	-3.7	114.2	F613 I634	F613-R624 VanDerWaalsContact CD1-C 3.4Å; R624-I634 CarbonylContact C-O 3.51Å; R624-I634 VanDerWaalsContact CA-O 3.23Å; R624-I634 WeakPolarHBondContact CA-O 3.47Å; R624-I634 WeakPolarHBondContact CB-O 3.37Å
625	L	90.5	Very high	87	Confident	16 Å²	16	70.9 Å²	70.9	8%	0.084	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	125.4	168.6	169.7	60.2	0	0	0	109.2	I584 R587 V612 F613 F627 H633 I634	I584-L625 HydrophobicContact CG1-CD2 4.27Å; R587-L625 VanDerWaalsContact NH1-CD1 3.29Å; V612-L625 HydrophobicContact CG1-CD2 3.94Å; F613-L625 HydrophobicContact CD1-CB 3.82Å; F613-L625 HydrophobicContact CE1-CB 4.13Å; L625-F627 HydrophobicContact CD2-CE2 3.9Å; L625-F627 HydrophobicContact CD2-CZ 4.14Å; L625-F627 HydrophobicContact CG-CD2 4.47Å; L625-F627 HydrophobicContact CG-CE2 3.96Å; L625-H633 WeakPolarHBondContact O-CA 3.34Å; L625-I634 HydrophobicContact CB-CB 4.23Å; L625-I634 HydrophobicContact CB-CG1 4.5Å; L625-I634 PolarHBondContact N-O 3.21Å; L625-I634 PolarHBondContact O-N 2.9Å
626	V	90.8	Very high	87.4	Confident	62 Å²	62	68 Å²	68	38%	0.376	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132	-178.5	176.8	0	0	0	0	110.4	P628 H633	V626-P628 WeakPolarHBondContact O-CD 3.31Å; V626-H633 WeakPolarHBondContact CG1-NE2 3.39Å; V626-H633 WeakPolarHBondContact CG2-NE2 3.36Å
627	F	92.6	Very high	87.9	Confident	28 Å²	28	65.2 Å²	65.2	12%	0.123	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	100.3	167.9	-69.2	-101.7	0	0	0	108.9	A580 A583 L625 Q629 N630 N631 L632 I634	A580-F627 HydrophobicContact CB-CE1 4.35Å; A580-F627 HydrophobicContact CB-CE2 4.09Å; A580-F627 HydrophobicContact CB-CZ 3.84Å; A583-F627 HydrophobicContact CB-CE1 3.93Å; A583-F627 HydrophobicContact CB-CZ 4.09Å; L625-F627 HydrophobicContact CD2-CE2 3.9Å; L625-F627 HydrophobicContact CD2-CZ 4.14Å; L625-F627 HydrophobicContact CG-CD2 4.47Å; L625-F627 HydrophobicContact CG-CE2 3.96Å; F627-Q629 PolarHBondContact O-N 2.95Å; F627-Q629 VanDerWaalsContact O-N 3.09Å; F627-N630 WeakPolarHBondContact CB-OD1 3.35Å; F627-N630 PolarHBondContact O-N 2.83Å; F627-N630 PolarHBondContact O-OD1 2.93Å; F627-N631 WeakPolarHBondContact O-CA 3.09Å; F627-N631 PolarHBondContact O-N 3.01Å; F627-L632 HydrophobicContact CB-CB 4.18Å; F627-L632 HydrophobicContact CD2-CB 4.44Å; F627-L632 HydrophobicContact CD2-CD2 4.03Å; F627-L632 HydrophobicContact CD2-CG 4.43Å; F627-L632 HydrophobicContact CE2-CD2 4.39Å; F627-L632 HydrophobicContact CG-CD2 4.48Å; F627-L632 PolarHBondContact N-O 2.83Å; F627-I634 HydrophobicContact CD2-CG1 4.46Å; F627-I634 HydrophobicContact CE2-CD1 4.41Å; F627-I634 HydrophobicContact CE2-CG1 3.87Å
628	P	88.7	Confident	88.5	Confident	103 Å²	103	58.5 Å²	58.5	67%	0.669	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-6.1	-171.5	29.3	-36.9	0	0	0	114.4	V626	V626-P628 WeakPolarHBondContact O-CD 3.31Å
629	Q	89.7	Confident	89	Confident	124 Å²	124	56.2 Å²	56.2	58%	0.579	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-34.8	178	-66.4	178.9	-10.4	0	0	112.2	K569 S572 V573 F627	K569-Q629 WeakPolarHBondContact CB-O 3.42Å; S572-Q629 PolarHBondContact OG-O 2.89Å; V573-Q629 HydrophobicContact CG2-CB 3.97Å; F627-Q629 PolarHBondContact O-N 2.95Å; F627-Q629 VanDerWaalsContact O-N 3.09Å
630	N	91.1	Very high	89.5	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.016	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.7	4.7	-175.1	65.9	-8.9	0	0	0	114.3	F556 K569 V573 F576 F627 L632	F556-N630 VanDerWaalsContact CD1-O 3.28Å; F556-N630 WeakPolarHBondContact CD1-O 3.44Å; F556-N630 HydrophobicContact CE1-CB 4.22Å; K569-N630 VanDerWaalsContact O-CA 3.27Å; K569-N630 WeakPolarHBondContact O-CA 3.3Å; K569-N630 VanDerWaalsContact O-CB 3.29Å; K569-N630 WeakPolarHBondContact O-CB 3.25Å; V573-N630 HydrophobicContact CB-CB 4.5Å; V573-N630 HydrophobicContact CG2-CB 4.15Å; F576-N630 WeakPolarHBondContact CB-ND2 3.48Å; F627-N630 WeakPolarHBondContact CB-OD1 3.35Å; F627-N630 PolarHBondContact O-N 2.83Å; F627-N630 PolarHBondContact O-OD1 2.93Å; N630-L632 PolarHBondContact O-N 2.82Å; N630-L632 VanDerWaalsContact OD1-CB 3.25Å; N630-L632 WeakPolarHBondContact OD1-CB 3.42Å; N630-L632 PolarHBondContact OD1-N 2.68Å; N630-L632 VanDerWaalsContact OD1-N 3.13Å
631	N	90.8	Very high	89.9	Confident	33 Å²	33	54.4 Å²	54.4	18%	0.176	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	25.2	-174.8	-57.4	-11.8	0	0	0	114.3	D557 V558 F627 H633	D557-N631 PolarHBondContact N-O 2.88Å; V558-N631 HydrophobicContact CG2-CB 3.96Å; F627-N631 WeakPolarHBondContact O-CA 3.09Å; F627-N631 PolarHBondContact O-N 3.01Å; N631-H633 PolarHBondContact O-CD2 2.81Å; N631-H633 PolarHBondContact O-N 2.9Å
632	L	94.3	Very high	90.1	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	122.7	171.3	179.2	77.3	0	0	0	110	W554 F556 F576 A580 F627 N630 I634	W554-L632 HydrophobicContact CB-CD1 4.03Å; W554-L632 HydrophobicContact CD2-CD1 4.13Å; W554-L632 HydrophobicContact CE3-CD1 3.73Å; W554-L632 HydrophobicContact CG-CD1 4.29Å; F556-L632 HydrophobicContact CD1-CB 4.22Å; F556-L632 HydrophobicContact CD1-CD1 4.42Å; F556-L632 HydrophobicContact CD2-CD1 4.21Å; F556-L632 HydrophobicContact CE1-CB 3.91Å; F556-L632 HydrophobicContact CE1-CD1 4.11Å; F556-L632 HydrophobicContact CE2-CD1 3.88Å; F556-L632 HydrophobicContact CG-CD1 4.5Å; F556-L632 HydrophobicContact CZ-CB 4.4Å; F556-L632 HydrophobicContact CZ-CD1 3.83Å; F576-L632 HydrophobicContact CD2-CD1 3.79Å; F576-L632 HydrophobicContact CD2-CD2 3.78Å; F576-L632 HydrophobicContact CD2-CG 4.38Å; F576-L632 HydrophobicContact CE2-CD1 3.9Å; A580-L632 HydrophobicContact CB-CD2 3.74Å; F627-L632 HydrophobicContact CB-CB 4.18Å; F627-L632 HydrophobicContact CD2-CB 4.44Å; F627-L632 HydrophobicContact CD2-CD2 4.03Å; F627-L632 HydrophobicContact CD2-CG 4.43Å; F627-L632 HydrophobicContact CE2-CD2 4.39Å; F627-L632 HydrophobicContact CG-CD2 4.48Å; F627-L632 PolarHBondContact N-O 2.83Å; N630-L632 PolarHBondContact O-N 2.82Å; N630-L632 VanDerWaalsContact OD1-CB 3.25Å; N630-L632 WeakPolarHBondContact OD1-CB 3.42Å; N630-L632 PolarHBondContact OD1-N 2.68Å; N630-L632 VanDerWaalsContact OD1-N 3.13Å; L632-I634 HydrophobicContact CD2-CD1 4.13Å; L632-I634 HydrophobicContact CG-CD1 4.3Å
633	H	93.7	Very high	90.1	Very high	18 Å²	18	53.2 Å²	53.2	8%	0.083	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.1	177.1	-72.5	-167.8	0	0	0	109.5	W554 V555 D557 L625 V626 N631	W554-H633 CarbonylContact C-O 3.56Å; W554-H633 VanDerWaalsContact CA-O 3.24Å; W554-H633 WeakPolarHBondContact CA-O 3.44Å; V555-H633 HydrophobicContact CG1-CB 4.1Å; V555-H633 PolarHBondContact N-O 3.38Å; V555-H633 PolarHBondContact O-N 2.99Å; D557-H633 WeakPolarHBondContact CB-CE1 3.33Å; D557-H633 WeakPolarHBondContact CB-ND1 3.34Å; D557-H633 IonicContact OD2-CE1 3.97Å; D557-H633 PolarHBondContact OD2-CE1 3.23Å; D557-H633 IonicContact OD2-ND1 3.56Å; D557-H633 PolarHBondContact OD2-ND1 2.86Å; L625-H633 WeakPolarHBondContact O-CA 3.34Å; V626-H633 WeakPolarHBondContact CG1-NE2 3.39Å; V626-H633 WeakPolarHBondContact CG2-NE2 3.36Å; N631-H633 PolarHBondContact O-CD2 2.81Å; N631-H633 PolarHBondContact O-N 2.9Å
634	I	93.4	Very high	90.1	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	122.1	167.1	-47.7	-59.7	0	0	0	107.6	N553 W554 I584 F613 R624 L625 F627 L632 V637	N553-I634 CarbonylContact O-C 3.37Å; N553-I634 WeakPolarHBondContact O-CA 3.12Å; W554-I634 HydrophobicContact CB-CD1 3.74Å; I584-I634 HydrophobicContact CD1-CD1 4.43Å; I584-I634 HydrophobicContact CD1-CG1 4.21Å; F613-I634 HydrophobicContact CE1-CB 4.36Å; F613-I634 HydrophobicContact CE1-CG2 4.13Å; F613-I634 WeakPolarHBondContact CE1-O 3.31Å; F613-I634 HydrophobicContact CZ-CG2 4.43Å; R624-I634 CarbonylContact C-O 3.51Å; R624-I634 VanDerWaalsContact CA-O 3.23Å; R624-I634 WeakPolarHBondContact CA-O 3.47Å; R624-I634 WeakPolarHBondContact CB-O 3.37Å; L625-I634 HydrophobicContact CB-CB 4.23Å; L625-I634 HydrophobicContact CB-CG1 4.5Å; L625-I634 PolarHBondContact N-O 3.21Å; L625-I634 PolarHBondContact O-N 2.9Å; F627-I634 HydrophobicContact CD2-CG1 4.46Å; F627-I634 HydrophobicContact CE2-CD1 4.41Å; F627-I634 HydrophobicContact CE2-CG1 3.87Å; L632-I634 HydrophobicContact CD2-CD1 4.13Å; L632-I634 HydrophobicContact CG-CD1 4.3Å; I634-V637 HydrophobicContact CG2-CG2 4.37Å
635	T	91.1	Very high	89.9	Confident	68 Å²	68	44.4 Å²	44.4	42%	0.417	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-29.2	-170.8	55.5	0	0	0	0	113.5	N553 V555	N553-T635 PolarHBondContact O-N 3.2Å; N553-T635 PolarHBondContact O-OG1 2.87Å; V555-T635 HydrophobicContact CG1-CG2 3.98Å
636	S	91.1	Very high	89.5	Confident	27 Å²	27	47.4 Å²	47.4	19%	0.189	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	161.5	167.7	81.6	0	0	0	0	112	N553 D638	N553-S636 PolarHBondContact N-O 3.24Å; N553-S636 PolarHBondContact ND2-OG 3.11Å; S636-D638 PolarHBondContact OG-OD1 3.01Å
637	V	90.5	Very high	89	Confident	5 Å²	5	49 Å²	49	3%	0.03	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	114.5	174.3	180	0	0	0	0	107.7	S551 Y552 I608 R609 V612 F613 I634	S551-V637 CarbonylContact O-C 3.55Å; S551-V637 WeakPolarHBondContact O-CA 3.35Å; Y552-V637 HydrophobicContact CD1-CB 4.48Å; Y552-V637 HydrophobicContact CD1-CG1 3.96Å; Y552-V637 HydrophobicContact CD1-CG2 4.06Å; Y552-V637 HydrophobicContact CE1-CG1 4.01Å; I608-V637 HydrophobicContact CG2-CG1 3.97Å; R609-V637 HydrophobicContact CG-CB 4.49Å; V612-V637 HydrophobicContact CB-CG2 4.07Å; V612-V637 HydrophobicContact CG1-CG2 3.87Å; V612-V637 HydrophobicContact CG2-CG2 4.12Å; F613-V637 HydrophobicContact CE1-CG2 4.36Å; F613-V637 HydrophobicContact CE2-CB 4.49Å; F613-V637 HydrophobicContact CE2-CG2 4Å; F613-V637 HydrophobicContact CZ-CG2 3.71Å; I634-V637 HydrophobicContact CG2-CG2 4.37Å
638	D	91.2	Very high	88.5	Confident	72 Å²	72	57.1 Å²	57.1	39%	0.385	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.6	-178.1	-48.7	-36.8	0	0	0	108.9	S551 N553 S636 Q640	S551-D638 PolarHBondContact N-O 3.21Å; S551-D638 PolarHBondContact O-N 3.33Å; N553-D638 PolarHBondContact ND2-OD2 3.31Å; N553-D638 VanDerWaalsContact ND2-OD2 3.13Å; S636-D638 PolarHBondContact OG-OD1 3.01Å; D638-Q640 PolarHBondContact O-N 2.93Å
639	V	88.9	Confident	87.8	Confident	43 Å²	43	55.4 Å²	55.4	26%	0.261	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	105	179.8	-174.1	0	0	0	0	107.7	L550 I608 V642	L550-V639 HydrophobicContact CD2-CB 4.31Å; L550-V639 HydrophobicContact CD2-CG1 4.13Å; L550-V639 HydrophobicContact CD2-CG2 3.98Å; I608-V639 HydrophobicContact CB-CG2 4.26Å; I608-V639 HydrophobicContact CD1-CG1 4.02Å; I608-V639 HydrophobicContact CD1-CG2 3.62Å; I608-V639 HydrophobicContact CG2-CG2 4.22Å; V639-V642 HydrophobicContact CG1-CG2 3.54Å
640	Q	88.3	Confident	87	Confident	95 Å²	95	53 Å²	53	44%	0.444	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-42	-175.3	-63.4	-171.4	-19.7	0	0	112.1	Q549 D638	Q549-Q640 HydrophobicContact CB-CB 4.27Å; Q549-Q640 HydrophobicContact CG-CB 4.12Å; Q549-Q640 PolarHBondContact O-N 3.23Å; D638-Q640 PolarHBondContact O-N 2.93Å
641	S	88.9	Confident	86.4	Confident	30 Å²	30	56.7 Å²	56.7	21%	0.21	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	153.1	172.5	68	0	0	0	0	112	Q549	Q549-S641 WeakPolarHBondContact CB-OG 3.45Å; Q549-S641 PolarHBondContact N-O 3.09Å; Q549-S641 PolarHBondContact O-N 2.74Å
642	V	87.2	Confident	85.8	Confident	38 Å²	38	58.3 Å²	58.3	23%	0.23	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	99.6	174	178.8	0	0	0	0	106.6	L546 L548 F600 V639	L546-V642 HydrophobicContact CD1-CG1 4.27Å; L548-V642 HydrophobicContact CD2-CB 4.23Å; L548-V642 HydrophobicContact CD2-CG1 3.76Å; L548-V642 HydrophobicContact CD2-CG2 3.95Å; F600-V642 HydrophobicContact CE1-CG1 3.88Å; V639-V642 HydrophobicContact CG1-CG2 3.54Å
643	E	87.2	Confident	85	Confident	98 Å²	98	60.7 Å²	60.7	46%	0.458	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.5	-173.2	-70.2	-179.6	-161	0	0	111.2	L546 S547 V645	L546-E643 CarbonylContact C-O 3.46Å; L546-E643 WeakPolarHBondContact CA-O 3.5Å; S547-E643 PolarHBondContact N-O 2.89Å; S547-E643 PolarHBondContact O-N 3.14Å; E643-V645 PolarHBondContact O-N 3.15Å
644	P	84.8	Confident	84.2	Confident	15 Å²	15	66.5 Å²	66.5	10%	0.097	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	130.7	167.3	-18.6	27.9	0	0	0	110.8	L546 D646 T649 R650	L546-P644 HydrophobicContact CD2-CB 4.31Å; L546-P644 HydrophobicContact CD2-CG 4.42Å; P644-D646 VanDerWaalsContact C-N 3.33Å; P644-T649 WeakPolarHBondContact CB-OG1 3.33Å; P644-R650 HydrophobicContact CB-CG 4.04Å; P644-R650 HydrophobicContact CG-CG 3.99Å; P644-R650 VanDerWaalsContact O-CD 3.32Å; P644-R650 WeakPolarHBondContact O-CD 3.41Å; P644-R650 WeakPolarHBondContact O-CG 3.31Å; P644-R650 PolarHBondContact O-NE 3.34Å
645	V	83.4	Confident	83.6	Confident	50 Å²	50	72.9 Å²	72.9	30%	0.303	37%	0.369	S	S	.	.	S	Bend	trans	-66.5	-41.1	177.6	176	0	0	0	0	110	I537 R545 E643 R650	I537-V645 HydrophobicContact CG2-CG2 4.31Å; R545-V645 HydrophobicContact CB-CB 4.17Å; R545-V645 HydrophobicContact CB-CG2 4.21Å; R545-V645 WeakPolarHBondContact O-CG2 3.47Å; R545-V645 PolarHBondContact O-N 2.96Å; E643-V645 PolarHBondContact O-N 3.15Å; V645-R650 PolarHBondContact O-NH2 3.2Å
646	D	82.1	Confident	82.9	Confident	80 Å²	80	73.3 Å²	73.3	43%	0.428	38%	0.375	S	S	.	.	S	Bend	trans	-65.4	135.2	174.7	164.5	54.6	0	0	0	111.6	P644 R648 T649 R650	P644-D646 VanDerWaalsContact C-N 3.33Å; D646-R648 PolarHBondContact OD1-N 3.22Å; D646-R648 PolarHBondContact OD2-N 2.74Å; D646-T649 WeakPolarHBondContact CB-OG1 3.49Å; D646-T649 PolarHBondContact O-OG1 2.69Å; D646-T649 VanDerWaalsContact O-OG1 3.08Å; D646-T649 WeakPolarHBondContact OD2-CB 3.48Å; D646-T649 WeakPolarHBondContact OD2-CG2 3.45Å; D646-T649 PolarHBondContact OD2-N 2.74Å; D646-T649 PolarHBondContact OD2-OG1 3.28Å; D646-R650 PolarHBondContact O-N 2.66Å
647	Q	81.1	Confident	82	Confident	95 Å²	95	75.6 Å²	75.6	44%	0.444	39%	0.387	S	S	.	.	H	α-helix	trans	-71.9	-38.9	-178.9	-172.2	67.2	49.7	0	0	111.1	T649 R650 D651	Q647-T649 VanDerWaalsContact C-N 3.34Å; Q647-T649 PolarHBondContact O-N 2.9Å; Q647-R650 WeakPolarHBondContact O-CB 3.44Å; Q647-R650 PolarHBondContact O-N 2.91Å; Q647-R650 VanDerWaalsContact O-N 3.16Å; Q647-D651 PolarHBondContact NE2-OD1 3.07Å; Q647-D651 PolarHBondContact O-N 3.31Å
648	R	81.8	Confident	81.5	Confident	199 Å²	199	81.7 Å²	81.7	75%	0.751	42%	0.415	S	S	*	.	H	α-helix	trans	-64.6	-39.6	-175.8	-176.9	179.8	178.4	179.4	-0.1	111.7	D646 S652	D646-R648 PolarHBondContact OD1-N 3.22Å; D646-R648 PolarHBondContact OD2-N 2.74Å; R648-S652 VanDerWaalsContact O-CB 3.28Å; R648-S652 WeakPolarHBondContact O-CB 3.4Å; R648-S652 PolarHBondContact O-N 2.79Å; R648-S652 PolarHBondContact O-OG 2.91Å
649	T	73.3	Confident	81.1	Confident	67 Å²	67	82.2 Å²	82.2	41%	0.411	42%	0.418	S	S	.	.	H	α-helix	trans	-67.7	-40.9	173	41.2	0	0	0	0	112.2	P644 D646 Q647 S652 L653	P644-T649 WeakPolarHBondContact CB-OG1 3.33Å; D646-T649 WeakPolarHBondContact CB-OG1 3.49Å; D646-T649 PolarHBondContact O-OG1 2.69Å; D646-T649 VanDerWaalsContact O-OG1 3.08Å; D646-T649 WeakPolarHBondContact OD2-CB 3.48Å; D646-T649 WeakPolarHBondContact OD2-CG2 3.45Å; D646-T649 PolarHBondContact OD2-N 2.74Å; D646-T649 PolarHBondContact OD2-OG1 3.28Å; Q647-T649 VanDerWaalsContact C-N 3.34Å; Q647-T649 PolarHBondContact O-N 2.9Å; T649-S652 PolarHBondContact O-N 3.46Å; T649-L653 VanDerWaalsContact O-CB 3.29Å; T649-L653 WeakPolarHBondContact O-CB 3.49Å; T649-L653 PolarHBondContact O-N 2.89Å
650	R	72.5	Confident	80.6	Confident	74 Å²	74	82.6 Å²	82.6	28%	0.279	43%	0.425	S	S	.	.	H	α-helix	trans	-57.3	-51.2	171.5	-94.1	-174.3	-73	123.9	9	112.5	P644 V645 D646 Q647 S652 L653 Q654	P644-R650 HydrophobicContact CB-CG 4.04Å; P644-R650 HydrophobicContact CG-CG 3.99Å; P644-R650 VanDerWaalsContact O-CD 3.32Å; P644-R650 WeakPolarHBondContact O-CD 3.41Å; P644-R650 WeakPolarHBondContact O-CG 3.31Å; P644-R650 PolarHBondContact O-NE 3.34Å; V645-R650 PolarHBondContact O-NH2 3.2Å; D646-R650 PolarHBondContact O-N 2.66Å; Q647-R650 WeakPolarHBondContact O-CB 3.44Å; Q647-R650 PolarHBondContact O-N 2.91Å; Q647-R650 VanDerWaalsContact O-N 3.16Å; R650-S652 VanDerWaalsContact C-N 3.32Å; R650-S652 PolarHBondContact O-N 3.1Å; R650-L653 PolarHBondContact O-N 3.41Å; R650-Q654 PolarHBondContact O-N 2.84Å
651	D	79.9	Confident	79.9	Confident	79 Å²	79	82.8 Å²	82.8	42%	0.422	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-40.3	-179.1	-58.9	-16.5	0	0	0	111.4	Q647 K655	Q647-D651 PolarHBondContact NE2-OD1 3.07Å; Q647-D651 PolarHBondContact O-N 3.31Å; D651-K655 WeakPolarHBondContact O-CB 3.33Å; D651-K655 PolarHBondContact O-N 2.95Å
652	S	78.2	Confident	79.5	Confident	67 Å²	67	86.2 Å²	86.2	47%	0.469	44%	0.441	S	S	.	.	H	α-helix	trans	-65.2	-38.9	176.6	-58.2	0	0	0	0	112	R648 T649 R650 K655 S656	R648-S652 VanDerWaalsContact O-CB 3.28Å; R648-S652 WeakPolarHBondContact O-CB 3.4Å; R648-S652 PolarHBondContact O-N 2.79Å; R648-S652 PolarHBondContact O-OG 2.91Å; T649-S652 PolarHBondContact O-N 3.46Å; R650-S652 VanDerWaalsContact C-N 3.32Å; R650-S652 PolarHBondContact O-N 3.1Å; S652-K655 PolarHBondContact O-N 3.44Å; S652-S656 WeakPolarHBondContact O-CB 3.24Å; S652-S656 PolarHBondContact O-N 2.76Å
653	L	75.7	Confident	79	Confident	52 Å²	52	89.9 Å²	89.9	27%	0.272	46%	0.458	S	S	.	.	H	α-helix	trans	-71.9	-40.9	179.7	-162.8	148.8	0	0	0	111.3	F597 T649 R650 K655 S656 V657	F597-L653 HydrophobicContact CZ-CD1 4.08Å; T649-L653 VanDerWaalsContact O-CB 3.29Å; T649-L653 WeakPolarHBondContact O-CB 3.49Å; T649-L653 PolarHBondContact O-N 2.89Å; R650-L653 PolarHBondContact O-N 3.41Å; L653-K655 PolarHBondContact O-N 3.08Å; L653-S656 WeakPolarHBondContact O-CB 3.47Å; L653-S656 PolarHBondContact O-N 3.33Å; L653-V657 HydrophobicContact CD2-CG2 4.33Å; L653-V657 WeakPolarHBondContact O-CG2 3.22Å; L653-V657 PolarHBondContact O-N 2.73Å
654	Q	78.8	Confident	78.8	Confident	141 Å²	141	89.2 Å²	89.2	66%	0.659	46%	0.461	S	S	*	.	H	α-helix	trans	-58.8	-45.1	170.7	-76.4	-171.6	-18.4	0	0	112.1	R650 S656 V657 Q658	R650-Q654 PolarHBondContact O-N 2.84Å; Q654-S656 VanDerWaalsContact C-N 3.3Å; Q654-S656 PolarHBondContact O-N 3.43Å; Q654-V657 PolarHBondContact O-N 2.68Å; Q654-Q658 PolarHBondContact O-N 2.78Å
655	K	79.1	Confident	78.7	Confident	136 Å²	136	91.7 Å²	91.7	59%	0.591	48%	0.476	S	S	*	.	H	α-helix	trans	-62.7	-36.4	176.3	-169.2	173.2	-176.3	176.9	0	112.4	D651 S652 L653 Q658 L659	D651-K655 WeakPolarHBondContact O-CB 3.33Å; D651-K655 PolarHBondContact O-N 2.95Å; S652-K655 PolarHBondContact O-N 3.44Å; L653-K655 PolarHBondContact O-N 3.08Å; K655-Q658 PolarHBondContact O-N 3.4Å; K655-L659 HydrophobicContact CG-CD1 4.47Å; K655-L659 WeakPolarHBondContact O-CG 3.31Å; K655-L659 PolarHBondContact O-N 3.03Å; K655-L659 VanDerWaalsContact O-N 3.09Å
656	S	76.1	Confident	78.8	Confident	76 Å²	76	93.5 Å²	93.5	53%	0.531	48%	0.484	S	S	.	.	H	α-helix	trans	-64.2	-42	174.2	-165.5	0	0	0	0	112.2	S652 L653 Q654 L659 A660	S652-S656 WeakPolarHBondContact O-CB 3.24Å; S652-S656 PolarHBondContact O-N 2.76Å; L653-S656 WeakPolarHBondContact O-CB 3.47Å; L653-S656 PolarHBondContact O-N 3.33Å; Q654-S656 VanDerWaalsContact C-N 3.3Å; Q654-S656 PolarHBondContact O-N 3.43Å; S656-L659 PolarHBondContact O-N 3.23Å; S656-A660 WeakPolarHBondContact O-CB 3.21Å; S656-A660 PolarHBondContact O-N 2.77Å
657	V	74	Confident	79	Confident	76 Å²	76	93.3 Å²	93.3	46%	0.461	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-41.8	175.5	173.3	0	0	0	0	111.5	L653 Q654 L659 A660 I661	L653-V657 HydrophobicContact CD2-CG2 4.33Å; L653-V657 WeakPolarHBondContact O-CG2 3.22Å; L653-V657 PolarHBondContact O-N 2.73Å; Q654-V657 PolarHBondContact O-N 2.68Å; V657-L659 PolarHBondContact O-N 3.01Å; V657-A660 PolarHBondContact O-N 3.25Å; V657-I661 HydrophobicContact CG1-CD1 4.14Å; V657-I661 WeakPolarHBondContact O-CG1 3.49Å; V657-I661 PolarHBondContact O-N 3.02Å
658	Q	80	Confident	79.1	Confident	132 Å²	132	95.6 Å²	95.6	62%	0.617	50%	0.5	S	S	*	.	H	α-helix	trans	-59.1	-47.9	175.6	-176.2	-179.5	3.5	0	0	111.7	Q654 K655 A660 I661 E662	Q654-Q658 PolarHBondContact O-N 2.78Å; K655-Q658 PolarHBondContact O-N 3.4Å; Q658-A660 VanDerWaalsContact C-N 3.33Å; Q658-A660 PolarHBondContact O-N 2.76Å; Q658-I661 PolarHBondContact O-N 2.71Å; Q658-E662 PolarHBondContact O-N 3.2Å
659	L	82.4	Confident	79.1	Confident	83 Å²	83	90.6 Å²	90.6	44%	0.435	49%	0.485	S	S	.	.	H	α-helix	trans	-63.7	-37.2	177	-70.1	168.9	0	0	0	112.1	K655 S656 V657 E662 I663	K655-L659 HydrophobicContact CG-CD1 4.47Å; K655-L659 WeakPolarHBondContact O-CG 3.31Å; K655-L659 PolarHBondContact O-N 3.03Å; K655-L659 VanDerWaalsContact O-N 3.09Å; S656-L659 PolarHBondContact O-N 3.23Å; V657-L659 PolarHBondContact O-N 3.01Å; L659-E662 PolarHBondContact O-N 3.24Å; L659-I663 WeakPolarHBondContact O-CB 3.16Å; L659-I663 WeakPolarHBondContact O-CD1 3.13Å; L659-I663 WeakPolarHBondContact O-CG1 3.33Å; L659-I663 PolarHBondContact O-N 3.18Å
660	A	78.6	Confident	79.7	Confident	51 Å²	51	89.5 Å²	89.5	42%	0.421	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-43	175.9	0	0	0	0	0	111.9	S656 V657 Q658 I663 T664	S656-A660 WeakPolarHBondContact O-CB 3.21Å; S656-A660 PolarHBondContact O-N 2.77Å; V657-A660 PolarHBondContact O-N 3.25Å; Q658-A660 VanDerWaalsContact C-N 3.33Å; Q658-A660 PolarHBondContact O-N 2.76Å; A660-I663 PolarHBondContact O-N 2.96Å; A660-T664 WeakPolarHBondContact O-CG2 3.47Å; A660-T664 PolarHBondContact O-N 3Å; A660-T664 PolarHBondContact O-OG1 3.33Å; A660-T664 VanDerWaalsContact O-OG1 3.07Å
661	I	71.9	Confident	80.3	Confident	99 Å²	99	88.6 Å²	88.6	51%	0.508	49%	0.491	S	S	.	.	H	α-helix	trans	-60.3	-50.3	174.6	-66.9	167.2	0	0	0	109.9	V657 Q658 I663 T664 T665	V657-I661 HydrophobicContact CG1-CD1 4.14Å; V657-I661 WeakPolarHBondContact O-CG1 3.49Å; V657-I661 PolarHBondContact O-N 3.02Å; Q658-I661 PolarHBondContact O-N 2.71Å; I661-I663 PolarHBondContact O-N 3.22Å; I661-T664 PolarHBondContact O-N 3.05Å; I661-T664 PolarHBondContact O-OG1 3.13Å; I661-T665 PolarHBondContact O-N 2.82Å; I661-T665 PolarHBondContact O-OG1 2.78Å; I661-T665 VanDerWaalsContact O-OG1 3.1Å
662	E	80.5	Confident	80.4	Confident	103 Å²	103	87.9 Å²	87.9	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-56.3	-46.6	178.2	-174.4	178	-180	0	0	112.6	Q658 L659 T665 N666	Q658-E662 PolarHBondContact O-N 3.2Å; L659-E662 PolarHBondContact O-N 3.24Å; E662-T665 PolarHBondContact O-N 2.87Å; E662-N666 VanDerWaalsContact O-CB 3.32Å; E662-N666 WeakPolarHBondContact O-CB 3.42Å; E662-N666 VanDerWaalsContact O-CG 3.24Å; E662-N666 PolarHBondContact O-N 2.89Å; E662-N666 PolarHBondContact O-ND2 2.84Å
663	I	78.3	Confident	80.6	Confident	114 Å²	114	92.5 Å²	92.5	59%	0.585	50%	0.503	S	S	*	.	H	α-helix	trans	-63.3	-45.2	177.2	-68.8	164.1	0	0	0	111.1	L659 A660 I661 S667	L659-I663 WeakPolarHBondContact O-CB 3.16Å; L659-I663 WeakPolarHBondContact O-CD1 3.13Å; L659-I663 WeakPolarHBondContact O-CG1 3.33Å; L659-I663 PolarHBondContact O-N 3.18Å; A660-I663 PolarHBondContact O-N 2.96Å; I661-I663 PolarHBondContact O-N 3.22Å; I663-S667 WeakPolarHBondContact O-CB 3.3Å; I663-S667 PolarHBondContact O-N 2.8Å
664	T	82.2	Confident	81	Confident	84 Å²	84	96 Å²	96	52%	0.515	52%	0.518	S	S	.	.	H	α-helix	trans	-66	-40.8	179.5	55.9	0	0	0	0	112.5	A660 I661 S667 Q668	A660-T664 WeakPolarHBondContact O-CG2 3.47Å; A660-T664 PolarHBondContact O-N 3Å; A660-T664 PolarHBondContact O-OG1 3.33Å; A660-T664 VanDerWaalsContact O-OG1 3.07Å; I661-T664 PolarHBondContact O-N 3.05Å; I661-T664 PolarHBondContact O-OG1 3.13Å; T664-S667 PolarHBondContact O-N 2.84Å; T664-Q668 VanDerWaalsContact O-CG 3.27Å; T664-Q668 WeakPolarHBondContact O-CG 3.18Å; T664-Q668 PolarHBondContact O-N 2.85Å
665	T	82.2	Confident	81	Confident	68 Å²	68	94 Å²	94	42%	0.417	51%	0.509	S	S	.	.	H	α-helix	trans	-64.5	-51.1	176.7	-58.8	0	0	0	0	110.9	I661 E662 S667 Q668 E669	I661-T665 PolarHBondContact O-N 2.82Å; I661-T665 PolarHBondContact O-OG1 2.78Å; I661-T665 VanDerWaalsContact O-OG1 3.1Å; E662-T665 PolarHBondContact O-N 2.87Å; T665-S667 VanDerWaalsContact C-N 3.27Å; T665-S667 PolarHBondContact O-N 3.48Å; T665-Q668 PolarHBondContact O-N 2.68Å; T665-Q668 VanDerWaalsContact O-N 3.16Å; T665-E669 PolarHBondContact O-N 2.88Å
666	N	85.3	Confident	81.2	Confident	88 Å²	88	90.4 Å²	90.4	47%	0.471	50%	0.504	S	S	.	.	H	α-helix	trans	-59.3	-37.6	177.2	-72.4	-25.1	0	0	0	112.1	E662 A670	E662-N666 VanDerWaalsContact O-CB 3.32Å; E662-N666 WeakPolarHBondContact O-CB 3.42Å; E662-N666 VanDerWaalsContact O-CG 3.24Å; E662-N666 PolarHBondContact O-N 2.89Å; E662-N666 PolarHBondContact O-ND2 2.84Å; N666-A670 WeakPolarHBondContact O-CB 3.43Å; N666-A670 PolarHBondContact O-N 3.13Å
667	S	86.1	Confident	81.7	Confident	76 Å²	76	92.8 Å²	92.8	53%	0.531	51%	0.507	S	S	.	.	H	α-helix	trans	-68.7	-38.3	176.9	-174.2	0	0	0	0	113.1	I663 T664 T665 A671	I663-S667 WeakPolarHBondContact O-CB 3.3Å; I663-S667 PolarHBondContact O-N 2.8Å; T664-S667 PolarHBondContact O-N 2.84Å; T665-S667 VanDerWaalsContact C-N 3.27Å; T665-S667 PolarHBondContact O-N 3.48Å; S667-A671 WeakPolarHBondContact O-CB 3.5Å; S667-A671 PolarHBondContact O-N 3.08Å; S667-A671 VanDerWaalsContact O-N 3.11Å
668	Q	83.6	Confident	82.2	Confident	142 Å²	142	95 Å²	95	66%	0.664	51%	0.507	S	S	*	.	H	α-helix	trans	-70.2	-42.3	176.6	-71.5	-69.4	-15.7	0	0	111.3	T664 T665 A670 A671 A672	T664-Q668 VanDerWaalsContact O-CG 3.27Å; T664-Q668 WeakPolarHBondContact O-CG 3.18Å; T664-Q668 PolarHBondContact O-N 2.85Å; T665-Q668 PolarHBondContact O-N 2.68Å; T665-Q668 VanDerWaalsContact O-N 3.16Å; Q668-A670 PolarHBondContact O-N 3.28Å; Q668-A671 PolarHBondContact O-N 2.88Å; Q668-A672 WeakPolarHBondContact O-CB 3.03Å; Q668-A672 PolarHBondContact O-N 3.46Å
669	E	82.8	Confident	82.3	Confident	94 Å²	94	93.5 Å²	93.5	44%	0.439	50%	0.503	S	S	.	.	H	α-helix	trans	-61.6	-43.1	175.1	-73.9	-168.1	-164.2	0	0	112.4	T665 A672 R673	T665-E669 PolarHBondContact O-N 2.88Å; E669-A672 PolarHBondContact O-N 2.94Å; E669-R673 WeakPolarHBondContact O-CG 3.35Å; E669-R673 PolarHBondContact O-N 3.21Å; E669-R673 IonicContact OE2-NH2 3.86Å
670	A	84.8	Confident	82.3	Confident	45 Å²	45	94.5 Å²	94.5	37%	0.372	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-44	177.1	0	0	0	0	0	112.1	N666 Q668 R673 H674	N666-A670 WeakPolarHBondContact O-CB 3.43Å; N666-A670 PolarHBondContact O-N 3.13Å; Q668-A670 PolarHBondContact O-N 3.28Å; A670-R673 PolarHBondContact O-N 3.08Å; A670-H674 PolarHBondContact O-CD2 2.79Å; A670-H674 VanDerWaalsContact O-CD2 3.23Å; A670-H674 PolarHBondContact O-N 2.78Å; A670-H674 VanDerWaalsContact O-N 3.14Å
671	A	85.9	Confident	82.5	Confident	55 Å²	55	98.4 Å²	98.4	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-62.1	-46.6	176.6	0	0	0	0	0	112	S667 Q668 R673 H674 E675	S667-A671 WeakPolarHBondContact O-CB 3.5Å; S667-A671 PolarHBondContact O-N 3.08Å; S667-A671 VanDerWaalsContact O-N 3.11Å; Q668-A671 PolarHBondContact O-N 2.88Å; A671-R673 PolarHBondContact O-N 3.46Å; A671-H674 PolarHBondContact O-N 3.32Å; A671-E675 PolarHBondContact O-N 2.76Å
672	A	82.2	Confident	83.1	Confident	63 Å²	63	98.2 Å²	98.2	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-39.9	178.9	0	0	0	0	0	112.7	Q668 E669 A676	Q668-A672 WeakPolarHBondContact O-CB 3.03Å; Q668-A672 PolarHBondContact O-N 3.46Å; E669-A672 PolarHBondContact O-N 2.94Å; A672-A676 WeakPolarHBondContact O-CB 3.29Å; A672-A676 PolarHBondContact O-N 3.03Å; A672-A676 VanDerWaalsContact O-N 3.12Å
673	R	81.8	Confident	83.2	Confident	164 Å²	164	95.8 Å²	95.8	62%	0.619	51%	0.509	S	S	*	.	H	α-helix	trans	-63.6	-48.8	175.6	-75.4	-178.3	-172.7	170.5	10.6	112.2	E669 A670 A671 E675 A676 E677	E669-R673 WeakPolarHBondContact O-CG 3.35Å; E669-R673 PolarHBondContact O-N 3.21Å; E669-R673 IonicContact OE2-NH2 3.86Å; A670-R673 PolarHBondContact O-N 3.08Å; A671-R673 PolarHBondContact O-N 3.46Å; R673-E675 VanDerWaalsContact C-N 3.32Å; R673-E675 PolarHBondContact O-N 2.85Å; R673-A676 PolarHBondContact O-N 2.7Å; R673-E677 WeakPolarHBondContact O-CG 3.45Å; R673-E677 PolarHBondContact O-N 3.15Å
674	H	84.1	Confident	83.4	Confident	127 Å²	127	97.6 Å²	97.6	59%	0.588	51%	0.509	S	S	*	.	H	α-helix	trans	-65.1	-34.1	-179.5	-73.2	-45.3	0	0	0	113.3	A670 A671 E677 R678	A670-H674 PolarHBondContact O-CD2 2.79Å; A670-H674 VanDerWaalsContact O-CD2 3.23Å; A670-H674 PolarHBondContact O-N 2.78Å; A670-H674 VanDerWaalsContact O-N 3.14Å; A671-H674 PolarHBondContact O-N 3.32Å; H674-E677 IonicContact ND1-OE2 2.75Å; H674-R678 WeakPolarHBondContact O-CB 3.33Å; H674-R678 PolarHBondContact O-N 2.8Å; H674-R678 VanDerWaalsContact O-N 3.17Å
675	E	79.3	Confident	83.6	Confident	99 Å²	99	95.5 Å²	95.5	46%	0.463	50%	0.504	S	S	.	.	H	α-helix	trans	-70.3	-38.2	175.6	-173.2	136	-109.1	0	0	112.3	A671 R673 R678 L679	A671-E675 PolarHBondContact O-N 2.76Å; R673-E675 VanDerWaalsContact C-N 3.32Å; R673-E675 PolarHBondContact O-N 2.85Å; E675-R678 PolarHBondContact O-N 2.86Å; E675-R678 IonicContact OE1-CZ 2.83Å; E675-R678 IonicContact OE1-NH1 3.9Å; E675-R678 PolarHBondContact OE1-NH1 2.82Å; E675-R678 VanDerWaalsContact OE1-NH1 3.13Å; E675-R678 IonicContact OE1-NH2 3.66Å; E675-R678 PolarHBondContact OE1-NH2 3.43Å; E675-L679 HydrophobicContact CG-CD1 4.32Å; E675-L679 PolarHBondContact O-N 3.03Å; E675-L679 VanDerWaalsContact O-N 3.15Å
676	A	83	Confident	83.7	Confident	60 Å²	60	100.7 Å²	100.7	50%	0.496	52%	0.516	S	S	.	.	H	α-helix	trans	-63.4	-47.1	174.4	0	0	0	0	0	112.4	A672 R673 R678 L679 E680	A672-A676 WeakPolarHBondContact O-CB 3.29Å; A672-A676 PolarHBondContact O-N 3.03Å; A672-A676 VanDerWaalsContact O-N 3.12Å; R673-A676 PolarHBondContact O-N 2.7Å; A676-R678 VanDerWaalsContact C-N 3.33Å; A676-R678 PolarHBondContact O-N 2.92Å; A676-L679 PolarHBondContact O-N 3.41Å; A676-E680 PolarHBondContact O-N 2.65Å; A676-E680 VanDerWaalsContact O-N 3.09Å
677	E	86.8	Confident	83.6	Confident	125 Å²	125	102.6 Å²	102.6	58%	0.584	53%	0.525	S	S	*	.	H	α-helix	trans	-59.6	-41.7	177.1	-72.8	176.3	162.3	0	0	112.1	R673 H674 Q681	R673-E677 WeakPolarHBondContact O-CG 3.45Å; R673-E677 PolarHBondContact O-N 3.15Å; H674-E677 IonicContact ND1-OE2 2.75Å; E677-Q681 PolarHBondContact O-N 3.24Å
678	R	84.4	Confident	83.5	Confident	124 Å²	124	104.5 Å²	104.5	47%	0.468	53%	0.526	S	S	.	.	H	α-helix	trans	-61.9	-46.4	177.8	-169.2	-175.4	75.2	-131.1	-5.5	111.7	H674 E675 A676 Q681 E682	H674-R678 WeakPolarHBondContact O-CB 3.33Å; H674-R678 PolarHBondContact O-N 2.8Å; H674-R678 VanDerWaalsContact O-N 3.17Å; E675-R678 PolarHBondContact O-N 2.86Å; E675-R678 IonicContact OE1-CZ 2.83Å; E675-R678 IonicContact OE1-NH1 3.9Å; E675-R678 PolarHBondContact OE1-NH1 2.82Å; E675-R678 VanDerWaalsContact OE1-NH1 3.13Å; E675-R678 IonicContact OE1-NH2 3.66Å; E675-R678 PolarHBondContact OE1-NH2 3.43Å; A676-R678 VanDerWaalsContact C-N 3.33Å; A676-R678 PolarHBondContact O-N 2.92Å; R678-Q681 PolarHBondContact O-N 3.43Å; R678-E682 PolarHBondContact O-N 3.29Å
679	L	81.3	Confident	83.4	Confident	100 Å²	100	106.8 Å²	106.8	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-64.6	-40.9	-179.5	-82.1	165	0	0	0	112.7	E675 A676 Q681 E682 A683	E675-L679 HydrophobicContact CG-CD1 4.32Å; E675-L679 PolarHBondContact O-N 3.03Å; E675-L679 VanDerWaalsContact O-N 3.15Å; A676-L679 PolarHBondContact O-N 3.41Å; L679-Q681 VanDerWaalsContact C-N 3.33Å; L679-Q681 PolarHBondContact O-N 3.2Å; L679-E682 PolarHBondContact O-N 2.86Å; L679-A683 WeakPolarHBondContact O-CB 3.3Å; L679-A683 PolarHBondContact O-N 3.04Å
680	E	82.5	Confident	83.5	Confident	103 Å²	103	107.8 Å²	107.8	48%	0.481	53%	0.533	S	S	.	.	H	α-helix	trans	-62.5	-42.4	178.2	-169.8	-179.5	169.3	0	0	111.5	A676 A683 R684	A676-E680 PolarHBondContact O-N 2.65Å; A676-E680 VanDerWaalsContact O-N 3.09Å; E680-A683 PolarHBondContact O-N 2.83Å; E680-R684 WeakPolarHBondContact O-CG 3.2Å; E680-R684 PolarHBondContact O-N 2.66Å; E680-R684 IonicContact OE1-CZ 2.79Å; E680-R684 IonicContact OE1-NE 3.6Å; E680-R684 PolarHBondContact OE1-NE 3.41Å; E680-R684 VanDerWaalsContact OE1-NE 3.13Å; E680-R684 IonicContact OE1-NH2 2.69Å; E680-R684 PolarHBondContact OE1-NH2 2.95Å
681	Q	84.2	Confident	83.5	Confident	133 Å²	133	112.6 Å²	112.6	62%	0.621	54%	0.542	S	S	*	.	H	α-helix	trans	-67.8	-39.8	-178.2	-154.1	73.3	-22.7	0	0	112.4	E677 R678 L679 G685	E677-Q681 PolarHBondContact O-N 3.24Å; R678-Q681 PolarHBondContact O-N 3.43Å; L679-Q681 VanDerWaalsContact C-N 3.33Å; L679-Q681 PolarHBondContact O-N 3.2Å; Q681-G685 PolarHBondContact O-N 2.86Å
682	E	84.7	Confident	83.4	Confident	95 Å²	95	115.2 Å²	115.2	44%	0.444	55%	0.547	S	S	.	.	H	α-helix	trans	-65.8	-40.9	173.8	-74.1	-175.8	-160.9	0	0	112.5	R678 L679 G685 R686	R678-E682 PolarHBondContact O-N 3.29Å; L679-E682 PolarHBondContact O-N 2.86Å; E682-G685 PolarHBondContact O-N 2.97Å; E682-R686 PolarHBondContact O-N 2.9Å; E682-R686 VanDerWaalsContact O-N 3.14Å
683	A	81.6	Confident	83.6	Confident	53 Å²	53	118.8 Å²	118.8	44%	0.438	55%	0.552	S	S	.	*	H	α-helix	trans	-63.4	-45.5	179	0	0	0	0	0	112	L679 E680 G685 R686 L687	L679-A683 WeakPolarHBondContact O-CB 3.3Å; L679-A683 PolarHBondContact O-N 3.04Å; E680-A683 PolarHBondContact O-N 2.83Å; A683-G685 VanDerWaalsContact C-N 3.32Å; A683-G685 PolarHBondContact O-N 2.77Å; A683-R686 PolarHBondContact O-N 3.49Å; A683-L687 PolarHBondContact O-N 2.72Å
684	R	81.7	Confident	83.8	Confident	151 Å²	151	115.7 Å²	115.7	57%	0.57	55%	0.548	S	S	*	.	H	α-helix	trans	-58.7	-43.1	174.3	-71.6	177.2	-180	-155	-0.2	111.8	E680 R686 L687 E688	E680-R684 WeakPolarHBondContact O-CG 3.2Å; E680-R684 PolarHBondContact O-N 2.66Å; E680-R684 IonicContact OE1-CZ 2.79Å; E680-R684 IonicContact OE1-NE 3.6Å; E680-R684 PolarHBondContact OE1-NE 3.41Å; E680-R684 VanDerWaalsContact OE1-NE 3.13Å; E680-R684 IonicContact OE1-NH2 2.69Å; E680-R684 PolarHBondContact OE1-NH2 2.95Å; R684-R686 VanDerWaalsContact C-N 3.35Å; R684-R686 PolarHBondContact O-N 2.88Å; R684-L687 PolarHBondContact O-N 3.29Å; R684-E688 PolarHBondContact O-N 3.02Å
685	G	87.1	Confident	83.9	Confident	40 Å²	40	115.3 Å²	115.3	41%	0.412	55%	0.547	S	S	.	.	H	α-helix	trans	-65.3	-30.7	179.5	0	0	0	0	0	114.9	Q681 E682 A683	Q681-G685 PolarHBondContact O-N 2.86Å; E682-G685 PolarHBondContact O-N 2.97Å; A683-G685 VanDerWaalsContact C-N 3.32Å; A683-G685 PolarHBondContact O-N 2.77Å
686	R	84.6	Confident	84.3	Confident	177 Å²	177	113.3 Å²	113.3	67%	0.668	55%	0.547	S	S	*	.	H	α-helix	trans	-75	-43.2	175	-71	-175.1	-171.4	172.4	7.5	112.5	E682 A683 R684 E688 R689 Q690	E682-R686 PolarHBondContact O-N 2.9Å; E682-R686 VanDerWaalsContact O-N 3.14Å; A683-R686 PolarHBondContact O-N 3.49Å; R684-R686 VanDerWaalsContact C-N 3.35Å; R684-R686 PolarHBondContact O-N 2.88Å; R686-E688 PolarHBondContact O-N 3.12Å; R686-R689 PolarHBondContact O-N 3.25Å; R686-Q690 PolarHBondContact O-N 2.84Å; R686-Q690 VanDerWaalsContact O-N 3.1Å
687	L	82.9	Confident	84.5	Confident	128 Å²	128	113.1 Å²	113.1	67%	0.67	55%	0.545	S	S	*	.	H	α-helix	trans	-57.6	-45.1	-179.7	-96	162.7	0	0	0	112.7	A683 R684 R689 Q690 R691	A683-L687 PolarHBondContact O-N 2.72Å; R684-L687 PolarHBondContact O-N 3.29Å; L687-R689 PolarHBondContact O-N 3.36Å; L687-Q690 PolarHBondContact O-N 2.84Å; L687-R691 WeakPolarHBondContact O-CB 3.2Å; L687-R691 PolarHBondContact O-N 3.16Å; L687-R691 VanDerWaalsContact O-N 3.15Å
688	E	84.4	Confident	84.6	Confident	116 Å²	116	109.8 Å²	109.8	54%	0.542	54%	0.54	S	S	.	.	H	α-helix	trans	-62.1	-40.8	177.7	-81.1	-68.9	129.7	0	0	112.7	R684 R686 I692	R684-E688 PolarHBondContact O-N 3.02Å; R686-E688 PolarHBondContact O-N 3.12Å; E688-I692 WeakPolarHBondContact O-CG1 3Å; E688-I692 PolarHBondContact O-N 3.41Å
689	R	82.1	Confident	84.6	Confident	190 Å²	190	108.6 Å²	108.6	72%	0.717	54%	0.539	S	S	*	.	H	α-helix	trans	-66.1	-48.1	178.2	-73.5	-176.6	179.1	169.2	1.5	112.3	R686 L687 R691 I692 E693	R686-R689 PolarHBondContact O-N 3.25Å; L687-R689 PolarHBondContact O-N 3.36Å; R689-R691 VanDerWaalsContact C-N 3.29Å; R689-R691 PolarHBondContact O-N 2.98Å; R689-I692 PolarHBondContact O-N 2.86Å; R689-I692 VanDerWaalsContact O-N 3.16Å; R689-E693 PolarHBondContact O-N 3.3Å
690	Q	83.2	Confident	84.8	Confident	116 Å²	116	110.2 Å²	110.2	54%	0.542	54%	0.544	S	S	.	.	H	α-helix	trans	-63.2	-38.4	-176.7	-172.8	168.4	-5.2	0	0	111.6	R686 L687 I692 E693 D694	R686-Q690 PolarHBondContact O-N 2.84Å; R686-Q690 VanDerWaalsContact O-N 3.1Å; L687-Q690 PolarHBondContact O-N 2.84Å; Q690-I692 VanDerWaalsContact C-N 3.31Å; Q690-I692 PolarHBondContact O-N 2.79Å; Q690-E693 PolarHBondContact O-N 2.78Å; Q690-D694 PolarHBondContact O-N 2.88Å
691	R	85.8	Confident	85	Confident	146 Å²	146	108.2 Å²	108.2	55%	0.551	55%	0.546	S	S	*	.	H	α-helix	trans	-56.8	-41.8	174.6	-176.7	-178	178.6	171.7	4.7	113.1	L687 R689 E695	L687-R691 WeakPolarHBondContact O-CB 3.2Å; L687-R691 PolarHBondContact O-N 3.16Å; L687-R691 VanDerWaalsContact O-N 3.15Å; R689-R691 VanDerWaalsContact C-N 3.29Å; R689-R691 PolarHBondContact O-N 2.98Å; R691-E695 IonicContact NE-OE1 3.77Å; R691-E695 PolarHBondContact NE-OE1 3.13Å; R691-E695 IonicContact NH2-OE1 2.86Å; R691-E695 WeakPolarHBondContact O-CG 3.37Å; R691-E695 PolarHBondContact O-N 2.96Å; R691-E695 VanDerWaalsContact O-N 3.14Å
692	I	84.4	Confident	85	Confident	110 Å²	110	111.4 Å²	111.4	56%	0.564	55%	0.552	S	S	*	*	H	α-helix	trans	-68.4	-38.3	-180	-65.3	165.9	0	0	0	110.9	E688 R689 Q690 A696	E688-I692 WeakPolarHBondContact O-CG1 3Å; E688-I692 PolarHBondContact O-N 3.41Å; R689-I692 PolarHBondContact O-N 2.86Å; R689-I692 VanDerWaalsContact O-N 3.16Å; Q690-I692 VanDerWaalsContact C-N 3.31Å; Q690-I692 PolarHBondContact O-N 2.79Å; I692-A696 WeakPolarHBondContact O-CB 3.25Å; I692-A696 PolarHBondContact O-N 3.02Å; I692-A696 VanDerWaalsContact O-N 3.15Å
693	E	86.7	Confident	85	Confident	137 Å²	137	114.7 Å²	114.7	64%	0.64	56%	0.56	S	S	*	*	H	α-helix	trans	-67.1	-44	177.5	-68.6	177	169.3	0	0	111.9	R689 Q690 A696 A697	R689-E693 PolarHBondContact O-N 3.3Å; Q690-E693 PolarHBondContact O-N 2.78Å; E693-A696 PolarHBondContact O-N 2.9Å; E693-A697 PolarHBondContact O-N 3.01Å
694	D	85.1	Confident	85.3	Confident	100 Å²	100	116.8 Å²	116.8	54%	0.535	56%	0.564	S	S	.	*	H	α-helix	trans	-62.8	-43	177.5	-73	-29.1	0	0	0	112.1	Q690 A696 A698	Q690-D694 PolarHBondContact O-N 2.88Å; D694-A696 PolarHBondContact O-N 3.48Å; D694-A698 WeakPolarHBondContact O-CB 3.45Å; D694-A698 PolarHBondContact O-N 2.98Å; D694-A698 VanDerWaalsContact O-N 3.15Å
695	E	86.2	Confident	85.4	Confident	119 Å²	119	114.2 Å²	114.2	56%	0.556	56%	0.561	S	S	*	*	H	α-helix	trans	-64.5	-38	176.6	-74.9	-179.9	-164.6	0	0	112	R691 E699	R691-E695 IonicContact NE-OE1 3.77Å; R691-E695 PolarHBondContact NE-OE1 3.13Å; R691-E695 IonicContact NH2-OE1 2.86Å; R691-E695 WeakPolarHBondContact O-CG 3.37Å; R691-E695 PolarHBondContact O-N 2.96Å; R691-E695 VanDerWaalsContact O-N 3.14Å; E695-E699 PolarHBondContact O-N 3.02Å
696	A	87.5	Confident	85.4	Confident	57 Å²	57	117.9 Å²	117.9	47%	0.471	57%	0.571	S	S	.	*	H	α-helix	trans	-68.6	-42.5	177.5	0	0	0	0	0	113	I692 E693 D694 A698 E699 Q700	I692-A696 WeakPolarHBondContact O-CB 3.25Å; I692-A696 PolarHBondContact O-N 3.02Å; I692-A696 VanDerWaalsContact O-N 3.15Å; E693-A696 PolarHBondContact O-N 2.9Å; D694-A696 PolarHBondContact O-N 3.48Å; A696-A698 VanDerWaalsContact C-N 3.32Å; A696-A698 PolarHBondContact O-N 3.34Å; A696-E699 PolarHBondContact O-N 2.85Å; A696-Q700 PolarHBondContact O-N 2.77Å
697	A	88.2	Confident	85.5	Confident	55 Å²	55	115 Å²	115	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-63.7	-37.5	177.1	0	0	0	0	0	112.1	E693 E699 Q700 A701	E693-A697 PolarHBondContact O-N 3.01Å; A697-E699 VanDerWaalsContact C-N 3.34Å; A697-E699 PolarHBondContact O-N 2.92Å; A697-Q700 PolarHBondContact O-N 2.97Å; A697-A701 PolarHBondContact O-N 2.83Å
698	A	87.2	Confident	85.5	Confident	56 Å²	56	113.6 Å²	113.6	46%	0.463	56%	0.557	S	S	.	*	H	α-helix	trans	-65.1	-32.9	177.7	0	0	0	0	0	113.5	D694 A696 R702	D694-A698 WeakPolarHBondContact O-CB 3.45Å; D694-A698 PolarHBondContact O-N 2.98Å; D694-A698 VanDerWaalsContact O-N 3.15Å; A696-A698 VanDerWaalsContact C-N 3.32Å; A696-A698 PolarHBondContact O-N 3.34Å; A698-R702 PolarHBondContact O-N 3.44Å
699	E	84.3	Confident	85.5	Confident	98 Å²	98	116.1 Å²	116.1	46%	0.458	56%	0.561	S	S	.	*	H	α-helix	trans	-68.4	-49.1	175.9	-150.2	-71.6	142.7	0	0	111.2	E695 A696 A697 A701 R702 R703	E695-E699 PolarHBondContact O-N 3.02Å; A696-E699 PolarHBondContact O-N 2.85Å; A697-E699 VanDerWaalsContact C-N 3.34Å; A697-E699 PolarHBondContact O-N 2.92Å; E699-A701 VanDerWaalsContact C-N 3.35Å; E699-A701 PolarHBondContact O-N 3.5Å; E699-R702 WeakPolarHBondContact O-CB 3.42Å; E699-R702 PolarHBondContact O-N 3.02Å; E699-R702 VanDerWaalsContact O-N 3.12Å; E699-R703 PolarHBondContact O-N 2.97Å; E699-R703 VanDerWaalsContact O-N 3.08Å; E699-R703 IonicContact OE1-NH1 3.59Å; E699-R703 IonicContact OE2-NH1 2.97Å; E699-R703 PolarHBondContact OE2-NH1 3.29Å
700	Q	86.9	Confident	85.5	Confident	134 Å²	134	112 Å²	112	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-58.2	-44.8	179.5	-72.2	-176.8	-19.5	0	0	112.2	A696 A697 R702 R703 N704	A696-Q700 PolarHBondContact O-N 2.77Å; A697-Q700 PolarHBondContact O-N 2.97Å; Q700-R702 VanDerWaalsContact C-N 3.31Å; Q700-R702 PolarHBondContact O-N 3.1Å; Q700-R703 WeakPolarHBondContact O-CB 3.47Å; Q700-R703 PolarHBondContact O-N 2.82Å; Q700-N704 PolarHBondContact O-N 2.86Å
701	A	86	Confident	85.5	Confident	62 Å²	62	112.3 Å²	112.3	51%	0.512	56%	0.558	S	S	.	*	H	α-helix	trans	-60.9	-39.5	177.6	0	0	0	0	0	112.4	A697 E699 L705	A697-A701 PolarHBondContact O-N 2.83Å; E699-A701 VanDerWaalsContact C-N 3.35Å; E699-A701 PolarHBondContact O-N 3.5Å; A701-L705 PolarHBondContact O-N 2.99Å
702	R	83.7	Confident	85.2	Confident	200 Å²	200	109.7 Å²	109.7	76%	0.755	56%	0.555	S	S	*	*	H	α-helix	trans	-62.7	-41.8	175.7	-107.9	179.5	178.1	148.7	1.3	112.4	A698 E699 Q700 L705 L706	A698-R702 PolarHBondContact O-N 3.44Å; E699-R702 WeakPolarHBondContact O-CB 3.42Å; E699-R702 PolarHBondContact O-N 3.02Å; E699-R702 VanDerWaalsContact O-N 3.12Å; Q700-R702 VanDerWaalsContact C-N 3.31Å; Q700-R702 PolarHBondContact O-N 3.1Å; R702-L705 PolarHBondContact O-N 2.96Å; R702-L706 PolarHBondContact O-N 2.77Å
703	R	86.5	Confident	85	Confident	164 Å²	164	107.3 Å²	107.3	62%	0.619	55%	0.552	S	S	*	*	H	α-helix	trans	-61.3	-49.1	-178.4	-140	178.6	-170	117.8	-4.5	111.6	E699 Q700 L705 L706 E707	E699-R703 PolarHBondContact O-N 2.97Å; E699-R703 VanDerWaalsContact O-N 3.08Å; E699-R703 IonicContact OE1-NH1 3.59Å; E699-R703 IonicContact OE2-NH1 2.97Å; E699-R703 PolarHBondContact OE2-NH1 3.29Å; Q700-R703 WeakPolarHBondContact O-CB 3.47Å; Q700-R703 PolarHBondContact O-N 2.82Å; R703-L705 PolarHBondContact O-N 2.82Å; R703-L706 WeakPolarHBondContact O-CB 3.5Å; R703-L706 PolarHBondContact O-N 3.3Å; R703-E707 PolarHBondContact O-N 2.98Å
704	N	87.4	Confident	84.9	Confident	96 Å²	96	103.3 Å²	103.3	51%	0.513	54%	0.542	S	S	.	.	H	α-helix	trans	-64.2	-40	-179.9	-63.4	-6	0	0	0	112.2	Q700 L706 E707 I708	Q700-N704 PolarHBondContact O-N 2.86Å; N704-L706 VanDerWaalsContact C-N 3.29Å; N704-L706 PolarHBondContact O-N 2.86Å; N704-E707 PolarHBondContact O-N 3.16Å; N704-I708 WeakPolarHBondContact O-CG1 3.45Å; N704-I708 PolarHBondContact O-N 2.83Å; N704-I708 VanDerWaalsContact O-N 3.14Å
705	L	84.2	Confident	84.6	Confident	98 Å²	98	104.2 Å²	104.2	51%	0.513	55%	0.546	S	S	.	.	H	α-helix	trans	-64.5	-35.1	178.4	-147.1	175.6	0	0	0	111.5	A701 R702 R703 R709	A701-L705 PolarHBondContact O-N 2.99Å; R702-L705 PolarHBondContact O-N 2.96Å; R703-L705 PolarHBondContact O-N 2.82Å; L705-R709 HydrophobicContact CD2-CG 4.35Å; L705-R709 PolarHBondContact O-N 2.84Å
706	L	85.9	Confident	84.1	Confident	117 Å²	117	104.5 Å²	104.5	61%	0.613	55%	0.548	S	S	*	.	H	α-helix	trans	-67.6	-42.9	176.5	-165.1	71.8	0	0	0	111.8	R702 R703 N704 R709 V710	R702-L706 PolarHBondContact O-N 2.77Å; R703-L706 WeakPolarHBondContact O-CB 3.5Å; R703-L706 PolarHBondContact O-N 3.3Å; N704-L706 VanDerWaalsContact C-N 3.29Å; N704-L706 PolarHBondContact O-N 2.86Å; L706-R709 PolarHBondContact O-N 2.79Å; L706-V710 PolarHBondContact O-N 2.85Å
707	E	87.7	Confident	83.7	Confident	117 Å²	117	105.6 Å²	105.6	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-62.9	-45.9	179	-172.4	173.2	-165.5	0	0	112.1	R703 N704 R709 V710 Q711	R703-E707 PolarHBondContact O-N 2.98Å; N704-E707 PolarHBondContact O-N 3.16Å; E707-R709 VanDerWaalsContact C-N 3.31Å; E707-R709 PolarHBondContact O-N 2.95Å; E707-V710 PolarHBondContact O-N 2.99Å; E707-V710 VanDerWaalsContact O-N 3.16Å; E707-Q711 PolarHBondContact O-N 3.07Å; E707-Q711 VanDerWaalsContact O-N 3.15Å
708	I	83.1	Confident	83.4	Confident	98 Å²	98	108.5 Å²	108.5	50%	0.503	56%	0.559	S	S	.	*	H	α-helix	trans	-60.2	-39.2	177.7	-68	167.8	0	0	0	111.6	N704 V710 Q711 L712	N704-I708 WeakPolarHBondContact O-CG1 3.45Å; N704-I708 PolarHBondContact O-N 2.83Å; N704-I708 VanDerWaalsContact O-N 3.14Å; I708-V710 PolarHBondContact O-N 3.35Å; I708-Q711 PolarHBondContact O-N 3.26Å; I708-L712 HydrophobicContact CG2-CD1 3.94Å; I708-L712 PolarHBondContact O-N 3.05Å
709	R	82.5	Confident	82.9	Confident	168 Å²	168	109 Å²	109	63%	0.634	56%	0.559	S	S	*	*	H	α-helix	trans	-62.5	-40.9	176	-78.7	-174.6	-176.1	-176.9	2.3	112.8	L705 L706 E707 Q711 L712 A713	L705-R709 HydrophobicContact CD2-CG 4.35Å; L705-R709 PolarHBondContact O-N 2.84Å; L706-R709 PolarHBondContact O-N 2.79Å; E707-R709 VanDerWaalsContact C-N 3.31Å; E707-R709 PolarHBondContact O-N 2.95Å; R709-Q711 VanDerWaalsContact C-N 3.34Å; R709-L712 PolarHBondContact O-N 3.46Å; R709-A713 PolarHBondContact O-N 2.77Å; R709-A713 VanDerWaalsContact O-N 3.11Å
710	V	82.9	Confident	82.7	Confident	103 Å²	103	110.8 Å²	110.8	62%	0.624	57%	0.568	S	S	*	*	H	α-helix	trans	-65.3	-40.9	179.2	174	0	0	0	0	110.6	L706 E707 I708 A714	L706-V710 PolarHBondContact O-N 2.85Å; E707-V710 PolarHBondContact O-N 2.99Å; E707-V710 VanDerWaalsContact O-N 3.16Å; I708-V710 PolarHBondContact O-N 3.35Å; V710-A714 PolarHBondContact O-N 3.17Å
711	Q	82.7	Confident	82.4	Confident	123 Å²	123	107.3 Å²	107.3	58%	0.575	56%	0.562	S	S	*	*	H	α-helix	trans	-65.9	-43.2	176.9	-66.3	-178.2	7.8	0	0	112.5	E707 I708 R709 A714 L715	E707-Q711 PolarHBondContact O-N 3.07Å; E707-Q711 VanDerWaalsContact O-N 3.15Å; I708-Q711 PolarHBondContact O-N 3.26Å; R709-Q711 VanDerWaalsContact C-N 3.34Å; Q711-A714 PolarHBondContact O-N 3.05Å; Q711-L715 PolarHBondContact O-N 2.94Å; Q711-L715 VanDerWaalsContact O-N 3.08Å
712	L	79.6	Confident	82.3	Confident	91 Å²	91	110.5 Å²	110.5	48%	0.476	56%	0.564	S	S	.	*	H	α-helix	trans	-61.4	-47.1	177.5	-83	164.3	0	0	0	112.5	I708 R709 A714 L715 E716	I708-L712 HydrophobicContact CG2-CD1 3.94Å; I708-L712 PolarHBondContact O-N 3.05Å; R709-L712 PolarHBondContact O-N 3.46Å; L712-A714 VanDerWaalsContact C-N 3.29Å; L712-A714 PolarHBondContact O-N 2.79Å; L712-L715 WeakPolarHBondContact O-CB 3.32Å; L712-L715 PolarHBondContact O-N 3.01Å; L712-L715 VanDerWaalsContact O-N 3.07Å; L712-E716 PolarHBondContact O-N 2.97Å
713	A	81.4	Confident	81.9	Confident	60 Å²	60	103.6 Å²	103.6	50%	0.496	55%	0.55	S	S	.	*	H	α-helix	trans	-62.2	-36	-179.7	0	0	0	0	0	112.7	R709 S717	R709-A713 PolarHBondContact O-N 2.77Å; R709-A713 VanDerWaalsContact O-N 3.11Å; A713-S717 PolarHBondContact O-N 3.41Å
714	A	84.4	Confident	81.6	Confident	53 Å²	53	102.5 Å²	102.5	44%	0.438	55%	0.552	S	S	.	*	H	α-helix	trans	-70.4	-32.1	174.8	0	0	0	0	0	112.9	V710 Q711 L712 N718	V710-A714 PolarHBondContact O-N 3.17Å; Q711-A714 PolarHBondContact O-N 3.05Å; L712-A714 VanDerWaalsContact C-N 3.29Å; L712-A714 PolarHBondContact O-N 2.79Å; A714-N718 PolarHBondContact O-N 2.84Å; A714-N718 PolarHBondContact O-ND2 2.79Å
715	L	78.6	Confident	81.4	Confident	119 Å²	119	100.9 Å²	100.9	62%	0.623	55%	0.552	S	S	*	*	H	α-helix	trans	-72.4	-45.4	177.2	-170.5	74.7	0	0	0	111.8	Q711 L712 N718 S719	Q711-L715 PolarHBondContact O-N 2.94Å; Q711-L715 VanDerWaalsContact O-N 3.08Å; L712-L715 WeakPolarHBondContact O-CB 3.32Å; L712-L715 PolarHBondContact O-N 3.01Å; L712-L715 VanDerWaalsContact O-N 3.07Å; L715-N718 PolarHBondContact O-N 2.86Å; L715-S719 WeakPolarHBondContact O-CB 3.39Å; L715-S719 PolarHBondContact O-N 3.03Å; L715-S719 PolarHBondContact O-OG 2.93Å
716	E	74.7	Confident	81.4	Confident	126 Å²	126	101.7 Å²	101.7	59%	0.589	55%	0.553	S	S	*	*	H	α-helix	trans	-59.9	-45.9	179.6	-73.4	-177.2	151.4	0	0	112.2	L712 N718 S719 Q720	L712-E716 PolarHBondContact O-N 2.97Å; E716-N718 PolarHBondContact O-N 3Å; E716-S719 PolarHBondContact O-N 2.84Å; E716-S719 PolarHBondContact O-OG 2.81Å; E716-Q720 PolarHBondContact O-N 2.84Å
717	S	81	Confident	81.1	Confident	79 Å²	79	99.5 Å²	99.5	55%	0.552	55%	0.548	S	S	*	.	H	α-helix	trans	-61.6	-43.1	179	-176.8	0	0	0	0	112.5	A713 A721	A713-S717 PolarHBondContact O-N 3.41Å; S717-A721 PolarHBondContact O-N 2.67Å
718	N	80.4	Confident	80.9	Confident	116 Å²	116	103 Å²	103	62%	0.62	56%	0.556	S	S	*	*	H	α-helix	trans	-68.8	-35.2	176.4	-78.9	-55.6	0	0	0	112.8	A714 L715 E716 K722	A714-N718 PolarHBondContact O-N 2.84Å; A714-N718 PolarHBondContact O-ND2 2.79Å; L715-N718 PolarHBondContact O-N 2.86Å; E716-N718 PolarHBondContact O-N 3Å; N718-K722 WeakPolarHBondContact O-CB 3.2Å; N718-K722 PolarHBondContact O-N 3.27Å
719	S	76.9	Confident	81	Confident	66 Å²	66	101.2 Å²	101.2	46%	0.462	56%	0.556	S	S	.	*	H	α-helix	trans	-73.1	-38.9	-178.6	71.1	0	0	0	0	112.4	L715 E716 K722 A723	L715-S719 WeakPolarHBondContact O-CB 3.39Å; L715-S719 PolarHBondContact O-N 3.03Å; L715-S719 PolarHBondContact O-OG 2.93Å; E716-S719 PolarHBondContact O-N 2.84Å; E716-S719 PolarHBondContact O-OG 2.81Å; S719-K722 PolarHBondContact O-N 3.43Å; S719-A723 WeakPolarHBondContact O-CB 3.28Å; S719-A723 PolarHBondContact O-N 2.85Å
720	Q	80.4	Confident	81.1	Confident	136 Å²	136	96.7 Å²	96.7	64%	0.636	54%	0.542	S	S	*	.	H	α-helix	trans	-59.4	-53	172.2	-82.3	-174	-36.2	0	0	111.8	E716 K722 A723 E724	E716-Q720 PolarHBondContact O-N 2.84Å; Q720-K722 VanDerWaalsContact C-N 3.26Å; Q720-K722 PolarHBondContact O-N 3.45Å; Q720-A723 PolarHBondContact O-N 2.91Å; Q720-E724 PolarHBondContact O-N 3.07Å
721	A	80.8	Confident	81.3	Confident	61 Å²	61	94.5 Å²	94.5	50%	0.504	54%	0.535	S	S	.	.	H	α-helix	trans	-59.3	-36.9	-178.4	0	0	0	0	0	112.7	S717 A725	S717-A721 PolarHBondContact O-N 2.67Å; A721-A725 WeakPolarHBondContact O-CB 3.23Å; A721-A725 PolarHBondContact O-N 2.99Å
722	K	83.2	Confident	81.5	Confident	129 Å²	129	93.5 Å²	93.5	56%	0.561	53%	0.534	S	S	*	.	H	α-helix	trans	-69.6	-45	176.4	-173.3	176.5	172.7	-176.4	0	112.3	N718 S719 Q720 E724 A725 E726	N718-K722 WeakPolarHBondContact O-CB 3.2Å; N718-K722 PolarHBondContact O-N 3.27Å; S719-K722 PolarHBondContact O-N 3.43Å; Q720-K722 VanDerWaalsContact C-N 3.26Å; Q720-K722 PolarHBondContact O-N 3.45Å; K722-E724 PolarHBondContact O-N 2.82Å; K722-A725 PolarHBondContact O-N 2.94Å; K722-E726 WeakPolarHBondContact CE-OE1 3.44Å; K722-E726 HydrophobicContact CG-CG 4.49Å; K722-E726 IonicContact NZ-OE1 3.29Å; K722-E726 WeakPolarHBondContact O-CG 3.47Å; K722-E726 PolarHBondContact O-N 3.03Å
723	A	76.8	Confident	82	Confident	56 Å²	56	95.9 Å²	95.9	46%	0.463	54%	0.536	S	S	.	.	H	α-helix	trans	-64.2	-38.9	179.5	0	0	0	0	0	112.5	S719 Q720 S727	S719-A723 WeakPolarHBondContact O-CB 3.28Å; S719-A723 PolarHBondContact O-N 2.85Å; Q720-A723 PolarHBondContact O-N 2.91Å; A723-S727 VanDerWaalsContact O-CB 3.31Å; A723-S727 WeakPolarHBondContact O-CB 3.4Å; A723-S727 PolarHBondContact O-N 3.47Å; A723-S727 PolarHBondContact O-OG 2.95Å
724	E	79.8	Confident	82	Confident	141 Å²	141	97.7 Å²	97.7	66%	0.659	54%	0.537	S	S	*	.	H	α-helix	trans	-66.1	-38.9	174	-71.4	-172.4	165.3	0	0	112.4	Q720 K722 S727 R728	Q720-E724 PolarHBondContact O-N 3.07Å; K722-E724 PolarHBondContact O-N 2.82Å; E724-S727 WeakPolarHBondContact CA-OG 3.31Å; E724-S727 PolarHBondContact O-OG 2.9Å; E724-R728 VanDerWaalsContact O-CB 3.23Å; E724-R728 WeakPolarHBondContact O-CB 3.35Å; E724-R728 PolarHBondContact O-N 2.83Å; E724-R728 VanDerWaalsContact O-N 3.13Å
725	A	82.3	Confident	81.8	Confident	62 Å²	62	99 Å²	99	51%	0.512	54%	0.543	S	S	.	.	H	α-helix	trans	-66.8	-46.1	176.7	0	0	0	0	0	112.5	A721 K722 A729	A721-A725 WeakPolarHBondContact O-CB 3.23Å; A721-A725 PolarHBondContact O-N 2.99Å; K722-A725 PolarHBondContact O-N 2.94Å; A725-A729 WeakPolarHBondContact O-CB 3.33Å; A725-A729 PolarHBondContact O-N 3.44Å; A725-A729 VanDerWaalsContact O-N 3.07Å
726	E	85.7	Confident	81.9	Confident	114 Å²	114	97 Å²	97	53%	0.533	54%	0.538	S	S	.	.	H	α-helix	trans	-66.5	-45.6	-179.9	-72.8	177.9	169.4	0	0	111.7	K722 R728 A729 E730	K722-E726 WeakPolarHBondContact CE-OE1 3.44Å; K722-E726 HydrophobicContact CG-CG 4.49Å; K722-E726 IonicContact NZ-OE1 3.29Å; K722-E726 WeakPolarHBondContact O-CG 3.47Å; K722-E726 PolarHBondContact O-N 3.03Å; E726-R728 PolarHBondContact O-N 3.33Å; E726-A729 PolarHBondContact O-N 2.82Å; E726-E730 WeakPolarHBondContact O-CB 2.96Å; E726-E730 PolarHBondContact O-N 2.91Å
727	S	78.9	Confident	82.5	Confident	71 Å²	71	95.9 Å²	95.9	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-63.2	-38.7	177.7	55.5	0	0	0	0	112.9	A723 E724 E730 A731	A723-S727 VanDerWaalsContact O-CB 3.31Å; A723-S727 WeakPolarHBondContact O-CB 3.4Å; A723-S727 PolarHBondContact O-N 3.47Å; A723-S727 PolarHBondContact O-OG 2.95Å; E724-S727 WeakPolarHBondContact CA-OG 3.31Å; E724-S727 PolarHBondContact O-OG 2.9Å; S727-E730 PolarHBondContact O-N 2.75Å; S727-A731 WeakPolarHBondContact O-CB 3.43Å; S727-A731 PolarHBondContact O-N 3.02Å
728	R	83.2	Confident	82.6	Confident	190 Å²	190	94.6 Å²	94.6	72%	0.717	53%	0.527	S	S	*	.	H	α-helix	trans	-69.4	-35.9	176.6	-167.2	175.5	-173.6	-174.8	2.1	112.8	E724 E726 N732	E724-R728 VanDerWaalsContact O-CB 3.23Å; E724-R728 WeakPolarHBondContact O-CB 3.35Å; E724-R728 PolarHBondContact O-N 2.83Å; E724-R728 VanDerWaalsContact O-N 3.13Å; E726-R728 PolarHBondContact O-N 3.33Å; R728-N732 PolarHBondContact O-N 3.36Å; R728-N732 PolarHBondContact O-ND2 2.76Å
729	A	85.6	Confident	83	Confident	61 Å²	61	91.7 Å²	91.7	50%	0.504	52%	0.519	S	S	.	.	H	α-helix	trans	-66.7	-44.2	174.4	0	0	0	0	0	111.7	A725 E726 N732 R733	A725-A729 WeakPolarHBondContact O-CB 3.33Å; A725-A729 PolarHBondContact O-N 3.44Å; A725-A729 VanDerWaalsContact O-N 3.07Å; E726-A729 PolarHBondContact O-N 2.82Å; A729-N732 PolarHBondContact O-N 2.82Å; A729-R733 PolarHBondContact O-N 3.16Å; A729-R733 VanDerWaalsContact O-N 3.13Å
730	E	84.2	Confident	83.6	Confident	73 Å²	73	93 Å²	93	34%	0.341	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-41.9	-179.6	-176	56.4	-159.1	0	0	112.4	E726 S727 N732 R733 I734	E726-E730 WeakPolarHBondContact O-CB 2.96Å; E726-E730 PolarHBondContact O-N 2.91Å; S727-E730 PolarHBondContact O-N 2.75Å; E730-N732 VanDerWaalsContact C-N 3.31Å; E730-N732 PolarHBondContact O-N 3.22Å; E730-R733 WeakPolarHBondContact O-CB 3.28Å; E730-R733 PolarHBondContact O-N 2.82Å; E730-R733 VanDerWaalsContact O-N 3.11Å; E730-R733 IonicContact OE1-CZ 2.9Å; E730-R733 IonicContact OE1-NE 2.66Å; E730-R733 PolarHBondContact OE1-NE 2.85Å; E730-R733 IonicContact OE1-NH2 3.36Å; E730-R733 PolarHBondContact OE1-NH2 2.7Å; E730-R733 IonicContact OE2-CZ 2.7Å; E730-R733 VanDerWaalsContact OE2-CZ 3.28Å; E730-R733 IonicContact OE2-NE 2.72Å; E730-R733 PolarHBondContact OE2-NE 2.87Å; E730-R733 IonicContact OE2-NH2 3.13Å; E730-R733 PolarHBondContact OE2-NH2 2.73Å; E730-I734 HydrophobicContact CG-CD1 4.05Å; E730-I734 WeakPolarHBondContact O-CG1 3.23Å; E730-I734 PolarHBondContact O-N 2.84Å
731	A	86.9	Confident	83.9	Confident	57 Å²	57	92 Å²	92	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-58.5	-41.6	175.2	0	0	0	0	0	112.5	S727 R733 S735	S727-A731 WeakPolarHBondContact O-CB 3.43Å; S727-A731 PolarHBondContact O-N 3.02Å; A731-R733 VanDerWaalsContact C-N 3.35Å; A731-S735 WeakPolarHBondContact O-CB 3.26Å; A731-S735 PolarHBondContact O-N 3.26Å
732	N	87.9	Confident	84.3	Confident	103 Å²	103	93.7 Å²	93.7	55%	0.551	52%	0.517	S	S	*	.	H	α-helix	trans	-65.7	-36.7	175.8	-74	-17.2	0	0	0	112.2	R728 A729 E730 S736	R728-N732 PolarHBondContact O-N 3.36Å; R728-N732 PolarHBondContact O-ND2 2.76Å; A729-N732 PolarHBondContact O-N 2.82Å; E730-N732 VanDerWaalsContact C-N 3.31Å; E730-N732 PolarHBondContact O-N 3.22Å; N732-S736 VanDerWaalsContact O-CB 3.32Å; N732-S736 WeakPolarHBondContact O-CB 3.35Å; N732-S736 PolarHBondContact O-N 2.73Å; N732-S736 PolarHBondContact O-OG 2.9Å
733	R	88.9	Confident	84.4	Confident	141 Å²	141	90.3 Å²	90.3	53%	0.532	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-51	176.7	-174.1	174.6	74.8	113.8	-3.9	111.4	A729 E730 A731 S735 S736 Q737	A729-R733 PolarHBondContact O-N 3.16Å; A729-R733 VanDerWaalsContact O-N 3.13Å; E730-R733 WeakPolarHBondContact O-CB 3.28Å; E730-R733 PolarHBondContact O-N 2.82Å; E730-R733 VanDerWaalsContact O-N 3.11Å; E730-R733 IonicContact OE1-CZ 2.9Å; E730-R733 IonicContact OE1-NE 2.66Å; E730-R733 PolarHBondContact OE1-NE 2.85Å; E730-R733 IonicContact OE1-NH2 3.36Å; E730-R733 PolarHBondContact OE1-NH2 2.7Å; E730-R733 IonicContact OE2-CZ 2.7Å; E730-R733 VanDerWaalsContact OE2-CZ 3.28Å; E730-R733 IonicContact OE2-NE 2.72Å; E730-R733 PolarHBondContact OE2-NE 2.87Å; E730-R733 IonicContact OE2-NH2 3.13Å; E730-R733 PolarHBondContact OE2-NH2 2.73Å; A731-R733 VanDerWaalsContact C-N 3.35Å; R733-S735 PolarHBondContact O-N 2.96Å; R733-S736 PolarHBondContact O-N 2.84Å; R733-Q737 WeakPolarHBondContact O-CB 3.22Å; R733-Q737 PolarHBondContact O-N 2.72Å
734	I	81.3	Confident	85.1	Confident	98 Å²	98	94.4 Å²	94.4	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-60.1	-47.7	179.6	-65.8	169.1	0	0	0	110.8	E730 S736 Q737 A738	E730-I734 HydrophobicContact CG-CD1 4.05Å; E730-I734 WeakPolarHBondContact O-CG1 3.23Å; E730-I734 PolarHBondContact O-N 2.84Å; I734-S736 PolarHBondContact O-N 3.49Å; I734-Q737 PolarHBondContact O-N 3.09Å; I734-A738 WeakPolarHBondContact O-CB 3.44Å; I734-A738 PolarHBondContact O-N 2.97Å
735	S	79.8	Confident	85.6	Confident	81 Å²	81	93 Å²	93	57%	0.566	52%	0.517	S	S	*	.	H	α-helix	trans	-58	-46.4	177.9	179.4	0	0	0	0	112.2	A731 R733 Q737 A738 A739	A731-S735 WeakPolarHBondContact O-CB 3.26Å; A731-S735 PolarHBondContact O-N 3.26Å; R733-S735 PolarHBondContact O-N 2.96Å; S735-Q737 PolarHBondContact O-N 2.99Å; S735-A738 PolarHBondContact O-N 3.1Å; S735-A739 PolarHBondContact O-N 2.97Å; S735-A739 VanDerWaalsContact O-N 3.12Å
736	S	81.5	Confident	85.7	Confident	75 Å²	75	97.7 Å²	97.7	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-65.6	-38.1	179.5	-57	0	0	0	0	112.3	N732 R733 I734 V740	N732-S736 VanDerWaalsContact O-CB 3.32Å; N732-S736 WeakPolarHBondContact O-CB 3.35Å; N732-S736 PolarHBondContact O-N 2.73Å; N732-S736 PolarHBondContact O-OG 2.9Å; R733-S736 PolarHBondContact O-N 2.84Å; I734-S736 PolarHBondContact O-N 3.49Å; S736-V740 WeakPolarHBondContact O-CG2 3.06Å; S736-V740 PolarHBondContact O-N 2.81Å
737	Q	88	Confident	85.8	Confident	104 Å²	104	95.3 Å²	95.3	49%	0.486	52%	0.521	S	S	.	.	H	α-helix	trans	-71.4	-41.7	179.8	-168.2	166.3	-14.9	0	0	111.8	R733 I734 S735 A739 V740 E741	R733-Q737 WeakPolarHBondContact O-CB 3.22Å; R733-Q737 PolarHBondContact O-N 2.72Å; I734-Q737 PolarHBondContact O-N 3.09Å; S735-Q737 PolarHBondContact O-N 2.99Å; Q737-A739 PolarHBondContact O-N 2.85Å; Q737-V740 PolarHBondContact O-N 2.86Å; Q737-E741 PolarHBondContact O-N 2.73Å; Q737-E741 VanDerWaalsContact O-N 3.1Å
738	A	82.5	Confident	86.3	Confident	52 Å²	52	97.5 Å²	97.5	43%	0.43	52%	0.523	S	S	.	.	H	α-helix	trans	-60.8	-42.7	174.5	0	0	0	0	0	112.3	I734 S735 V740 E741 E742	I734-A738 WeakPolarHBondContact O-CB 3.44Å; I734-A738 PolarHBondContact O-N 2.97Å; S735-A738 PolarHBondContact O-N 3.1Å; A738-V740 VanDerWaalsContact C-N 3.31Å; A738-V740 PolarHBondContact O-N 3.3Å; A738-E741 PolarHBondContact O-N 2.91Å; A738-E742 WeakPolarHBondContact O-CB 3.17Å; A738-E742 PolarHBondContact O-N 3.39Å
739	A	87.7	Confident	86.4	Confident	54 Å²	54	91.1 Å²	91.1	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-63	-34.5	177.4	0	0	0	0	0	113.1	S735 Q737 A743	S735-A739 PolarHBondContact O-N 2.97Å; S735-A739 VanDerWaalsContact O-N 3.12Å; Q737-A739 PolarHBondContact O-N 2.85Å; A739-A743 WeakPolarHBondContact O-CB 3.29Å; A739-A743 PolarHBondContact O-N 2.85Å; A739-A743 VanDerWaalsContact O-N 3.11Å
740	V	90	Very high	86.6	Confident	94 Å²	94	93.3 Å²	93.3	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-71.3	-39.5	175.7	170.8	0	0	0	0	111.7	S736 Q737 A738 K744	S736-V740 WeakPolarHBondContact O-CG2 3.06Å; S736-V740 PolarHBondContact O-N 2.81Å; Q737-V740 PolarHBondContact O-N 2.86Å; A738-V740 VanDerWaalsContact C-N 3.31Å; A738-V740 PolarHBondContact O-N 3.3Å; V740-K744 PolarHBondContact O-N 2.82Å; V740-K744 VanDerWaalsContact O-N 3.08Å
741	E	86.7	Confident	86.9	Confident	115 Å²	115	92.7 Å²	92.7	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-67.5	-42.4	174.9	-72	-173.7	163.9	0	0	112	Q737 A738 A743 K744 L745	Q737-E741 PolarHBondContact O-N 2.73Å; Q737-E741 VanDerWaalsContact O-N 3.1Å; A738-E741 PolarHBondContact O-N 2.91Å; E741-A743 VanDerWaalsContact C-N 3.31Å; E741-A743 PolarHBondContact O-N 2.99Å; E741-K744 WeakPolarHBondContact O-CB 3.35Å; E741-K744 PolarHBondContact O-N 3.45Å; E741-L745 WeakPolarHBondContact O-CG 3.15Å; E741-L745 PolarHBondContact O-N 2.6Å
742	E	88.7	Confident	86.9	Confident	97 Å²	97	95.7 Å²	95.7	45%	0.453	52%	0.524	S	S	.	.	H	α-helix	trans	-59.2	-41.8	175.2	-166.7	-170	164.8	0	0	111.7	A738 R746	A738-E742 WeakPolarHBondContact O-CB 3.17Å; A738-E742 PolarHBondContact O-N 3.39Å; E742-R746 VanDerWaalsContact CD-NH1 3.28Å; E742-R746 PolarHBondContact O-N 3.03Å; E742-R746 VanDerWaalsContact O-N 3.08Å; E742-R746 IonicContact OE1-CZ 3.27Å; E742-R746 IonicContact OE1-NH1 3.28Å; E742-R746 PolarHBondContact OE1-NH1 3.3Å; E742-R746 IonicContact OE1-NH2 2.84Å; E742-R746 PolarHBondContact OE1-NH2 2.81Å
743	A	86.9	Confident	86.8	Confident	58 Å²	58	97.1 Å²	97.1	48%	0.479	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-40.7	175.7	0	0	0	0	0	112.8	A739 E741 A747	A739-A743 WeakPolarHBondContact O-CB 3.29Å; A739-A743 PolarHBondContact O-N 2.85Å; A739-A743 VanDerWaalsContact O-N 3.11Å; E741-A743 VanDerWaalsContact C-N 3.31Å; E741-A743 PolarHBondContact O-N 2.99Å; A743-A747 PolarHBondContact O-N 2.86Å
744	K	91.3	Very high	86.5	Confident	142 Å²	142	93.7 Å²	93.7	62%	0.617	52%	0.523	S	S	*	.	H	α-helix	trans	-61.6	-50.3	174.1	-98.3	-174.1	170.8	-173.8	0	112	V740 E741 R746 A747 E748	V740-K744 PolarHBondContact O-N 2.82Å; V740-K744 VanDerWaalsContact O-N 3.08Å; E741-K744 WeakPolarHBondContact O-CB 3.35Å; E741-K744 PolarHBondContact O-N 3.45Å; K744-R746 VanDerWaalsContact C-N 3.31Å; K744-R746 PolarHBondContact O-N 2.86Å; K744-A747 WeakPolarHBondContact O-CB 3.49Å; K744-A747 PolarHBondContact O-N 3.46Å; K744-E748 PolarHBondContact O-N 2.78Å
745	L	89.1	Confident	86.8	Confident	112 Å²	112	93.4 Å²	93.4	59%	0.586	52%	0.522	S	S	*	.	H	α-helix	trans	-62.8	-37.1	-178	-71	168.8	0	0	0	111.9	E741 E748 A749	E741-L745 WeakPolarHBondContact O-CG 3.15Å; E741-L745 PolarHBondContact O-N 2.6Å; L745-E748 PolarHBondContact O-N 3.48Å; L745-A749 WeakPolarHBondContact O-CB 3.46Å; L745-A749 PolarHBondContact O-N 2.92Å
746	R	86.1	Confident	87.1	Confident	160 Å²	160	92.4 Å²	92.4	60%	0.604	52%	0.519	S	S	*	.	H	α-helix	trans	-62.3	-41.6	171.3	-79	-166.7	179.3	101.6	10.2	112.9	E742 K744 L750	E742-R746 VanDerWaalsContact CD-NH1 3.28Å; E742-R746 PolarHBondContact O-N 3.03Å; E742-R746 VanDerWaalsContact O-N 3.08Å; E742-R746 IonicContact OE1-CZ 3.27Å; E742-R746 IonicContact OE1-NH1 3.28Å; E742-R746 PolarHBondContact OE1-NH1 3.3Å; E742-R746 IonicContact OE1-NH2 2.84Å; E742-R746 PolarHBondContact OE1-NH2 2.81Å; K744-R746 VanDerWaalsContact C-N 3.31Å; K744-R746 PolarHBondContact O-N 2.86Å; R746-L750 WeakPolarHBondContact O-CB 3.39Å; R746-L750 PolarHBondContact O-N 3Å; R746-L750 VanDerWaalsContact O-N 3.07Å
747	A	86.1	Confident	87.2	Confident	63 Å²	63	94.5 Å²	94.5	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-67.4	-39.8	179.1	0	0	0	0	0	112.2	A743 K744 S751	A743-A747 PolarHBondContact O-N 2.86Å; K744-A747 WeakPolarHBondContact O-CB 3.49Å; K744-A747 PolarHBondContact O-N 3.46Å; A747-S751 WeakPolarHBondContact O-CB 3.42Å; A747-S751 PolarHBondContact O-N 2.6Å; A747-S751 VanDerWaalsContact O-N 3.1Å
748	E	89	Confident	87.1	Confident	118 Å²	118	93.9 Å²	93.9	55%	0.551	52%	0.52	S	S	*	.	H	α-helix	trans	-66.2	-44.4	174.2	-73	-179.7	171	0	0	112	K744 L745 L750 S751 I752	K744-E748 PolarHBondContact O-N 2.78Å; L745-E748 PolarHBondContact O-N 3.48Å; E748-L750 PolarHBondContact O-N 3.21Å; E748-S751 WeakPolarHBondContact O-CB 3.34Å; E748-S751 PolarHBondContact O-N 2.81Å; E748-I752 WeakPolarHBondContact O-CG1 3.45Å; E748-I752 PolarHBondContact O-N 2.81Å
749	A	87	Confident	87.3	Confident	56 Å²	56	95.9 Å²	95.9	46%	0.463	52%	0.52	S	S	.	.	H	α-helix	trans	-58.3	-46.3	176.6	0	0	0	0	0	112.2	L745 S751 I752 E753	L745-A749 WeakPolarHBondContact O-CB 3.46Å; L745-A749 PolarHBondContact O-N 2.92Å; A749-S751 VanDerWaalsContact C-N 3.32Å; A749-S751 PolarHBondContact O-N 3.45Å; A749-I752 PolarHBondContact O-N 2.93Å; A749-E753 WeakPolarHBondContact O-CB 3.36Å; A749-E753 PolarHBondContact O-N 3.24Å
750	L	89.6	Confident	87.3	Confident	106 Å²	106	102.5 Å²	102.5	56%	0.555	53%	0.534	S	S	*	.	H	α-helix	trans	-62.4	-38.1	176.8	-168.6	76.2	0	0	0	112.2	R746 E748 T754	R746-L750 WeakPolarHBondContact O-CB 3.39Å; R746-L750 PolarHBondContact O-N 3Å; R746-L750 VanDerWaalsContact O-N 3.07Å; E748-L750 PolarHBondContact O-N 3.21Å; L750-T754 WeakPolarHBondContact O-CB 3.47Å; L750-T754 WeakPolarHBondContact O-CG2 3.26Å; L750-T754 PolarHBondContact O-N 2.97Å; L750-T754 PolarHBondContact O-OG1 2.78Å
751	S	90.2	Very high	87	Confident	60 Å²	60	103.4 Å²	103.4	42%	0.42	54%	0.535	S	S	.	.	H	α-helix	trans	-65.9	-37.6	175.3	-175.8	0	0	0	0	112.2	A747 E748 A749 T754 N755	A747-S751 WeakPolarHBondContact O-CB 3.42Å; A747-S751 PolarHBondContact O-N 2.6Å; A747-S751 VanDerWaalsContact O-N 3.1Å; E748-S751 WeakPolarHBondContact O-CB 3.34Å; E748-S751 PolarHBondContact O-N 2.81Å; A749-S751 VanDerWaalsContact C-N 3.32Å; A749-S751 PolarHBondContact O-N 3.45Å; S751-T754 PolarHBondContact O-OG1 2.9Å; S751-N755 WeakPolarHBondContact O-CB 3.35Å; S751-N755 PolarHBondContact O-N 3.17Å; S751-N755 VanDerWaalsContact O-N 3.16Å; S751-N755 PolarHBondContact O-ND2 3.19Å
752	I	86.6	Confident	86.9	Confident	120 Å²	120	103.2 Å²	103.2	62%	0.615	53%	0.532	S	S	*	.	H	α-helix	trans	-69.6	-46.4	176.9	-67.6	164.3	0	0	0	110.6	E748 A749 N755 A756	E748-I752 WeakPolarHBondContact O-CG1 3.45Å; E748-I752 PolarHBondContact O-N 2.81Å; A749-I752 PolarHBondContact O-N 2.93Å; I752-N755 PolarHBondContact O-N 3.01Å; I752-A756 WeakPolarHBondContact O-CB 3.43Å; I752-A756 PolarHBondContact O-N 3.44Å
753	E	85.9	Confident	86.9	Confident	133 Å²	133	104.3 Å²	104.3	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-58.9	-51.9	179.1	-175.7	172.9	-151.8	0	0	111.5	A749 N755 A756 E757	A749-E753 WeakPolarHBondContact O-CB 3.36Å; A749-E753 PolarHBondContact O-N 3.24Å; E753-N755 PolarHBondContact O-N 3.03Å; E753-A756 PolarHBondContact O-N 2.77Å; E753-E757 PolarHBondContact O-N 3.42Å
754	T	83.2	Confident	86.8	Confident	70 Å²	70	104.2 Å²	104.2	43%	0.429	54%	0.54	S	S	.	.	H	α-helix	trans	-62.5	-39.2	179.2	49.9	0	0	0	0	113.1	L750 S751 L758	L750-T754 WeakPolarHBondContact O-CB 3.47Å; L750-T754 WeakPolarHBondContact O-CG2 3.26Å; L750-T754 PolarHBondContact O-N 2.97Å; L750-T754 PolarHBondContact O-OG1 2.78Å; S751-T754 PolarHBondContact O-OG1 2.9Å; T754-L758 WeakPolarHBondContact O-CB 3.42Å; T754-L758 PolarHBondContact O-N 2.85Å; T754-L758 VanDerWaalsContact O-N 3.1Å
755	N	87.6	Confident	86.4	Confident	92 Å²	92	106 Å²	106	49%	0.492	54%	0.543	S	S	.	.	H	α-helix	trans	-68	-40.3	175.5	-79.8	-49.6	0	0	0	112.7	S751 I752 E753 E757 L758 E759	S751-N755 WeakPolarHBondContact O-CB 3.35Å; S751-N755 PolarHBondContact O-N 3.17Å; S751-N755 VanDerWaalsContact O-N 3.16Å; S751-N755 PolarHBondContact O-ND2 3.19Å; I752-N755 PolarHBondContact O-N 3.01Å; E753-N755 PolarHBondContact O-N 3.03Å; N755-E757 VanDerWaalsContact C-N 3.34Å; N755-L758 PolarHBondContact O-N 2.81Å; N755-E759 PolarHBondContact O-N 2.82Å
756	A	84.9	Confident	86.2	Confident	60 Å²	60	103.5 Å²	103.5	50%	0.496	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-39.3	177.1	0	0	0	0	0	111.9	I752 E753 R760	I752-A756 WeakPolarHBondContact O-CB 3.43Å; I752-A756 PolarHBondContact O-N 3.44Å; E753-A756 PolarHBondContact O-N 2.77Å; A756-R760 WeakPolarHBondContact O-CB 3.48Å; A756-R760 PolarHBondContact O-N 2.83Å
757	E	84.6	Confident	86.1	Confident	119 Å²	119	98.8 Å²	98.8	56%	0.556	53%	0.534	S	S	*	.	H	α-helix	trans	-66.7	-38.2	176	-163.5	168.6	-135.4	0	0	112	E753 N755 R760 L761	E753-E757 PolarHBondContact O-N 3.42Å; N755-E757 VanDerWaalsContact C-N 3.34Å; E757-R760 PolarHBondContact O-N 2.86Å; E757-L761 WeakPolarHBondContact O-CB 3.27Å; E757-L761 WeakPolarHBondContact O-CG 3.28Å; E757-L761 PolarHBondContact O-N 2.87Å
758	L	85.4	Confident	85.9	Confident	90 Å²	90	101.4 Å²	101.4	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-65.3	-43.3	176.4	-135.3	174.9	0	0	0	112.5	T754 N755 L761 K762	T754-L758 WeakPolarHBondContact O-CB 3.42Å; T754-L758 PolarHBondContact O-N 2.85Å; T754-L758 VanDerWaalsContact O-N 3.1Å; N755-L758 PolarHBondContact O-N 2.81Å; L758-L761 PolarHBondContact O-N 2.75Å; L758-K762 HydrophobicContact CD2-CD 4.28Å; L758-K762 HydrophobicContact CD2-CG 4.36Å; L758-K762 WeakPolarHBondContact O-CG 3.45Å; L758-K762 PolarHBondContact O-N 2.94Å
759	E	87	Confident	85.7	Confident	94 Å²	94	100.6 Å²	100.6	44%	0.439	53%	0.534	S	S	.	.	H	α-helix	trans	-67.3	-40.4	174.9	-79.3	-57.8	130	0	0	112.3	N755 L761 K762 L763	N755-E759 PolarHBondContact O-N 2.82Å; E759-L761 VanDerWaalsContact C-N 3.31Å; E759-L761 PolarHBondContact O-N 2.82Å; E759-K762 PolarHBondContact O-N 3.06Å; E759-K762 WeakPolarHBondContact OE1-CD 3.36Å; E759-K762 IonicContact OE1-NZ 2.97Å; E759-K762 PolarHBondContact OE1-NZ 2.85Å; E759-L763 PolarHBondContact O-N 2.74Å
760	R	86.6	Confident	85.7	Confident	193 Å²	193	100.5 Å²	100.5	73%	0.728	53%	0.532	S	S	*	.	H	α-helix	trans	-57.8	-44.2	172.9	-176.9	-177.1	175.5	-165.3	-1.5	111.6	A756 E757 A764	A756-R760 WeakPolarHBondContact O-CB 3.48Å; A756-R760 PolarHBondContact O-N 2.83Å; E757-R760 PolarHBondContact O-N 2.86Å; R760-A764 WeakPolarHBondContact O-CB 3.38Å; R760-A764 PolarHBondContact O-N 2.71Å
761	L	83.8	Confident	85.5	Confident	114 Å²	114	102.4 Å²	102.4	60%	0.597	53%	0.533	S	S	*	.	H	α-helix	trans	-65.6	-41.1	177.2	-79.3	168.5	0	0	0	112.6	E757 L758 E759 R765	E757-L761 WeakPolarHBondContact O-CB 3.27Å; E757-L761 WeakPolarHBondContact O-CG 3.28Å; E757-L761 PolarHBondContact O-N 2.87Å; L758-L761 PolarHBondContact O-N 2.75Å; E759-L761 VanDerWaalsContact C-N 3.31Å; E759-L761 PolarHBondContact O-N 2.82Å; L761-R765 WeakPolarHBondContact O-CB 3.03Å; L761-R765 PolarHBondContact O-N 2.99Å
762	K	86.3	Confident	85.3	Confident	110 Å²	110	103.4 Å²	103.4	48%	0.478	53%	0.533	S	S	.	.	H	α-helix	trans	-60.5	-48.7	174.8	-79.1	164.2	167.9	169.8	0	112	L758 E759 R765 A766	L758-K762 HydrophobicContact CD2-CD 4.28Å; L758-K762 HydrophobicContact CD2-CG 4.36Å; L758-K762 WeakPolarHBondContact O-CG 3.45Å; L758-K762 PolarHBondContact O-N 2.94Å; E759-K762 PolarHBondContact O-N 3.06Å; E759-K762 WeakPolarHBondContact OE1-CD 3.36Å; E759-K762 IonicContact OE1-NZ 2.97Å; E759-K762 PolarHBondContact OE1-NZ 2.85Å; K762-R765 PolarHBondContact O-N 2.76Å; K762-A766 WeakPolarHBondContact O-CB 3.44Å; K762-A766 PolarHBondContact O-N 2.79Å
763	L	86.9	Confident	85.2	Confident	120 Å²	120	104.4 Å²	104.4	63%	0.628	53%	0.533	S	S	*	.	H	α-helix	trans	-61.8	-43.8	179.6	-77	165.8	0	0	0	111.8	E759 A766 A767	E759-L763 PolarHBondContact O-N 2.74Å; L763-A766 PolarHBondContact O-N 3.13Å; L763-A767 PolarHBondContact O-N 2.7Å
764	A	85.6	Confident	85.2	Confident	57 Å²	57	104.7 Å²	104.7	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-59.1	-48.1	175	0	0	0	0	0	111.9	R760 A766 A767 E768	R760-A764 WeakPolarHBondContact O-CB 3.38Å; R760-A764 PolarHBondContact O-N 2.71Å; A764-A766 PolarHBondContact O-N 3.06Å; A764-A767 PolarHBondContact O-N 2.99Å; A764-E768 WeakPolarHBondContact O-CB 3.31Å; A764-E768 PolarHBondContact O-N 2.69Å
765	R	82.5	Confident	85.3	Confident	179 Å²	179	107.3 Å²	107.3	68%	0.675	54%	0.54	S	S	*	.	H	α-helix	trans	-64.2	-37.4	178.2	-121.5	174	-178.4	165.9	0.5	113	L761 K762 E768 I769	L761-R765 WeakPolarHBondContact O-CB 3.03Å; L761-R765 PolarHBondContact O-N 2.99Å; K762-R765 PolarHBondContact O-N 2.76Å; R765-E768 PolarHBondContact O-N 2.84Å; R765-I769 WeakPolarHBondContact O-CB 3.29Å; R765-I769 WeakPolarHBondContact O-CD1 3.28Å; R765-I769 WeakPolarHBondContact O-CG1 3.29Å; R765-I769 PolarHBondContact O-N 2.96Å
766	A	86.4	Confident	85.1	Confident	59 Å²	59	107.3 Å²	107.3	49%	0.488	54%	0.54	S	S	.	.	H	α-helix	trans	-65.6	-44.2	177.2	0	0	0	0	0	111.6	K762 L763 A764 I769 A770	K762-A766 WeakPolarHBondContact O-CB 3.44Å; K762-A766 PolarHBondContact O-N 2.79Å; L763-A766 PolarHBondContact O-N 3.13Å; A764-A766 PolarHBondContact O-N 3.06Å; A766-I769 PolarHBondContact O-N 3.19Å; A766-A770 WeakPolarHBondContact O-CB 3.43Å; A766-A770 PolarHBondContact O-N 3.29Å
767	A	83.9	Confident	85.2	Confident	62 Å²	62	110.5 Å²	110.5	51%	0.512	54%	0.544	S	S	.	.	H	α-helix	trans	-64	-41.7	175	0	0	0	0	0	112.2	L763 A764 A770 Y771	L763-A767 PolarHBondContact O-N 2.7Å; A764-A767 PolarHBondContact O-N 2.99Å; A767-A770 PolarHBondContact O-N 2.8Å; A767-Y771 WeakPolarHBondContact O-CB 3.43Å; A767-Y771 PolarHBondContact O-N 2.81Å
768	E	82.2	Confident	85.2	Confident	118 Å²	118	110.6 Å²	110.6	55%	0.551	55%	0.548	S	S	*	.	H	α-helix	trans	-63.4	-44.4	177.1	-173.3	173.9	-147.8	0	0	112.2	A764 R765 A770 Y771 I772	A764-E768 WeakPolarHBondContact O-CB 3.31Å; A764-E768 PolarHBondContact O-N 2.69Å; R765-E768 PolarHBondContact O-N 2.84Å; E768-A770 PolarHBondContact O-N 2.92Å; E768-Y771 PolarHBondContact O-N 2.81Å; E768-I772 HydrophobicContact CG-CD1 4.04Å; E768-I772 WeakPolarHBondContact O-CB 3.49Å; E768-I772 VanDerWaalsContact O-CG1 3.26Å; E768-I772 WeakPolarHBondContact O-CG1 3.48Å; E768-I772 PolarHBondContact O-N 2.99Å
769	I	84.4	Confident	84.8	Confident	101 Å²	101	108.9 Å²	108.9	52%	0.518	55%	0.547	S	S	.	.	H	α-helix	trans	-64.2	-39.4	175.6	-70	165.4	0	0	0	111.5	R765 A766 K773	R765-I769 WeakPolarHBondContact O-CB 3.29Å; R765-I769 WeakPolarHBondContact O-CD1 3.28Å; R765-I769 WeakPolarHBondContact O-CG1 3.29Å; R765-I769 PolarHBondContact O-N 2.96Å; A766-I769 PolarHBondContact O-N 3.19Å; I769-K773 PolarHBondContact O-N 2.71Å
770	A	86	Confident	84.5	Confident	53 Å²	53	110.5 Å²	110.5	44%	0.438	56%	0.558	S	S	.	*	H	α-helix	trans	-64	-47.1	176.3	0	0	0	0	0	111.7	A766 A767 E768 I772 K773 E774	A766-A770 WeakPolarHBondContact O-CB 3.43Å; A766-A770 PolarHBondContact O-N 3.29Å; A767-A770 PolarHBondContact O-N 2.8Å; E768-A770 PolarHBondContact O-N 2.92Å; A770-I772 PolarHBondContact O-N 2.9Å; A770-K773 WeakPolarHBondContact O-CB 3.36Å; A770-K773 PolarHBondContact O-N 2.83Å; A770-K773 VanDerWaalsContact O-N 3.16Å; A770-E774 PolarHBondContact O-N 2.92Å
771	Y	86.7	Confident	84.4	Confident	146 Å²	146	108.5 Å²	108.5	57%	0.573	56%	0.555	S	S	*	*	H	α-helix	trans	-60.2	-42.7	176	173.6	-108.5	0	0	0	112.6	A767 E768 K773 E774 K775	A767-Y771 WeakPolarHBondContact O-CB 3.43Å; A767-Y771 PolarHBondContact O-N 2.81Å; E768-Y771 PolarHBondContact O-N 2.81Å; Y771-K773 VanDerWaalsContact C-N 3.31Å; Y771-K773 PolarHBondContact O-N 3.16Å; Y771-E774 PolarHBondContact O-N 3.27Å; Y771-K775 HydrophobicContact CE1-CD 4.43Å; Y771-K775 VanDerWaalsContact O-CB 3.25Å; Y771-K775 WeakPolarHBondContact O-CB 3.12Å; Y771-K775 PolarHBondContact O-N 2.84Å
772	I	84.1	Confident	84.2	Confident	81 Å²	81	110.7 Å²	110.7	42%	0.415	56%	0.556	S	S	.	*	H	α-helix	trans	-63.4	-37.8	176	-69.7	165.8	0	0	0	111.1	E768 A770 N776	E768-I772 HydrophobicContact CG-CD1 4.04Å; E768-I772 WeakPolarHBondContact O-CB 3.49Å; E768-I772 VanDerWaalsContact O-CG1 3.26Å; E768-I772 WeakPolarHBondContact O-CG1 3.48Å; E768-I772 PolarHBondContact O-N 2.99Å; A770-I772 PolarHBondContact O-N 2.9Å; I772-N776 WeakPolarHBondContact O-CB 3.32Å; I772-N776 PolarHBondContact O-N 3.47Å; I772-N776 PolarHBondContact O-ND2 2.89Å
773	K	86	Confident	83.9	Confident	141 Å²	141	112.3 Å²	112.3	61%	0.613	56%	0.563	S	S	*	*	H	α-helix	trans	-62.8	-54.4	174.1	-94	-173.3	169.6	-171.8	0	112.4	I769 A770 Y771 K775 N776 E777	I769-K773 PolarHBondContact O-N 2.71Å; A770-K773 WeakPolarHBondContact O-CB 3.36Å; A770-K773 PolarHBondContact O-N 2.83Å; A770-K773 VanDerWaalsContact O-N 3.16Å; Y771-K773 VanDerWaalsContact C-N 3.31Å; Y771-K773 PolarHBondContact O-N 3.16Å; K773-K775 VanDerWaalsContact C-N 3.29Å; K773-K775 PolarHBondContact O-N 2.97Å; K773-N776 PolarHBondContact O-N 3.08Å; K773-N776 VanDerWaalsContact O-N 3.11Å; K773-E777 PolarHBondContact O-N 2.79Å
774	E	85.8	Confident	83.6	Confident	140 Å²	140	109 Å²	109	65%	0.654	55%	0.553	S	S	*	*	H	α-helix	trans	-57.8	-43	178.8	-75.2	-166.5	141.8	0	0	111.6	A770 Y771 N776 E777 L778	A770-E774 PolarHBondContact O-N 2.92Å; Y771-E774 PolarHBondContact O-N 3.27Å; E774-N776 VanDerWaalsContact C-N 3.32Å; E774-N776 PolarHBondContact O-N 3.35Å; E774-E777 PolarHBondContact O-N 3.04Å; E774-L778 VanDerWaalsContact O-CB 3.29Å; E774-L778 WeakPolarHBondContact O-CB 3.38Å; E774-L778 PolarHBondContact O-N 2.82Å
775	K	85.2	Confident	83.5	Confident	125 Å²	125	110.7 Å²	110.7	54%	0.543	55%	0.554	S	S	.	*	H	α-helix	trans	-59.9	-41	176.8	-175.9	177.4	178.7	179.1	0	112.4	Y771 K773 A779	Y771-K775 HydrophobicContact CE1-CD 4.43Å; Y771-K775 VanDerWaalsContact O-CB 3.25Å; Y771-K775 WeakPolarHBondContact O-CB 3.12Å; Y771-K775 PolarHBondContact O-N 2.84Å; K773-K775 VanDerWaalsContact C-N 3.29Å; K773-K775 PolarHBondContact O-N 2.97Å; K775-A779 WeakPolarHBondContact O-CB 3.4Å; K775-A779 PolarHBondContact O-N 2.87Å
776	N	82.4	Confident	83.5	Confident	91 Å²	91	106.8 Å²	106.8	49%	0.487	54%	0.544	S	S	.	.	H	α-helix	trans	-72.2	-38.8	178.4	-72.2	-17.9	0	0	0	112.3	I772 K773 E774 A779 L780	I772-N776 WeakPolarHBondContact O-CB 3.32Å; I772-N776 PolarHBondContact O-N 3.47Å; I772-N776 PolarHBondContact O-ND2 2.89Å; K773-N776 PolarHBondContact O-N 3.08Å; K773-N776 VanDerWaalsContact O-N 3.11Å; E774-N776 VanDerWaalsContact C-N 3.32Å; E774-N776 PolarHBondContact O-N 3.35Å; N776-A779 PolarHBondContact O-N 3.22Å; N776-L780 WeakPolarHBondContact O-CB 3.39Å; N776-L780 WeakPolarHBondContact O-CG 3.25Å; N776-L780 PolarHBondContact O-N 2.82Å
777	E	87.1	Confident	83	Confident	127 Å²	127	108.1 Å²	108.1	59%	0.593	55%	0.546	S	S	*	.	H	α-helix	trans	-65.1	-40.3	174.2	-73.6	-176.8	177.7	0	0	111.9	K773 E774 L780 K781	K773-E777 PolarHBondContact O-N 2.79Å; E774-E777 PolarHBondContact O-N 3.04Å; E777-L780 PolarHBondContact O-N 3.44Å; E777-K781 PolarHBondContact O-N 2.86Å
778	L	84.1	Confident	82.9	Confident	121 Å²	121	111.6 Å²	111.6	63%	0.634	55%	0.552	S	S	*	*	H	α-helix	trans	-66.6	-40.5	176.2	-166.2	148.7	0	0	0	111.4	E774 K781 Y782	E774-L778 VanDerWaalsContact O-CB 3.29Å; E774-L778 WeakPolarHBondContact O-CB 3.38Å; E774-L778 PolarHBondContact O-N 2.82Å; L778-K781 PolarHBondContact O-N 2.75Å; L778-Y782 WeakPolarHBondContact O-CB 3.49Å; L778-Y782 PolarHBondContact O-N 2.73Å
779	A	78.1	Confident	82.8	Confident	55 Å²	55	111.3 Å²	111.3	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-65.1	-37.1	173.2	0	0	0	0	0	112.9	K775 N776 K783	K775-A779 WeakPolarHBondContact O-CB 3.4Å; K775-A779 PolarHBondContact O-N 2.87Å; N776-A779 PolarHBondContact O-N 3.22Å; A779-K783 PolarHBondContact O-N 2.8Å
780	L	81.4	Confident	82.2	Confident	127 Å²	127	112.4 Å²	112.4	67%	0.665	56%	0.556	S	S	*	*	H	α-helix	trans	-65.6	-44.6	174.9	-84.8	164.3	0	0	0	112.1	N776 E777 K783 A784	N776-L780 WeakPolarHBondContact O-CB 3.39Å; N776-L780 WeakPolarHBondContact O-CG 3.25Å; N776-L780 PolarHBondContact O-N 2.82Å; E777-L780 PolarHBondContact O-N 3.44Å; L780-K783 PolarHBondContact O-N 3.09Å; L780-A784 PolarHBondContact O-N 3.07Å
781	K	83	Confident	81.8	Confident	152 Å²	152	116.8 Å²	116.8	66%	0.661	57%	0.565	S	S	*	*	H	α-helix	trans	-59.2	-51	172.7	-82.5	-177.3	172.9	176.7	0	111.6	E777 L778 K783 A784 D785	E777-K781 PolarHBondContact O-N 2.86Å; L778-K781 PolarHBondContact O-N 2.75Å; K781-K783 VanDerWaalsContact C-N 3.26Å; K781-K783 PolarHBondContact O-N 3.03Å; K781-A784 WeakPolarHBondContact O-CB 3.43Å; K781-A784 PolarHBondContact O-N 3.18Å; K781-D785 VanDerWaalsContact O-CG 3.28Å; K781-D785 PolarHBondContact O-N 2.83Å
782	Y	80.9	Confident	81.4	Confident	159 Å²	159	113.2 Å²	113.2	62%	0.624	56%	0.561	S	S	*	*	H	α-helix	trans	-55.9	-42.2	-179.4	-162.7	-82.4	0	0	0	111.9	L778 E786	L778-Y782 WeakPolarHBondContact O-CB 3.49Å; L778-Y782 PolarHBondContact O-N 2.73Å; Y782-E786 WeakPolarHBondContact O-CB 3.17Å; Y782-E786 PolarHBondContact O-N 3.07Å
783	K	78.9	Confident	81	Confident	145 Å²	145	117.6 Å²	117.6	63%	0.63	57%	0.572	S	S	*	*	H	α-helix	trans	-67.6	-37.7	175.3	-116.4	-170.1	177.6	-171.5	0	113.6	A779 L780 K781 T787	A779-K783 PolarHBondContact O-N 2.8Å; L780-K783 PolarHBondContact O-N 3.09Å; K781-K783 VanDerWaalsContact C-N 3.26Å; K781-K783 PolarHBondContact O-N 3.03Å; K783-T787 WeakPolarHBondContact O-CG2 3.37Å; K783-T787 PolarHBondContact O-N 3.25Å; K783-T787 PolarHBondContact O-OG1 3.46Å; K783-T787 VanDerWaalsContact O-OG1 3.13Å
784	A	81.5	Confident	80.3	Confident	51 Å²	51	117.9 Å²	117.9	42%	0.421	57%	0.574	S	S	.	*	H	α-helix	trans	-63.1	-51.3	176.3	0	0	0	0	0	110.4	L780 K781 E786 T787 E788	L780-A784 PolarHBondContact O-N 3.07Å; K781-A784 WeakPolarHBondContact O-CB 3.43Å; K781-A784 PolarHBondContact O-N 3.18Å; A784-E786 VanDerWaalsContact C-N 3.34Å; A784-E786 PolarHBondContact O-N 2.86Å; A784-T787 PolarHBondContact O-N 3.44Å; A784-T787 PolarHBondContact O-OG1 2.6Å; A784-E788 PolarHBondContact O-N 2.94Å
785	D	82.7	Confident	79.9	Confident	92 Å²	92	115.4 Å²	115.4	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-58.9	-44.4	177.6	-59.6	-16.4	0	0	0	111	K781 E788 I789	K781-D785 VanDerWaalsContact O-CG 3.28Å; K781-D785 PolarHBondContact O-N 2.83Å; D785-E788 PolarHBondContact O-N 3.06Å; D785-I789 WeakPolarHBondContact O-CB 3.37Å; D785-I789 VanDerWaalsContact O-CG1 3.25Å; D785-I789 WeakPolarHBondContact O-CG1 3.4Å; D785-I789 PolarHBondContact O-N 2.69Å
786	E	82	Confident	79.5	Confident	96 Å²	96	112.6 Å²	112.6	45%	0.449	56%	0.56	S	S	.	*	H	α-helix	trans	-59.6	-46.1	175.6	-176.8	173.3	-134.4	0	0	112	Y782 A784 E788 I789 E790	Y782-E786 WeakPolarHBondContact O-CB 3.17Å; Y782-E786 PolarHBondContact O-N 3.07Å; A784-E786 VanDerWaalsContact C-N 3.34Å; A784-E786 PolarHBondContact O-N 2.86Å; E786-E788 VanDerWaalsContact C-N 3.33Å; E786-E788 PolarHBondContact O-N 2.88Å; E786-I789 PolarHBondContact O-N 2.87Å; E786-E790 PolarHBondContact O-N 2.89Å
787	T	76.4	Confident	78.8	Confident	87 Å²	87	113.9 Å²	113.9	53%	0.534	57%	0.565	S	S	.	*	H	α-helix	trans	-67.4	-30.6	175.9	56.1	0	0	0	0	113.6	K783 A784 K791	K783-T787 WeakPolarHBondContact O-CG2 3.37Å; K783-T787 PolarHBondContact O-N 3.25Å; K783-T787 PolarHBondContact O-OG1 3.46Å; K783-T787 VanDerWaalsContact O-OG1 3.13Å; A784-T787 PolarHBondContact O-N 3.44Å; A784-T787 PolarHBondContact O-OG1 2.6Å; T787-K791 WeakPolarHBondContact O-CB 3.44Å; T787-K791 PolarHBondContact O-N 3.36Å
788	E	81.5	Confident	78	Confident	136 Å²	136	110.4 Å²	110.4	64%	0.636	55%	0.552	S	S	*	*	H	α-helix	trans	-73.3	-38.8	175.5	-171.8	158.4	-143.2	0	0	111.5	A784 D785 E786 K791 S792	A784-E788 PolarHBondContact O-N 2.94Å; D785-E788 PolarHBondContact O-N 3.06Å; E786-E788 VanDerWaalsContact C-N 3.33Å; E786-E788 PolarHBondContact O-N 2.88Å; E788-K791 PolarHBondContact O-N 2.63Å; E788-S792 WeakPolarHBondContact O-CB 3.43Å; E788-S792 PolarHBondContact O-N 3.36Å; E788-S792 PolarHBondContact O-OG 3.1Å
789	I	79.9	Confident	77.5	Confident	112 Å²	112	110.4 Å²	110.4	57%	0.574	55%	0.553	S	S	*	*	H	α-helix	trans	-61.1	-49.9	170.5	-69.2	164.7	0	0	0	110.3	D785 E786 K791 S792 R793	D785-I789 WeakPolarHBondContact O-CB 3.37Å; D785-I789 VanDerWaalsContact O-CG1 3.25Å; D785-I789 WeakPolarHBondContact O-CG1 3.4Å; D785-I789 PolarHBondContact O-N 2.69Å; E786-I789 PolarHBondContact O-N 2.87Å; I789-K791 VanDerWaalsContact C-N 3.34Å; I789-K791 PolarHBondContact O-N 2.77Å; I789-S792 PolarHBondContact O-N 3.43Å; I789-S792 PolarHBondContact O-OG 3.28Å; I789-R793 WeakPolarHBondContact O-CB 3.41Å; I789-R793 PolarHBondContact O-N 2.83Å
790	E	73.6	Confident	77.4	Confident	124 Å²	124	113.6 Å²	113.6	58%	0.579	57%	0.567	S	S	*	*	H	α-helix	trans	-59.6	-43.2	176.4	-76.3	-147.3	132.3	0	0	112.3	E786 S792 R793 F794	E786-E790 PolarHBondContact O-N 2.89Å; E790-S792 PolarHBondContact O-N 2.98Å; E790-R793 PolarHBondContact O-N 2.89Å; E790-F794 WeakPolarHBondContact O-CB 3.43Å; E790-F794 PolarHBondContact O-N 2.99Å
791	K	76.1	Confident	76.4	Confident	145 Å²	145	110.1 Å²	110.1	63%	0.63	55%	0.548	S	S	*	.	H	α-helix	trans	-61.7	-44.1	177.5	-170.4	-178.9	-176.1	-174.7	0	111.7	T787 E788 I789 F794 I795	T787-K791 WeakPolarHBondContact O-CB 3.44Å; T787-K791 PolarHBondContact O-N 3.36Å; E788-K791 PolarHBondContact O-N 2.63Å; I789-K791 VanDerWaalsContact C-N 3.34Å; I789-K791 PolarHBondContact O-N 2.77Å; K791-F794 PolarHBondContact O-N 2.8Å; K791-I795 HydrophobicContact CG-CD1 4.1Å; K791-I795 WeakPolarHBondContact O-CB 3.45Å; K791-I795 WeakPolarHBondContact O-CD1 3.4Å; K791-I795 VanDerWaalsContact O-CG1 3.24Å; K791-I795 WeakPolarHBondContact O-CG1 3.45Å; K791-I795 PolarHBondContact O-N 3.37Å
792	S	78.1	Confident	75.7	Confident	70 Å²	70	104.1 Å²	104.1	49%	0.49	53%	0.53	S	S	.	.	H	α-helix	trans	-65.6	-41.1	176.5	74.6	0	0	0	0	112.2	E788 I789 E790 I795 S796	E788-S792 WeakPolarHBondContact O-CB 3.43Å; E788-S792 PolarHBondContact O-N 3.36Å; E788-S792 PolarHBondContact O-OG 3.1Å; I789-S792 PolarHBondContact O-N 3.43Å; I789-S792 PolarHBondContact O-OG 3.28Å; E790-S792 PolarHBondContact O-N 2.98Å; S792-I795 PolarHBondContact O-N 3.32Å; S792-S796 VanDerWaalsContact O-CB 3.31Å; S792-S796 WeakPolarHBondContact O-CB 3.44Å; S792-S796 PolarHBondContact O-N 3.06Å
793	R	76	Confident	75.2	Confident	173 Å²	173	100.1 Å²	100.1	65%	0.653	53%	0.53	S	S	*	.	H	α-helix	trans	-62.5	-43.5	175	-176.5	-178.7	178.1	-168.7	-0.2	111.3	I789 E790 S796 M797	I789-R793 WeakPolarHBondContact O-CB 3.41Å; I789-R793 PolarHBondContact O-N 2.83Å; E790-R793 PolarHBondContact O-N 2.89Å; R793-S796 PolarHBondContact O-N 3.29Å; R793-M797 VanDerWaalsContact O-CB 3.29Å; R793-M797 WeakPolarHBondContact O-CB 3.48Å; R793-M797 PolarHBondContact O-N 2.99Å
794	F	71.4	Confident	74.7	Confident	147 Å²	147	98.3 Å²	98.3	65%	0.645	53%	0.527	S	S	*	.	H	α-helix	trans	-65.9	-45.3	178.1	-166.5	-92.4	0	0	0	111.7	E790 K791 S796 M797 V798	E790-F794 WeakPolarHBondContact O-CB 3.43Å; E790-F794 PolarHBondContact O-N 2.99Å; K791-F794 PolarHBondContact O-N 2.8Å; F794-S796 PolarHBondContact O-N 3.31Å; F794-M797 PolarHBondContact O-N 2.86Å; F794-V798 HydrophobicContact CD1-CG2 4.06Å; F794-V798 HydrophobicContact CE1-CG2 3.84Å; F794-V798 HydrophobicContact CZ-CG2 4.39Å; F794-V798 WeakPolarHBondContact O-CG2 3.47Å; F794-V798 PolarHBondContact O-N 2.84Å
795	I	77.8	Confident	73.9	Confident	88 Å²	88	99.5 Å²	99.5	45%	0.451	53%	0.529	S	S	.	.	H	α-helix	trans	-60.3	-45.6	174.6	-69.4	164.4	0	0	0	111.1	K791 S792 M797 V798 N799	K791-I795 HydrophobicContact CG-CD1 4.1Å; K791-I795 WeakPolarHBondContact O-CB 3.45Å; K791-I795 WeakPolarHBondContact O-CD1 3.4Å; K791-I795 VanDerWaalsContact O-CG1 3.24Å; K791-I795 WeakPolarHBondContact O-CG1 3.45Å; K791-I795 PolarHBondContact O-N 3.37Å; S792-I795 PolarHBondContact O-N 3.32Å; I795-M797 VanDerWaalsContact C-N 3.34Å; I795-M797 PolarHBondContact O-N 2.92Å; I795-V798 PolarHBondContact O-N 2.87Å; I795-N799 WeakPolarHBondContact O-CB 3.32Å; I795-N799 VanDerWaalsContact O-CG 3.31Å; I795-N799 PolarHBondContact O-N 2.83Å; I795-N799 PolarHBondContact O-ND2 3.14Å
796	S	75.8	Confident	73	Confident	67 Å²	67	98.1 Å²	98.1	47%	0.469	52%	0.521	S	S	.	.	H	α-helix	trans	-58.2	-46.2	175.3	179.8	0	0	0	0	111.6	S792 R793 F794 N799 V800	S792-S796 VanDerWaalsContact O-CB 3.31Å; S792-S796 WeakPolarHBondContact O-CB 3.44Å; S792-S796 PolarHBondContact O-N 3.06Å; R793-S796 PolarHBondContact O-N 3.29Å; F794-S796 PolarHBondContact O-N 3.31Å; S796-N799 PolarHBondContact O-N 3.1Å; S796-V800 WeakPolarHBondContact O-CB 3.5Å; S796-V800 WeakPolarHBondContact O-CG2 3.27Å; S796-V800 PolarHBondContact O-N 2.83Å
797	M	68.9	Low	72.3	Confident	117 Å²	117	100.2 Å²	100.2	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-64.3	-43	-179.5	-162.2	160.7	-176.3	0	0	111.9	R793 F794 I795 L801	R793-M797 VanDerWaalsContact O-CB 3.29Å; R793-M797 WeakPolarHBondContact O-CB 3.48Å; R793-M797 PolarHBondContact O-N 2.99Å; F794-M797 PolarHBondContact O-N 2.86Å; I795-M797 VanDerWaalsContact C-N 3.34Å; I795-M797 PolarHBondContact O-N 2.92Å; M797-L801 HydrophobicContact CG-CD1 4.15Å; M797-L801 VanDerWaalsContact O-CB 3.29Å; M797-L801 WeakPolarHBondContact O-CB 3.34Å; M797-L801 WeakPolarHBondContact O-CD1 3.37Å; M797-L801 VanDerWaalsContact O-CG 3.3Å; M797-L801 WeakPolarHBondContact O-CG 3.45Å; M797-L801 PolarHBondContact O-N 2.79Å
798	V	71	Confident	71.5	Confident	55 Å²	55	98.7 Å²	98.7	33%	0.333	52%	0.521	S	S	.	.	H	α-helix	trans	-62.3	-43.1	174	169.1	0	0	0	0	111.7	F794 I795 G802 L806	F794-V798 HydrophobicContact CD1-CG2 4.06Å; F794-V798 HydrophobicContact CE1-CG2 3.84Å; F794-V798 HydrophobicContact CZ-CG2 4.39Å; F794-V798 WeakPolarHBondContact O-CG2 3.47Å; F794-V798 PolarHBondContact O-N 2.84Å; I795-V798 PolarHBondContact O-N 2.87Å; V798-G802 PolarHBondContact O-N 3.06Å; V798-L806 HydrophobicContact CG1-CD1 3.97Å
799	N	72.7	Confident	70.7	Confident	120 Å²	120	97.9 Å²	97.9	64%	0.642	52%	0.519	S	S	*	.	H	α-helix	trans	-68.6	-40.4	179.6	-75.2	-16.4	0	0	0	112.9	I795 S796 G802	I795-N799 WeakPolarHBondContact O-CB 3.32Å; I795-N799 VanDerWaalsContact O-CG 3.31Å; I795-N799 PolarHBondContact O-N 2.83Å; I795-N799 PolarHBondContact O-ND2 3.14Å; S796-N799 PolarHBondContact O-N 3.1Å; N799-G802 PolarHBondContact O-N 2.89Å
800	V	75.7	Confident	70	Confident	123 Å²	123	96.3 Å²	96.3	75%	0.745	52%	0.522	S	S	*	.	H	α-helix	trans	-70.5	-36.8	176.7	171.9	0	0	0	0	111.5	S796 G802	S796-V800 WeakPolarHBondContact O-CB 3.5Å; S796-V800 WeakPolarHBondContact O-CG2 3.27Å; S796-V800 PolarHBondContact O-N 2.83Å; V800-G802 VanDerWaalsContact C-N 3.32Å
801	L	60.9	Low	69.5	Low	54 Å²	54	92.8 Å²	92.8	28%	0.283	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-36.5	173.9	-81.1	162.5	0	0	0	111.8	M797 T805 L806 M809	M797-L801 HydrophobicContact CG-CD1 4.15Å; M797-L801 VanDerWaalsContact O-CB 3.29Å; M797-L801 WeakPolarHBondContact O-CB 3.34Å; M797-L801 WeakPolarHBondContact O-CD1 3.37Å; M797-L801 VanDerWaalsContact O-CG 3.3Å; M797-L801 WeakPolarHBondContact O-CG 3.45Å; M797-L801 PolarHBondContact O-N 2.79Å; L801-T805 WeakPolarHBondContact O-CB 3.45Å; L801-T805 PolarHBondContact O-OG1 2.86Å; L801-L806 HydrophobicContact CB-CD1 4.38Å; L801-L806 HydrophobicContact CB-CD2 4.3Å; L801-L806 HydrophobicContact CB-CG 4Å; L801-L806 HydrophobicContact CD1-CD2 4.26Å; L801-M809 HydrophobicContact CD2-CE 4.21Å; L801-M809 HydrophobicContact CD2-SD 4.02Å
802	G	67.6	Low	68.9	Low	26 Å²	26	87.9 Å²	87.9	27%	0.268	50%	0.496	S	S	.	.	H	α-helix	trans	71.9	156	174.6	0	0	0	0	0	114.2	V798 N799 V800 D804 T805 L806	V798-G802 PolarHBondContact O-N 3.06Å; N799-G802 PolarHBondContact O-N 2.89Å; V800-G802 VanDerWaalsContact C-N 3.32Å; G802-D804 VanDerWaalsContact C-N 3.33Å; G802-D804 PolarHBondContact O-N 2.74Å; G802-T805 PolarHBondContact O-N 2.87Å; G802-L806 WeakPolarHBondContact O-CB 3.39Å; G802-L806 WeakPolarHBondContact O-CG 3.47Å; G802-L806 PolarHBondContact O-N 3.49Å
803	A	70.9	Confident	68.2	Low	75 Å²	75	91.3 Å²	91.3	62%	0.62	50%	0.504	S	S	*	.	H	α-helix	trans	-64.5	-32.2	-169.9	0	0	0	0	0	114.2	R807	A803-R807 VanDerWaalsContact O-CB 3.32Å; A803-R807 WeakPolarHBondContact O-CB 3.42Å; A803-R807 PolarHBondContact O-N 2.83Å; A803-R807 VanDerWaalsContact O-N 3.08Å
804	D	67.7	Low	67.6	Low	106 Å²	106	85.7 Å²	85.7	57%	0.567	49%	0.492	S	S	*	.	H	α-helix	trans	-76	-40.1	-179.9	-66.5	-53.4	0	0	0	112.3	G802 R807 A808	G802-D804 VanDerWaalsContact C-N 3.33Å; G802-D804 PolarHBondContact O-N 2.74Å; D804-R807 WeakPolarHBondContact O-CB 3.33Å; D804-R807 PolarHBondContact O-N 2.96Å; D804-R807 IonicContact OD1-CZ 2.7Å; D804-R807 IonicContact OD1-NH1 3.26Å; D804-R807 PolarHBondContact OD1-NH1 3.46Å; D804-R807 IonicContact OD1-NH2 2.68Å; D804-R807 PolarHBondContact OD1-NH2 2.82Å; D804-A808 WeakPolarHBondContact O-CB 3.29Å; D804-A808 PolarHBondContact O-N 2.93Å
805	T	66	Low	67.1	Low	77 Å²	77	82.3 Å²	82.3	47%	0.472	48%	0.48	S	S	.	.	H	α-helix	trans	-74.8	-35.4	178.2	-16	0	0	0	0	111.6	L801 G802 R807 A808 M809	L801-T805 WeakPolarHBondContact O-CB 3.45Å; L801-T805 PolarHBondContact O-OG1 2.86Å; G802-T805 PolarHBondContact O-N 2.87Å; T805-R807 VanDerWaalsContact C-N 3.34Å; T805-A808 PolarHBondContact O-N 3.44Å; T805-M809 WeakPolarHBondContact O-CB 3.43Å; T805-M809 WeakPolarHBondContact O-CG 3.48Å; T805-M809 PolarHBondContact O-N 3.11Å
806	L	63.1	Low	66.5	Low	62 Å²	62	82.6 Å²	82.6	33%	0.325	48%	0.482	S	S	.	.	H	α-helix	trans	-62.6	-39.6	168.7	-77.6	165.3	0	0	0	111.9	V798 L801 G802 M809 A810	V798-L806 HydrophobicContact CG1-CD1 3.97Å; L801-L806 HydrophobicContact CB-CD1 4.38Å; L801-L806 HydrophobicContact CB-CD2 4.3Å; L801-L806 HydrophobicContact CB-CG 4Å; L801-L806 HydrophobicContact CD1-CD2 4.26Å; G802-L806 WeakPolarHBondContact O-CB 3.39Å; G802-L806 WeakPolarHBondContact O-CG 3.47Å; G802-L806 PolarHBondContact O-N 3.49Å; L806-M809 PolarHBondContact O-N 2.81Å; L806-A810 VanDerWaalsContact O-CB 3.28Å; L806-A810 WeakPolarHBondContact O-CB 3.45Å; L806-A810 PolarHBondContact O-N 3.49Å
807	R	66.7	Low	65.4	Low	141 Å²	141	80.3 Å²	80.3	53%	0.532	47%	0.467	S	S	.	.	H	α-helix	trans	-63.3	-47.6	173.4	-166.9	-170.1	-47.3	124.5	19.7	110.8	A803 D804 T805 M809 A810 T811	A803-R807 VanDerWaalsContact O-CB 3.32Å; A803-R807 WeakPolarHBondContact O-CB 3.42Å; A803-R807 PolarHBondContact O-N 2.83Å; A803-R807 VanDerWaalsContact O-N 3.08Å; D804-R807 WeakPolarHBondContact O-CB 3.33Å; D804-R807 PolarHBondContact O-N 2.96Å; D804-R807 IonicContact OD1-CZ 2.7Å; D804-R807 IonicContact OD1-NH1 3.26Å; D804-R807 PolarHBondContact OD1-NH1 3.46Å; D804-R807 IonicContact OD1-NH2 2.68Å; D804-R807 PolarHBondContact OD1-NH2 2.82Å; T805-R807 VanDerWaalsContact C-N 3.34Å; R807-M809 VanDerWaalsContact C-N 3.32Å; R807-M809 PolarHBondContact O-N 2.87Å; R807-A810 PolarHBondContact O-N 3.28Å; R807-T811 HydrophobicContact CG-CG2 4.42Å; R807-T811 WeakPolarHBondContact O-CG2 3.5Å; R807-T811 PolarHBondContact O-N 3.01Å; R807-T811 PolarHBondContact O-OG1 3.34Å
808	A	61	Low	64.7	Low	54 Å²	54	79.6 Å²	79.6	45%	0.446	47%	0.465	S	S	.	.	H	α-helix	trans	-60.9	-39.2	177	0	0	0	0	0	112.4	D804 T805 A812	D804-A808 WeakPolarHBondContact O-CB 3.29Å; D804-A808 PolarHBondContact O-N 2.93Å; T805-A808 PolarHBondContact O-N 3.44Å; A808-A812 WeakPolarHBondContact O-CA 3.44Å; A808-A812 WeakPolarHBondContact O-CB 3.12Å; A808-A812 PolarHBondContact O-N 2.9Å
809	M	63.8	Low	64.2	Low	120 Å²	120	85.4 Å²	85.4	59%	0.591	48%	0.481	S	S	*	.	H	α-helix	trans	-67.2	-42.2	174.4	-76.9	178.6	152.4	0	0	112.5	L801 T805 L806 R807	L801-M809 HydrophobicContact CD2-CE 4.21Å; L801-M809 HydrophobicContact CD2-SD 4.02Å; T805-M809 WeakPolarHBondContact O-CB 3.43Å; T805-M809 WeakPolarHBondContact O-CG 3.48Å; T805-M809 PolarHBondContact O-N 3.11Å; L806-M809 PolarHBondContact O-N 2.81Å; R807-M809 VanDerWaalsContact C-N 3.32Å; R807-M809 PolarHBondContact O-N 2.87Å
810	A	64.5	Low	63.3	Low	79 Å²	79	84.8 Å²	84.8	65%	0.653	48%	0.475	S	S	*	.	H	α-helix	trans	-70	-35.7	178.7	0	0	0	0	0	112.8	L806 R807	L806-A810 VanDerWaalsContact O-CB 3.28Å; L806-A810 WeakPolarHBondContact O-CB 3.45Å; L806-A810 PolarHBondContact O-N 3.49Å; R807-A810 PolarHBondContact O-N 3.28Å
811	T	64.1	Low	62.1	Low	49 Å²	49	81.2 Å²	81.2	30%	0.301	45%	0.452	S	S	.	.	H	α-helix	trans	-88	-17.2	176.4	73.2	0	0	0	0	113.7	R807 E813 S814 D815	R807-T811 HydrophobicContact CG-CG2 4.42Å; R807-T811 WeakPolarHBondContact O-CG2 3.5Å; R807-T811 PolarHBondContact O-N 3.01Å; R807-T811 PolarHBondContact O-OG1 3.34Å; T811-E813 VanDerWaalsContact C-N 3.27Å; T811-E813 PolarHBondContact O-N 3.4Å; T811-S814 WeakPolarHBondContact CA-OG 3.44Å; T811-S814 CarbonylContact O-C 3.58Å; T811-S814 PolarHBondContact O-N 2.84Å; T811-S814 PolarHBondContact O-OG 3.3Å; T811-D815 WeakPolarHBondContact CB-OD2 3.43Å; T811-D815 WeakPolarHBondContact O-CB 3.33Å; T811-D815 PolarHBondContact O-N 2.9Å; T811-D815 PolarHBondContact OG1-OD2 3.15Å
812	A	64	Low	61.8	Low	43 Å²	43	85.4 Å²	85.4	36%	0.355	47%	0.474	S	S	.	.	H	α-helix	trans	-54.3	-41.6	-176.8	0	0	0	0	0	113.2	A808 N816	A808-A812 WeakPolarHBondContact O-CA 3.44Å; A808-A812 WeakPolarHBondContact O-CB 3.12Å; A808-A812 PolarHBondContact O-N 2.9Å; A812-N816 WeakPolarHBondContact O-CB 3.37Å; A812-N816 PolarHBondContact O-N 2.92Å
813	E	62.1	Low	61.4	Low	141 Å²	141	88.2 Å²	88.2	66%	0.659	50%	0.495	S	S	*	.	H	α-helix	trans	-68.1	-46.7	176	-167.9	172.2	-171.1	0	0	110.9	T811 D815 S817	T811-E813 VanDerWaalsContact C-N 3.27Å; T811-E813 PolarHBondContact O-N 3.4Å; E813-D815 PolarHBondContact O-N 2.83Å; E813-S817 WeakPolarHBondContact O-CB 3.45Å; E813-S817 PolarHBondContact O-N 2.94Å; E813-S817 PolarHBondContact O-OG 3.33Å
814	S	64.1	Low	60.9	Low	56 Å²	56	89.9 Å²	89.9	39%	0.392	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-37.1	177.5	58.5	0	0	0	0	113.8	T811 S817 L818	T811-S814 WeakPolarHBondContact CA-OG 3.44Å; T811-S814 CarbonylContact O-C 3.58Å; T811-S814 PolarHBondContact O-N 2.84Å; T811-S814 PolarHBondContact O-OG 3.3Å; S814-S817 PolarHBondContact O-N 2.88Å; S814-L818 VanDerWaalsContact O-CB 3.28Å; S814-L818 WeakPolarHBondContact O-CB 3.14Å; S814-L818 WeakPolarHBondContact O-CD1 3.24Å; S814-L818 VanDerWaalsContact O-CG 3.22Å; S814-L818 WeakPolarHBondContact O-CG 3.38Å; S814-L818 PolarHBondContact O-N 3.23Å
815	D	61.4	Low	60.5	Low	75 Å²	75	88.3 Å²	88.3	40%	0.401	50%	0.502	S	S	.	.	H	α-helix	trans	-71.9	-43.5	-179.2	-80.9	-40.5	0	0	0	111.1	T811 E813 L818 R819	T811-D815 WeakPolarHBondContact CB-OD2 3.43Å; T811-D815 WeakPolarHBondContact O-CB 3.33Å; T811-D815 PolarHBondContact O-N 2.9Å; T811-D815 PolarHBondContact OG1-OD2 3.15Å; E813-D815 PolarHBondContact O-N 2.83Å; D815-L818 PolarHBondContact O-N 2.8Å; D815-R819 WeakPolarHBondContact O-CB 3.46Å; D815-R819 VanDerWaalsContact O-CG 3.3Å; D815-R819 WeakPolarHBondContact O-CG 3.29Å; D815-R819 PolarHBondContact O-N 2.87Å
816	N	63.7	Low	59.9	Low	94 Å²	94	89.3 Å²	89.3	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-68.4	-36.6	173.1	-79.3	-22	0	0	0	111.5	A812 R819 M820	A812-N816 WeakPolarHBondContact O-CB 3.37Å; A812-N816 PolarHBondContact O-N 2.92Å; N816-R819 PolarHBondContact O-N 2.87Å; N816-M820 WeakPolarHBondContact O-CB 3.48Å; N816-M820 VanDerWaalsContact O-CG 3.28Å; N816-M820 WeakPolarHBondContact O-CG 3.25Å; N816-M820 PolarHBondContact O-N 3.46Å
817	S	52.7	Low	59.2	Low	19 Å²	19	95.8 Å²	95.8	13%	0.133	53%	0.532	C	S	.	.	H	α-helix	trans	-62.5	-47.2	173.3	-59.3	0	0	0	0	111.4	E813 S814 R819 M820 L821 L841	E813-S817 WeakPolarHBondContact O-CB 3.45Å; E813-S817 PolarHBondContact O-N 2.94Å; E813-S817 PolarHBondContact O-OG 3.33Å; S814-S817 PolarHBondContact O-N 2.88Å; S817-R819 VanDerWaalsContact C-N 3.35Å; S817-R819 PolarHBondContact O-N 2.89Å; S817-M820 PolarHBondContact O-N 3.45Å; S817-L821 WeakPolarHBondContact O-CB 3.4Å; S817-L821 WeakPolarHBondContact O-CD1 3.39Å; S817-L821 WeakPolarHBondContact O-CG 3.39Å; S817-L821 PolarHBondContact O-N 3.35Å; S817-L841 WeakPolarHBondContact OG-CD1 3.48Å
818	L	54.3	Low	58	Low	103 Å²	103	90.2 Å²	90.2	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-60.3	-41.3	175.2	-79.9	164.3	0	0	0	112.3	S814 D815 L821 N822	S814-L818 VanDerWaalsContact O-CB 3.28Å; S814-L818 WeakPolarHBondContact O-CB 3.14Å; S814-L818 WeakPolarHBondContact O-CD1 3.24Å; S814-L818 VanDerWaalsContact O-CG 3.22Å; S814-L818 WeakPolarHBondContact O-CG 3.38Å; S814-L818 PolarHBondContact O-N 3.23Å; D815-L818 PolarHBondContact O-N 2.8Å; L818-L821 PolarHBondContact O-N 2.92Å; L818-N822 PolarHBondContact O-N 2.79Å
819	R	61.1	Low	56.8	Low	177 Å²	177	93.1 Å²	93.1	67%	0.668	53%	0.527	S	S	*	.	H	α-helix	trans	-64.7	-42.5	174.5	-76.4	174.1	175.5	176.1	-0	112.4	D815 N816 S817 N822 A823	D815-R819 WeakPolarHBondContact O-CB 3.46Å; D815-R819 VanDerWaalsContact O-CG 3.3Å; D815-R819 WeakPolarHBondContact O-CG 3.29Å; D815-R819 PolarHBondContact O-N 2.87Å; N816-R819 PolarHBondContact O-N 2.87Å; S817-R819 VanDerWaalsContact C-N 3.35Å; S817-R819 PolarHBondContact O-N 2.89Å; R819-N822 PolarHBondContact O-N 3.42Å; R819-A823 WeakPolarHBondContact O-CB 3.43Å; R819-A823 PolarHBondContact O-N 3.29Å
820	M	54.2	Low	55.2	Low	106 Å²	106	89.9 Å²	89.9	52%	0.522	51%	0.512	S	S	.	.	H	α-helix	trans	-63.6	-43.2	176	-77.4	-76.2	-76.5	0	0	111.8	N816 S817 A823 L824	N816-M820 WeakPolarHBondContact O-CB 3.48Å; N816-M820 VanDerWaalsContact O-CG 3.28Å; N816-M820 WeakPolarHBondContact O-CG 3.25Å; N816-M820 PolarHBondContact O-N 3.46Å; S817-M820 PolarHBondContact O-N 3.45Å; M820-A823 PolarHBondContact O-N 3.47Å; M820-L824 HydrophobicContact CE-CD1 4.44Å; M820-L824 WeakPolarHBondContact O-CB 3.48Å; M820-L824 WeakPolarHBondContact O-CG 3.38Å; M820-L824 PolarHBondContact O-N 2.92Å
821	L	51.1	Low	54.3	Low	49 Å²	49	92.1 Å²	92.1	26%	0.257	51%	0.512	S	S	.	.	H	α-helix	trans	-61	-46.3	176.5	-67.6	163.1	0	0	0	111.2	S817 L818 A823 S828 L830	S817-L821 WeakPolarHBondContact O-CB 3.4Å; S817-L821 WeakPolarHBondContact O-CD1 3.39Å; S817-L821 WeakPolarHBondContact O-CG 3.39Å; S817-L821 PolarHBondContact O-N 3.35Å; L818-L821 PolarHBondContact O-N 2.92Å; L821-A823 PolarHBondContact O-N 2.89Å; L821-S828 WeakPolarHBondContact CD2-OG 3.49Å; L821-L830 HydrophobicContact CD1-CD1 4.43Å; L821-L830 HydrophobicContact CD2-CD1 3.91Å
822	N	54.6	Low	53	Low	142 Å²	142	92.9 Å²	92.9	76%	0.759	52%	0.517	S	S	*	.	H	α-helix	trans	-61	-40	173.5	-94.7	-17	0	0	0	113	L818 R819	L818-N822 PolarHBondContact O-N 2.79Å; R819-N822 PolarHBondContact O-N 3.42Å
823	A	58.4	Low	51.8	Low	84 Å²	84	97.7 Å²	97.7	69%	0.694	54%	0.536	S	S	*	.	H	α-helix	trans	-74.5	-32.1	-176.7	0	0	0	0	0	113.4	R819 M820 L821 G825	R819-A823 WeakPolarHBondContact O-CB 3.43Å; R819-A823 PolarHBondContact O-N 3.29Å; M820-A823 PolarHBondContact O-N 3.47Å; L821-A823 PolarHBondContact O-N 2.89Å; A823-G825 PolarHBondContact O-N 2.92Å; A823-G825 VanDerWaalsContact O-N 3.1Å
824	L	60.2	Low	51.6	Low	110 Å²	110	93.9 Å²	93.9	58%	0.576	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	9.2	180	-79.5	160.3	0	0	0	113.8	M820 L826	M820-L824 HydrophobicContact CE-CD1 4.44Å; M820-L824 WeakPolarHBondContact O-CB 3.48Å; M820-L824 WeakPolarHBondContact O-CG 3.38Å; M820-L824 PolarHBondContact O-N 2.92Å; L824-L826 HydrophobicContact CB-CD1 4.2Å; L824-L826 PolarHBondContact O-N 2.86Å
825	G	58.5	Low	50.3	Low	74 Å²	74	95.7 Å²	95.7	76%	0.763	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	1.2	175.3	0	0	0	0	0	114.7	A823	A823-G825 PolarHBondContact O-N 2.92Å; A823-G825 VanDerWaalsContact O-N 3.1Å
826	L	53.4	Low	48.9	Very low	98 Å²	98	97.9 Å²	97.9	51%	0.513	56%	0.56	S	S	.	*			trans	-89	125.3	178.7	-67.1	158.9	0	0	0	108.5	L824 S828	L824-L826 HydrophobicContact CB-CD1 4.2Å; L824-L826 PolarHBondContact O-N 2.86Å; L826-S828 WeakPolarHBondContact CB-OG 3.37Å; L826-S828 PolarHBondContact O-N 3.18Å; L826-S828 PolarHBondContact O-OG 2.9Å
827	Q	48.4	Very low	48	Very low	198 Å²	198	96.6 Å²	96.6	93%	0.925	56%	0.557	S	S	*	*			trans	-69.9	55.4	149.4	-73.7	-170.8	-30.7	0	0	108.9	T829	Q827-T829 PolarHBondContact O-N 3.13Å
828	S	42.8	Very low	47.8	Very low	24 Å²	24	99.3 Å²	99.3	17%	0.168	57%	0.572	C	S	.	*			trans	-63.8	109	-152.8	6.1	0	0	0	0	110.2	L821 L826 L830	L821-S828 WeakPolarHBondContact CD2-OG 3.49Å; L826-S828 WeakPolarHBondContact CB-OG 3.37Å; L826-S828 PolarHBondContact O-N 3.18Å; L826-S828 PolarHBondContact O-OG 2.9Å; S828-L830 PolarHBondContact O-N 3.03Å
829	T	35	Very low	47.5	Very low	115 Å²	115	97.6 Å²	97.6	71%	0.706	56%	0.564	S	S	*	*			trans	-69.2	63.6	166.4	30.7	0	0	0	0	110.3	Q827 I831	Q827-T829 PolarHBondContact O-N 3.13Å; T829-I831 HydrophobicContact CG2-CD1 3.75Å; T829-I831 HydrophobicContact CG2-CG1 3.9Å; T829-I831 PolarHBondContact O-N 3.22Å
830	L	30.6	Very low	47.1	Very low	51 Å²	51	92.2 Å²	92.2	27%	0.267	55%	0.548	S	S	.	.			trans	-68.2	61.4	159.2	-160.8	167	0	0	0	107.4	L821 S828 V838 L840	L821-L830 HydrophobicContact CD1-CD1 4.43Å; L821-L830 HydrophobicContact CD2-CD1 3.91Å; S828-L830 PolarHBondContact O-N 3.03Å; L830-V838 WeakPolarHBondContact CD2-O 3.49Å; L830-L840 HydrophobicContact CB-CD1 3.86Å; L830-L840 HydrophobicContact CB-CG 4.41Å; L830-L840 HydrophobicContact CD1-CB 3.72Å; L830-L840 HydrophobicContact CD1-CD1 4.08Å; L830-L840 HydrophobicContact CD1-CG 4.11Å; L830-L840 HydrophobicContact CG-CB 3.96Å; L830-L840 HydrophobicContact CG-CD1 3.77Å; L830-L840 HydrophobicContact CG-CG 3.79Å
831	I	45	Very low	46.8	Very low	127 Å²	127	89.8 Å²	89.8	65%	0.651	54%	0.537	S	S	*	.			trans	-75.3	-31.2	-164.3	-67.9	167.9	0	0	0	112.4	T829	T829-I831 HydrophobicContact CG2-CD1 3.75Å; T829-I831 HydrophobicContact CG2-CG1 3.9Å; T829-I831 PolarHBondContact O-N 3.22Å
832	T	37	Very low	46.7	Very low	65 Å²	65	92.3 Å²	92.3	40%	0.399	55%	0.554	S	S	.	*			trans	67.9	133.3	-166	80.4	0	0	0	0	113.9	G834 P837	T832-G834 PolarHBondContact O-N 2.99Å; T832-G834 VanDerWaalsContact O-N 3.14Å; T832-P837 HydrophobicContact CG2-CB 3.44Å; T832-P837 VanDerWaalsContact CG2-CB 3.44Å
833	D	39.9	Very low	46.4	Very low	144 Å²	144	88.7 Å²	88.7	77%	0.77	54%	0.537	S	S	*	.			trans	-88.1	35.9	175.7	-160.1	4.5	0	0	0	110.3	T835	D833-T835 WeakPolarHBondContact O-CA 3.33Å; D833-T835 WeakPolarHBondContact O-CB 3.36Å; D833-T835 PolarHBondContact O-N 2.96Å
834	G	58.2	Low	46.1	Very low	61 Å²	61	86.6 Å²	86.6	63%	0.629	52%	0.52	S	S	*	.	S	Bend	trans	64.6	-20.6	-157.2	0	0	0	0	0	115.4	T832 P837	T832-G834 PolarHBondContact O-N 2.99Å; T832-G834 VanDerWaalsContact O-N 3.14Å; G834-P837 WeakPolarHBondContact O-CD 3.12Å
835	T	35.6	Very low	45.4	Very low	94 Å²	94	88 Å²	88	58%	0.577	52%	0.523	S	S	*	.	S	Bend		-68	-77.7	-111.1	46.3	0	0	0	0	116.4	D833	D833-T835 WeakPolarHBondContact O-CA 3.33Å; D833-T835 WeakPolarHBondContact O-CB 3.36Å; D833-T835 PolarHBondContact O-N 2.96Å
836	T	32.1	Very low	44.9	Very low	120 Å²	120	86.3 Å²	86.3	74%	0.736	51%	0.506	S	S	*	.	S	Bend	cis	76.1	19	-18.2	59	0	0	0	0	118.4	V838	T836-V838 PolarHBondContact O-N 3.5Å
837	P	46	Very low	44.8	Very low	67 Å²	67	88.9 Å²	88.9	44%	0.435	52%	0.52	S	S	.	.			trans	-49.5	117.3	-157.7	20.5	-33.5	0	0	0	111.3	T832 G834 N839	T832-P837 HydrophobicContact CG2-CB 3.44Å; T832-P837 VanDerWaalsContact CG2-CB 3.44Å; G834-P837 WeakPolarHBondContact O-CD 3.12Å; P837-N839 PolarHBondContact O-N 2.8Å
838	V	48	Very low	44.9	Very low	77 Å²	77	85.5 Å²	85.5	47%	0.467	51%	0.507	S	S	.	.			trans	-69.4	82.5	-172.4	-174.9	0	0	0	0	109.4	L830 T836 L840	L830-V838 WeakPolarHBondContact CD2-O 3.49Å; T836-V838 PolarHBondContact O-N 3.5Å; V838-L840 HydrophobicContact CG1-CD2 4.36Å; V838-L840 PolarHBondContact O-N 2.97Å; V838-L840 VanDerWaalsContact O-N 3.14Å
839	N	46.9	Very low	44.9	Very low	66 Å²	66	86.5 Å²	86.5	35%	0.353	52%	0.521	S	S	.	.			trans	-71.3	104.9	173.6	-172	-4.2	0	0	0	107.4	P837 L841 T842	P837-N839 PolarHBondContact O-N 2.8Å; N839-L841 PolarHBondContact O-N 2.72Å; N839-L841 VanDerWaalsContact OD1-CB 3.28Å; N839-L841 WeakPolarHBondContact OD1-CB 3.27Å; N839-L841 WeakPolarHBondContact OD1-CD1 3.13Å; N839-L841 VanDerWaalsContact OD1-CG 3.31Å; N839-L841 WeakPolarHBondContact OD1-CG 3.33Å; N839-L841 PolarHBondContact OD1-N 3.11Å; N839-T842 PolarHBondContact O-N 2.81Å; N839-T842 PolarHBondContact O-OG1 3.26Å
840	L	53.6	Low	45	Very low	65 Å²	65	86.7 Å²	86.7	34%	0.34	53%	0.527	S	S	.	.	H	α-helix	trans	-62.4	-9.6	-179.7	-67.6	169.4	0	0	0	112.6	L830 V838 T843 A844	L830-L840 HydrophobicContact CB-CD1 3.86Å; L830-L840 HydrophobicContact CB-CG 4.41Å; L830-L840 HydrophobicContact CD1-CB 3.72Å; L830-L840 HydrophobicContact CD1-CD1 4.08Å; L830-L840 HydrophobicContact CD1-CG 4.11Å; L830-L840 HydrophobicContact CG-CB 3.96Å; L830-L840 HydrophobicContact CG-CD1 3.77Å; L830-L840 HydrophobicContact CG-CG 3.79Å; V838-L840 HydrophobicContact CG1-CD2 4.36Å; V838-L840 PolarHBondContact O-N 2.97Å; V838-L840 VanDerWaalsContact O-N 3.14Å; L840-T843 CarbonylContact O-C 3.57Å; L840-T843 WeakPolarHBondContact O-CB 3.31Å; L840-T843 PolarHBondContact O-N 2.87Å; L840-A844 PolarHBondContact O-N 3.41Å
841	L	47.6	Very low	45.7	Very low	55 Å²	55	88.6 Å²	88.6	29%	0.288	54%	0.54	S	S	.	.	H	α-helix	trans	-61.4	-42.6	166.7	-66.4	169.6	0	0	0	112.7	S817 N839 T843 A844 H845	S817-L841 WeakPolarHBondContact OG-CD1 3.48Å; N839-L841 PolarHBondContact O-N 2.72Å; N839-L841 VanDerWaalsContact OD1-CB 3.28Å; N839-L841 WeakPolarHBondContact OD1-CB 3.27Å; N839-L841 WeakPolarHBondContact OD1-CD1 3.13Å; N839-L841 VanDerWaalsContact OD1-CG 3.31Å; N839-L841 WeakPolarHBondContact OD1-CG 3.33Å; N839-L841 PolarHBondContact OD1-N 3.11Å; L841-T843 VanDerWaalsContact C-N 3.26Å; L841-T843 PolarHBondContact O-N 3.18Å; L841-A844 PolarHBondContact O-N 3.23Å; L841-H845 PolarHBondContact O-N 3.07Å
842	T	48.5	Very low	45.3	Very low	101 Å²	101	91.1 Å²	91.1	62%	0.62	55%	0.547	S	S	*	.	H	α-helix	trans	-72.5	-21.9	174	29.9	0	0	0	0	112	N839 G846	N839-T842 PolarHBondContact O-N 2.81Å; N839-T842 PolarHBondContact O-OG1 3.26Å; T842-G846 WeakPolarHBondContact O-CA 3.45Å; T842-G846 PolarHBondContact O-N 2.74Å
843	T	49.2	Very low	45.1	Very low	66 Å²	66	97 Å²	97	41%	0.405	57%	0.57	S	S	.	*	H	α-helix	trans	-73.2	-39	168.6	-36.7	0	0	0	0	111.7	L840 L841 G846 L847	L840-T843 CarbonylContact O-C 3.57Å; L840-T843 WeakPolarHBondContact O-CB 3.31Å; L840-T843 PolarHBondContact O-N 2.87Å; L841-T843 VanDerWaalsContact C-N 3.26Å; L841-T843 PolarHBondContact O-N 3.18Å; T843-G846 PolarHBondContact O-N 3.02Å; T843-L847 PolarHBondContact O-N 2.84Å
844	A	51.4	Low	44.6	Very low	40 Å²	40	93.5 Å²	93.5	33%	0.331	57%	0.569	S	S	.	*	H	α-helix	trans	-65.8	-43.8	173.2	0	0	0	0	0	111.7	L840 L841 G846 L847 I848	L840-A844 PolarHBondContact O-N 3.41Å; L841-A844 PolarHBondContact O-N 3.23Å; A844-G846 VanDerWaalsContact C-N 3.31Å; A844-G846 PolarHBondContact O-N 2.85Å; A844-L847 PolarHBondContact O-N 2.92Å; A844-I848 PolarHBondContact O-N 3.19Å
845	H	46.1	Very low	43.9	Very low	139 Å²	139	96.1 Å²	96.1	64%	0.644	58%	0.577	S	S	*	*	H	α-helix	trans	-67.7	-29.2	170.9	-98.6	-56.3	0	0	0	112.7	L841 I848 G849	L841-H845 PolarHBondContact O-N 3.07Å; H845-I848 CarbonylContact O-C 3.52Å; H845-I848 PolarHBondContact O-N 3.47Å; H845-G849 WeakPolarHBondContact O-CA 3.47Å; H845-G849 PolarHBondContact O-N 3.47Å
846	G	48.3	Very low	44.1	Very low	40 Å²	40	97 Å²	97	41%	0.412	59%	0.587	S	S	.	*	H	α-helix	trans	-70.3	-36.2	174.1	0	0	0	0	0	113.7	T842 T843 A844 I848 G849 S850	T842-G846 WeakPolarHBondContact O-CA 3.45Å; T842-G846 PolarHBondContact O-N 2.74Å; T843-G846 PolarHBondContact O-N 3.02Å; A844-G846 VanDerWaalsContact C-N 3.31Å; A844-G846 PolarHBondContact O-N 2.85Å; G846-I848 PolarHBondContact O-N 2.82Å; G846-G849 PolarHBondContact O-N 2.9Å; G846-S850 PolarHBondContact O-N 3.19Å
847	L	51.5	Low	44.2	Very low	152 Å²	152	101.6 Å²	101.6	80%	0.796	59%	0.591	S	S	*	*	H	α-helix	trans	-63.3	-22.5	171.3	-83.8	162.6	0	0	0	113.2	T843 A844	T843-L847 PolarHBondContact O-N 2.84Å; A844-L847 PolarHBondContact O-N 2.92Å
848	I	49.2	Very low	44.1	Very low	126 Å²	126	106 Å²	106	65%	0.646	60%	0.603	S	S	*	*	H	α-helix	trans	-100.9	-24.1	173.9	-61.5	172	0	0	0	111.4	A844 H845 G846 V851	A844-I848 PolarHBondContact O-N 3.19Å; H845-I848 CarbonylContact O-C 3.52Å; H845-I848 PolarHBondContact O-N 3.47Å; G846-I848 PolarHBondContact O-N 2.82Å; I848-V851 VanDerWaalsContact O-CG2 3.28Å; I848-V851 WeakPolarHBondContact O-CG2 3.28Å
849	G	42.5	Very low	43.5	Very low	46 Å²	46	112.4 Å²	112.4	47%	0.474	62%	0.619	S	S	.	*	H	α-helix	trans	-97.4	-1.2	-163.6	0	0	0	0	0	115.5	H845 G846 V851	H845-G849 WeakPolarHBondContact O-CA 3.47Å; H845-G849 PolarHBondContact O-N 3.47Å; G846-G849 PolarHBondContact O-N 2.9Å; G849-V851 PolarHBondContact O-N 2.72Å
850	S	37.7	Very low	43.2	Very low	118 Å²	118	113.2 Å²	113.2	83%	0.825	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	40.5	165.3	-174.9	0	0	0	0	112.4	G846	G846-S850 PolarHBondContact O-N 3.19Å
851	V	45.7	Very low	42.5	Very low	91 Å²	91	114.3 Å²	114.3	55%	0.552	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.2	-15.1	-169.1	-174.7	0	0	0	0	114.1	I848 G849	I848-V851 VanDerWaalsContact O-CG2 3.28Å; I848-V851 WeakPolarHBondContact O-CG2 3.28Å; G849-V851 PolarHBondContact O-N 2.72Å
852	F	36.1	Very low	41.9	Very low	180 Å²	180	119.8 Å²	119.8	79%	0.789	67%	0.672	S	S	*	*			trans	-149	105.7	170.6	-67.1	-77.9	0	0	0	109.4
853	E	33.7	Very low	41.3	Very low	188 Å²	188	120.5 Å²	120.5	88%	0.879	68%	0.676	S	S	*	*				57.6	142.3	63.9	-58.1	-163.6	152.7	0	0	113.8
854	G	29.5	Very low	40.5	Very low	72 Å²	72	125.6 Å²	125.6	74%	0.742	70%	0.7	S	S	*	*			cis	133.8	76.2	3.4	0	0	0	0	0	113.4
855	S	43.2	Very low	39.8	Very low	115 Å²	115	127 Å²	127	80%	0.804	72%	0.719	S	S	*	*			trans	-162.9	144	171.3	52.7	0	0	0	0	117.5
856	S	39.7	Very low	39.3	Very low	114 Å²	114	127.2 Å²	127.2	80%	0.797	73%	0.725	S	S	*	*			trans	58.5	122.9	170	71.4	0	0	0	0	118.9
857	R	34.3	Very low	39.4	Very low	215 Å²	215	131.5 Å²	131.5	81%	0.811	74%	0.743	S	S	*	*			cis	99.4	130.9	27.1	-96.5	-169.6	165.7	170.7	0.5	116.1
858	K	43.1	Very low	38.8	Very low	159 Å²	159	131 Å²	131	69%	0.691	74%	0.741	S	S	*	*			trans	73.4	143.4	143.9	-78.4	-175.8	175.9	-177.2	0	116.7
859	R	35.9	Very low	38.4	Very low	212 Å²	212	128 Å²	128	80%	0.8	74%	0.741	S	S	*	*			cis	166.9	172	-2.7	-161.6	-173.5	-158	-165.8	4	103.6
860	A	40.7	Very low	38.6	Very low	83 Å²	83	139.6 Å²	139.6	69%	0.686	78%	0.778	S	S	*	*			trans	73.8	151.7	139.6	0	0	0	0	0	118.1
861	S	39.1	Very low	38.7	Very low	89 Å²	89	140.7 Å²	140.7	62%	0.622	78%	0.776	S	S	*	*			cis	-167.3	170.2	-22.7	50.5	0	0	0	0	109.1
862	E	35.3	Very low	38.3	Very low	169 Å²	169	143.3 Å²	143.3	79%	0.79	79%	0.788	S	S	*	*				-7.8	146.6	129.5	-48.3	151.5	137.4	0	0	115.8
863	V	36.2	Very low	38.4	Very low	117 Å²	117	141.2 Å²	141.2	71%	0.709	79%	0.788	S	S	*	*				174	117.5	111.2	149.9	0	0	0	0	111.2
864	L	30.8	Very low	38.7	Very low	172 Å²	172	138.5 Å²	138.5	90%	0.901	78%	0.783	S	S	*	*			trans	38.2	138.8	142.9	-67	144.3	0	0	0	122
865	G	37	Very low	39.3	Very low	71 Å²	71	142.6 Å²	142.6	73%	0.732	79%	0.785	S	S	*	*			trans	166.6	46.3	160.2	0	0	0	0	0	117.6	V867	G865-V867 PolarHBondContact O-N 2.99Å
866	N	36	Very low	39	Very low	143 Å²	143	144.5 Å²	144.5	77%	0.765	78%	0.784	S	S	*	*			trans	-85.6	110.9	170.5	-149.2	55.2	0	0	0	109.3	D868	N866-D868 PolarHBondContact ND2-OD2 3.34Å
867	V	50.5	Low	39	Very low	129 Å²	129	146.6 Å²	146.6	78%	0.782	78%	0.783	S	S	*	*			trans	-118.8	89.7	175.6	179.8	0	0	0	0	107.5	G865	G865-V867 PolarHBondContact O-N 2.99Å
868	D	39.2	Very low	39.3	Very low	142 Å²	142	141.4 Å²	141.4	76%	0.759	78%	0.781	S	S	*	*			trans	-95	130.2	171.9	-82.1	-54.4	0	0	0	109.6	N866	N866-D868 PolarHBondContact ND2-OD2 3.34Å
869	G	40.4	Very low	39	Very low	64 Å²	64	139.9 Å²	139.9	66%	0.66	79%	0.788	S	S	*	*			trans	118.2	85.3	-162.3	0	0	0	0	0	108.2
870	K	47.1	Very low	39.3	Very low	288 Å²	288	133.4 Å²	133.4	100%	1.252	79%	0.787	S	S	*	*			trans	-51.7	0	-169.8	-81	-169.9	173	-174.3	0	114.2

Retrieved 870 of 870 residues in 1248.1 ms (Link to these results)

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