Q9ARQ7_ORYSJ Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession Q9ARQ7, Species ORYSJ (Oryza sativa subsp. japonica, Rice), Gene n/a, Length 1,002 aa.

						>Q9ARQ7_ORYSJ|Q9ARQ7
MGSGSLLLSLLLVLVVVNVGVAVNQDGLSLLDARRALAAPDGALADWNARDATPCSWTGVSCDAGVGGGAVTGISLAGLNLTGSFPAALCRLPRVASIDLSYNYIGPNLSSDAVAPCKALRRLDLSMNALVGPLPDALAALPELVYLKLDSNNFSGPIPESFGRFKKLESLSLVYNLLGGEVPPFLGGVSTLRELNLSYNPFVAGPVPAELGNLSALRVLWLAGCNLIGAIPASLGRLGNLTDLDLSTNALTGSIPPEITRLTSVVQIELYNNSLTGPIPVGFGKLAELQGVDLAMNRLNGAIPDDFFEAPKLESVHLYANSLTGPVPESVAKAASLVELRLFANRLNGTLPADLGKNSPLVCVDMSDNSISGEIPPAICDRGELEELLMLDNKLSGRIPDGLGRCRRLRRVRLSNNRLDGDVPAAVWGLPHMSLLELNDNQLTGVISPVIGGAANLSKLVLSNNRLTGSIPPEIGSASKLYELSADGNMLSGPLPGSLGGLEELGRLVLRNNSLSGQLLRGINSWKKLSELNLADNGFTGAIPAELGDLPVLNYLDLSGNRLTGEVPMQLENLKLNQFNVSNNQLSGALPPQYATAAYRSSFLGNPGLCGDNAGLCANSQGGPRSRAGFAWMMRSIFIFAAVVLVAGVAWFYWRYRSFNNSKLSADRSKWSLTSFHKLSFSEYEILDCLDEDNVIGSGASGKVYKAVLSNGEVVAVKKLWGLKKGTDVENGGEGSTADNSFEAEVKTLGKIRHKNIVKLWCSCTHNDTKLLVYEYMPNGSLGDVLHSSKAGLLDWSTRYKIALDAAEGLSYLHHDYVPAIVHRDVKSNNILLDAEFGARVADFGVAKVVEATVRGPKSMSVIAGSCGYIAPEYAYTLRVNEKSDIYSFGVVLLELVTGKPPVDPEFGEKDLVKWVCSTIDQKGVEHVLDSKLDMTFKDEINRVLNIALLCSSSLPINRPAMRRVVKMLQEVRAEATRPRLEKDGKLSPYYYEDTSDQGSSV
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.4	Very low	57.8	Low	255 Å²	255	114.2 Å²	114.2	100%	1.256	69%	0.693	S	S	*	*				0	97.7	0	-74.2	170.4	160.9	0	0	107.8
2	G	53.5	Low	57.7	Low	75 Å²	75	114.7 Å²	114.7	77%	0.773	69%	0.688	S	S	*	*			trans	-152.8	22	-173.1	0	0	0	0	0	113.8
3	S	55.3	Low	57.5	Low	106 Å²	106	113.9 Å²	113.9	74%	0.741	68%	0.684	S	S	*	*			trans	-92.6	8.7	-173.9	44.2	0	0	0	0	114.6
4	G	56.2	Low	57.2	Low	57 Å²	57	114.4 Å²	114.4	59%	0.588	68%	0.68	S	S	*	*	S	Bend	trans	-85.7	-17.5	-178.1	0	0	0	0	0	116
5	S	59.9	Low	56.9	Low	95 Å²	95	114.7 Å²	114.7	66%	0.664	68%	0.683	S	S	*	*	H	α-helix	trans	-77.5	-29.9	-174.5	175.6	0	0	0	0	113.7	S9	S5-S9 PolarHBondContact O-OG 3.09Å
6	L	60.7	Low	56.5	Low	135 Å²	135	113.9 Å²	113.9	71%	0.707	68%	0.679	S	S	*	*	H	α-helix	trans	-75	-27.8	-178.8	-102.7	122	0	0	0	113.7	S9 L10	L6-S9 PolarHBondContact O-OG 3.15Å; L6-L10 PolarHBondContact O-N 2.94Å
7	L	61.7	Low	56.1	Low	124 Å²	124	113.6 Å²	113.6	65%	0.649	68%	0.678	S	S	*	*	H	α-helix	trans	-74.4	-35.7	179.5	-116.6	109.9	0	0	0	112.3	S9 L10 L11	L7-S9 VanDerWaalsContact C-N 3.34Å; L7-L10 PolarHBondContact O-N 2.79Å; L7-L11 PolarHBondContact O-N 2.87Å; L7-L11 VanDerWaalsContact O-N 3.13Å
8	L	61.9	Low	55.6	Low	131 Å²	131	115.2 Å²	115.2	69%	0.686	68%	0.682	S	S	*	*	H	α-helix	trans	-69.9	-34.5	-179.7	-132	89	0	0	0	111.9	L12	L8-L12 PolarHBondContact O-N 3.06Å; L8-L12 VanDerWaalsContact O-N 3.08Å
9	S	61.7	Low	55.3	Low	61 Å²	61	115.6 Å²	115.6	43%	0.427	69%	0.686	S	S	.	*	H	α-helix	trans	-71.9	-35.7	176.4	29.5	0	0	0	0	111.9	S5 L6 L7 L12 V13	S5-S9 PolarHBondContact O-OG 3.09Å; L6-S9 PolarHBondContact O-OG 3.15Å; L7-S9 VanDerWaalsContact C-N 3.34Å; S9-L12 PolarHBondContact O-N 3.2Å; S9-V13 WeakPolarHBondContact O-CG2 3.44Å; S9-V13 PolarHBondContact O-N 3.21Å; S9-V13 VanDerWaalsContact O-N 3.16Å
10	L	60.7	Low	55.2	Low	114 Å²	114	112.8 Å²	112.8	60%	0.597	68%	0.682	S	S	*	*	H	α-helix	trans	-65.7	-39.4	173.2	-129.1	98.9	0	0	0	112.4	L6 L7 V13 L14	L6-L10 PolarHBondContact O-N 2.94Å; L7-L10 PolarHBondContact O-N 2.79Å; L10-V13 PolarHBondContact O-N 3.09Å; L10-L14 PolarHBondContact O-N 3.38Å; L10-L14 VanDerWaalsContact O-N 3.14Å
11	L	59.2	Low	55.3	Low	103 Å²	103	111.2 Å²	111.2	54%	0.539	67%	0.672	S	S	.	*	H	α-helix	trans	-67.7	-36.3	176.5	-94.3	148.5	0	0	0	112.4	L7 L14 V15	L7-L11 PolarHBondContact O-N 2.87Å; L7-L11 VanDerWaalsContact O-N 3.13Å; L11-L14 PolarHBondContact O-N 3.25Å; L11-V15 WeakPolarHBondContact O-CG2 3.44Å; L11-V15 PolarHBondContact O-N 2.92Å; L11-V15 VanDerWaalsContact O-N 3.15Å
12	L	56.4	Low	56.8	Low	120 Å²	120	102.7 Å²	102.7	63%	0.628	64%	0.643	S	S	*	*	H	α-helix	trans	-68.7	-37.1	176	-134.7	89	0	0	0	112.2	L8 S9 L14 V15 V16	L8-L12 PolarHBondContact O-N 3.06Å; L8-L12 VanDerWaalsContact O-N 3.08Å; S9-L12 PolarHBondContact O-N 3.2Å; L12-L14 VanDerWaalsContact C-N 3.34Å; L12-V15 PolarHBondContact O-N 3.08Å; L12-V16 WeakPolarHBondContact O-CG2 3.27Å; L12-V16 PolarHBondContact O-N 2.96Å
13	V	54.8	Low	58.4	Low	105 Å²	105	99.5 Å²	99.5	64%	0.636	61%	0.608	S	S	*	*	H	α-helix	trans	-68.1	-33.6	176.2	175.4	0	0	0	0	111.6	S9 L10 V16	S9-V13 WeakPolarHBondContact O-CG2 3.44Å; S9-V13 PolarHBondContact O-N 3.21Å; S9-V13 VanDerWaalsContact O-N 3.16Å; L10-V13 PolarHBondContact O-N 3.09Å; V13-V16 PolarHBondContact O-N 3.34Å
14	L	53.1	Low	60	Low	121 Å²	121	96.7 Å²	96.7	63%	0.634	59%	0.585	S	S	*	*	H	α-helix	trans	-71.5	-28	174.7	-87.8	155	0	0	0	113.6	L10 L11 L12	L10-L14 PolarHBondContact O-N 3.38Å; L10-L14 VanDerWaalsContact O-N 3.14Å; L11-L14 PolarHBondContact O-N 3.25Å; L12-L14 VanDerWaalsContact C-N 3.34Å
15	V	52.7	Low	61.7	Low	119 Å²	119	100.5 Å²	100.5	72%	0.721	59%	0.587	S	S	*	*	H	α-helix	trans	-79.3	-26.1	174.7	175.1	0	0	0	0	111.9	L11 L12	L11-V15 WeakPolarHBondContact O-CG2 3.44Å; L11-V15 PolarHBondContact O-N 2.92Å; L11-V15 VanDerWaalsContact O-N 3.15Å; L12-V15 PolarHBondContact O-N 3.08Å
16	V	50.4	Low	63.3	Low	101 Å²	101	96.8 Å²	96.8	61%	0.612	56%	0.56	S	S	*	*	H	α-helix	trans	-83.8	-16.3	-176.5	173.7	0	0	0	0	114.1	L12 V13	L12-V16 WeakPolarHBondContact O-CG2 3.27Å; L12-V16 PolarHBondContact O-N 2.96Å; V13-V16 PolarHBondContact O-N 3.34Å
17	V	50	Low	64.8	Low	109 Å²	109	90.4 Å²	90.4	66%	0.661	53%	0.526	S	S	*	.	S	Bend	trans	-134	60.8	-179.5	-162	0	0	0	0	112.6
18	N	47.2	Very low	66.3	Low	142 Å²	142	88.6 Å²	88.6	76%	0.759	52%	0.517	S	S	*	.			trans	-149.2	66.4	143.3	-96.7	-46.7	0	0	0	106.7	G20	N18-G20 PolarHBondContact O-N 3.12Å
19	V	49.8	Very low	67.8	Low	124 Å²	124	82.9 Å²	82.9	75%	0.752	49%	0.488	S	S	*	.			trans	-61.5	89.6	150.8	-176.7	0	0	0	0	103.7	V21	V19-V21 VanDerWaalsContact C-N 3.28Å; V19-V21 PolarHBondContact O-N 3.07Å
20	G	53.7	Low	69.5	Low	59 Å²	59	80 Å²	80	61%	0.608	47%	0.468	S	S	*	.			trans	-56.9	104.3	169.9	0	0	0	0	0	105.1	N18 A22	N18-G20 PolarHBondContact O-N 3.12Å; G20-A22 PolarHBondContact O-N 3.38Å
21	V	57.4	Low	71.1	Confident	79 Å²	79	76.2 Å²	76.2	48%	0.479	45%	0.448	S	S	.	.			trans	-65.8	95.1	174.4	179.8	0	0	0	0	104.6	V19 R50 A52	V19-V21 VanDerWaalsContact C-N 3.28Å; V19-V21 PolarHBondContact O-N 3.07Å; V21-R50 CarbonylContact O-C 3.23Å; V21-A52 VanDerWaalsContact CG1-CA 3.47Å; V21-A52 HydrophobicContact CG1-CB 3.56Å
22	A	76.1	Confident	72.7	Confident	77 Å²	77	73.5 Å²	73.5	64%	0.636	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-85.7	138.3	172.1	0	0	0	0	0	107.3	G20	G20-A22 PolarHBondContact O-N 3.38Å
23	V	88.3	Confident	74.6	Confident	7 Å²	7	67.9 Å²	67.9	4%	0.042	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-57.6	144	173.6	76.6	0	0	0	0	110.8	L28 L31 A49 D51 W57	V23-L28 HydrophobicContact CG1-CD2 3.87Å; V23-L28 HydrophobicContact CG1-CG 3.99Å; V23-L31 HydrophobicContact CG1-CD1 4.09Å; V23-A49 PolarHBondContact N-O 3.41Å; V23-D51 WeakPolarHBondContact CA-O 3.44Å; V23-D51 WeakPolarHBondContact CB-O 3.44Å; V23-D51 WeakPolarHBondContact CG2-O 3.28Å; V23-D51 PolarHBondContact N-O 2.9Å; V23-W57 HydrophobicContact CG2-CH2 4.04Å; V23-W57 HydrophobicContact CG2-CZ2 3.88Å
24	N	89.2	Confident	76.4	Confident	48 Å²	48	67.2 Å²	67.2	26%	0.257	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-59	170.9	176.2	72.3	5.8	0	0	0	112.5	D26 G27 L28 A52 P54 G68	N24-D26 PolarHBondContact O-N 3.06Å; N24-D26 VanDerWaalsContact O-N 3.17Å; N24-D26 PolarHBondContact OD1-N 3.22Å; N24-G27 PolarHBondContact O-N 3.24Å; N24-G27 PolarHBondContact OD1-N 2.74Å; N24-L28 PolarHBondContact O-N 3.17Å; N24-A52 PolarHBondContact N-O 3.09Å; N24-A52 VanDerWaalsContact N-O 3.14Å; N24-P54 WeakPolarHBondContact OD1-CD 3.45Å; N24-G68 PolarHBondContact ND2-O 3.11Å
25	Q	90.5	Very high	78.3	Confident	136 Å²	136	71.2 Å²	71.2	64%	0.636	40%	0.398	S	S	*	.	H	α-helix	trans	-57.8	-32.9	-176.2	-171.4	60.7	31.2	0	0	113.6	L28 S29	Q25-L28 PolarHBondContact O-N 3.02Å; Q25-S29 PolarHBondContact O-N 3.29Å; Q25-S29 VanDerWaalsContact O-N 3.11Å; Q25-S29 PolarHBondContact O-OG 3.04Å
26	D	93.2	Very high	80.1	Confident	18 Å²	18	66.9 Å²	66.9	10%	0.096	37%	0.374	C	S	.	.	H	α-helix	trans	-66.5	-44.4	176.1	-73.7	6.2	0	0	0	110.7	N24 L28 S29 L30 P54 A70 V71 L92	N24-D26 PolarHBondContact O-N 3.06Å; N24-D26 VanDerWaalsContact O-N 3.17Å; N24-D26 PolarHBondContact OD1-N 3.22Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.3Å; D26-S29 WeakPolarHBondContact O-CB 3.41Å; D26-S29 PolarHBondContact O-N 2.97Å; D26-S29 VanDerWaalsContact O-N 3.11Å; D26-L30 PolarHBondContact O-N 3.09Å; D26-P54 HydrophobicContact CB-CG 4.29Å; D26-A70 WeakPolarHBondContact OD2-CA 3.35Å; D26-V71 HydrophobicContact CB-CB 4.36Å; D26-V71 HydrophobicContact CB-CG2 3.74Å; D26-V71 PolarHBondContact OD2-N 3.19Å; D26-L92 HydrophobicContact CB-CD2 3.66Å
27	G	93.3	Very high	82.1	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-64.1	-35.4	175.8	0	0	0	0	0	113.3	N24 S29 L30 L31	N24-G27 PolarHBondContact O-N 3.24Å; N24-G27 PolarHBondContact OD1-N 2.74Å; G27-S29 VanDerWaalsContact C-N 3.31Å; G27-S29 PolarHBondContact O-N 3.5Å; G27-L30 PolarHBondContact O-N 3.29Å; G27-L31 VanDerWaalsContact O-CG 3.3Å; G27-L31 WeakPolarHBondContact O-CG 3.42Å; G27-L31 PolarHBondContact O-N 3.06Å
28	L	93.3	Very high	84	Confident	87 Å²	87	60.3 Å²	60.3	46%	0.455	34%	0.339	S	S	.	.	H	α-helix	trans	-63.1	-38.7	171.8	-68.8	176.9	0	0	0	111.9	V23 N24 Q25 D26 L31 D32	V23-L28 HydrophobicContact CG1-CD2 3.87Å; V23-L28 HydrophobicContact CG1-CG 3.99Å; N24-L28 PolarHBondContact O-N 3.17Å; Q25-L28 PolarHBondContact O-N 3.02Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.3Å; L28-L31 PolarHBondContact O-N 3.14Å; L28-D32 PolarHBondContact O-N 3.28Å
29	S	94.1	Very high	85.7	Confident	10 Å²	10	55.3 Å²	55.3	7%	0.07	32%	0.318	C	S	.	.	H	α-helix	trans	-68.5	-38.6	177.2	-55.5	0	0	0	0	111.8	Q25 D26 G27 D32 A33	Q25-S29 PolarHBondContact O-N 3.29Å; Q25-S29 VanDerWaalsContact O-N 3.11Å; Q25-S29 PolarHBondContact O-OG 3.04Å; D26-S29 WeakPolarHBondContact O-CB 3.41Å; D26-S29 PolarHBondContact O-N 2.97Å; D26-S29 VanDerWaalsContact O-N 3.11Å; G27-S29 VanDerWaalsContact C-N 3.31Å; G27-S29 PolarHBondContact O-N 3.5Å; S29-D32 PolarHBondContact O-N 2.96Å; S29-A33 WeakPolarHBondContact O-CB 3.41Å; S29-A33 PolarHBondContact O-N 3.21Å
30	L	95.6	Very high	87	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.5	-41.8	173.2	-75	168.6	0	0	0	112.1	D26 G27 D32 A33 R34 W47 P54 W57 V60 V71 I74 L89 L92	D26-L30 PolarHBondContact O-N 3.09Å; G27-L30 PolarHBondContact O-N 3.29Å; L30-D32 VanDerWaalsContact C-N 3.32Å; L30-D32 PolarHBondContact O-N 3.07Å; L30-A33 WeakPolarHBondContact O-CB 3.46Å; L30-A33 PolarHBondContact O-N 2.9Å; L30-R34 PolarHBondContact O-N 3.05Å; L30-W47 HydrophobicContact CB-CE3 4.34Å; L30-W47 HydrophobicContact CB-CZ3 4.01Å; L30-W47 HydrophobicContact CD2-CH2 3.93Å; L30-W47 HydrophobicContact CD2-CZ3 4.24Å; L30-W47 VanDerWaalsContact O-CZ3 3.3Å; L30-W47 WeakPolarHBondContact O-CZ3 3.32Å; L30-P54 HydrophobicContact CD1-CB 3.41Å; L30-P54 VanDerWaalsContact CD1-CB 3.41Å; L30-P54 HydrophobicContact CD1-CG 3.73Å; L30-W57 HydrophobicContact CB-CE3 4.22Å; L30-W57 HydrophobicContact CB-CZ3 3.68Å; L30-W57 HydrophobicContact CD1-CE3 4.03Å; L30-W57 HydrophobicContact CD1-CZ3 4.1Å; L30-V60 HydrophobicContact CD1-CG1 4.12Å; L30-V60 HydrophobicContact CD1-CG2 3.89Å; L30-V60 HydrophobicContact CD2-CG2 4.5Å; L30-V71 HydrophobicContact CD1-CG2 4Å; L30-I74 HydrophobicContact CD2-CD1 4.37Å; L30-I74 HydrophobicContact CD2-CG1 3.89Å; L30-L89 HydrophobicContact CD2-CD2 3.55Å; L30-L92 HydrophobicContact CD2-CD1 4.13Å; L30-L92 HydrophobicContact CG-CD1 4.33Å
31	L	94.6	Very high	87.7	Confident	36 Å²	36	57.3 Å²	57.3	19%	0.188	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-34.2	175.7	-70.6	170.1	0	0	0	112.5	V23 G27 L28 W47 A49 W57	V23-L31 HydrophobicContact CG1-CD1 4.09Å; G27-L31 VanDerWaalsContact O-CG 3.3Å; G27-L31 WeakPolarHBondContact O-CG 3.42Å; G27-L31 PolarHBondContact O-N 3.06Å; L28-L31 PolarHBondContact O-N 3.14Å; L31-W47 HydrophobicContact CD2-CB 4.3Å; L31-A49 HydrophobicContact CD1-CB 3.68Å; L31-W57 HydrophobicContact CD1-CH2 3.98Å; L31-W57 HydrophobicContact CD2-CH2 3.97Å; L31-W57 HydrophobicContact CD2-CZ3 4.22Å; L31-W57 HydrophobicContact CG-CH2 3.68Å; L31-W57 HydrophobicContact CG-CZ3 4.03Å
32	D	94.4	Very high	88.6	Confident	45 Å²	45	55.7 Å²	55.7	24%	0.241	31%	0.312	C	S	.	.	H	α-helix	trans	-68.5	-42.1	171.8	-163.5	38.3	0	0	0	111.1	L28 S29 L30 R34 R35 A88 R91	L28-D32 PolarHBondContact O-N 3.28Å; S29-D32 PolarHBondContact O-N 2.96Å; L30-D32 VanDerWaalsContact C-N 3.32Å; L30-D32 PolarHBondContact O-N 3.07Å; D32-R34 VanDerWaalsContact C-N 3.32Å; D32-R34 PolarHBondContact O-N 3.12Å; D32-R35 WeakPolarHBondContact O-CB 3.47Å; D32-R35 PolarHBondContact O-N 3.47Å; D32-R35 VanDerWaalsContact O-N 3.12Å; D32-R35 IonicContact OD1-CZ 2.75Å; D32-R35 IonicContact OD1-NH1 3.9Å; D32-R35 PolarHBondContact OD1-NH1 3.19Å; D32-A88 HydrophobicContact CB-CB 4.1Å; D32-R91 IonicContact OD2-CZ 3.76Å; D32-R91 IonicContact OD2-NH1 2.78Å; D32-R91 PolarHBondContact OD2-NH1 3.35Å; D32-R91 IonicContact OD2-NH2 3.35Å
33	A	94.3	Very high	88.8	Confident	2 Å²	2	53.5 Å²	53.5	2%	0.017	29%	0.294	C	S	.	.	H	α-helix	trans	-58.9	-40.7	173.8	0	0	0	0	0	112.5	S29 L30 R35 A36 P86 A88 L89	S29-A33 WeakPolarHBondContact O-CB 3.41Å; S29-A33 PolarHBondContact O-N 3.21Å; L30-A33 WeakPolarHBondContact O-CB 3.46Å; L30-A33 PolarHBondContact O-N 2.9Å; A33-R35 PolarHBondContact O-N 3.11Å; A33-R35 VanDerWaalsContact O-N 3.16Å; A33-A36 WeakPolarHBondContact O-CB 3.26Å; A33-A36 PolarHBondContact O-N 2.86Å; A33-A36 VanDerWaalsContact O-N 3.08Å; A33-P86 HydrophobicContact CB-CB 3.97Å; A33-P86 WeakPolarHBondContact O-CB 3.47Å; A33-A88 HydrophobicContact CB-CB 3.99Å; A33-L89 HydrophobicContact CB-CD2 3.52Å; A33-L89 HydrophobicContact CB-CG 3.81Å
34	R	93.2	Very high	88.9	Confident	92 Å²	92	53.2 Å²	53.2	35%	0.347	29%	0.292	S	S	.	.	H	α-helix	trans	-56.6	-29.1	176	-178.1	-179.3	170.4	-177.5	3.4	112.6	L30 D32 A36 L37 L44 W47	L30-R34 PolarHBondContact O-N 3.05Å; D32-R34 VanDerWaalsContact C-N 3.32Å; D32-R34 PolarHBondContact O-N 3.12Å; R34-A36 PolarHBondContact O-N 2.94Å; R34-L37 CarbonylContact O-C 3.58Å; R34-L37 PolarHBondContact O-N 3.16Å; R34-L44 HydrophobicContact CG-CD1 4.34Å; R34-L44 PolarHBondContact NH1-O 2.83Å; R34-L44 PolarHBondContact NH2-O 3.35Å; R34-W47 HydrophobicContact CB-CE3 3.9Å; R34-W47 HydrophobicContact CB-CZ3 3.96Å; R34-W47 HydrophobicContact CG-CE3 4.33Å; R34-W47 PolarHBondContact NH1-O 3.36Å
35	R	92.5	Very high	88.8	Confident	205 Å²	205	54.3 Å²	54.3	77%	0.774	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.8	178.9	-64.2	174.6	174.7	160.5	-6.9	113.6	D32 A33 L37	D32-R35 WeakPolarHBondContact O-CB 3.47Å; D32-R35 PolarHBondContact O-N 3.47Å; D32-R35 VanDerWaalsContact O-N 3.12Å; D32-R35 IonicContact OD1-CZ 2.75Å; D32-R35 IonicContact OD1-NH1 3.9Å; D32-R35 PolarHBondContact OD1-NH1 3.19Å; A33-R35 PolarHBondContact O-N 3.11Å; A33-R35 VanDerWaalsContact O-N 3.16Å; R35-L37 VanDerWaalsContact C-N 3.27Å
36	A	92.2	Very high	88.9	Confident	28 Å²	28	50.5 Å²	50.5	23%	0.231	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-12.3	175	0	0	0	0	0	112.8	A33 R34 G83 S84 P86	A33-A36 WeakPolarHBondContact O-CB 3.26Å; A33-A36 PolarHBondContact O-N 2.86Å; A33-A36 VanDerWaalsContact O-N 3.08Å; R34-A36 PolarHBondContact O-N 2.94Å; A36-G83 CarbonylContact O-C 3.59Å; A36-G83 WeakPolarHBondContact O-CA 3.25Å; A36-S84 PolarHBondContact O-N 3.5Å; A36-P86 HydrophobicContact CB-CB 4.14Å
37	L	92.3	Very high	88.9	Confident	20 Å²	20	50 Å²	50	11%	0.105	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	135.5	-174.9	-60.8	173.1	0	0	0	110.7	R34 R35 L76 L81 T82 P86 I105	R34-L37 CarbonylContact O-C 3.58Å; R34-L37 PolarHBondContact O-N 3.16Å; R35-L37 VanDerWaalsContact C-N 3.27Å; L37-L76 HydrophobicContact CD1-CD1 4.44Å; L37-L81 HydrophobicContact CD1-CD1 4.31Å; L37-T82 CarbonylContact C-O 3.5Å; L37-T82 WeakPolarHBondContact CA-O 3.44Å; L37-P86 HydrophobicContact CD1-CB 4.28Å; L37-P86 HydrophobicContact CD1-CG 4.16Å; L37-P86 HydrophobicContact CD2-CG 4.32Å; L37-P86 HydrophobicContact CG-CB 4.21Å; L37-P86 HydrophobicContact CG-CG 4.34Å; L37-I105 HydrophobicContact CD2-CD1 3.97Å; L37-I105 HydrophobicContact CD2-CG1 4.26Å
38	A	88.8	Confident	88.8	Confident	52 Å²	52	53.1 Å²	53.1	43%	0.43	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	116.3	166.2	0	0	0	0	0	108.9	T82	A38-T82 VanDerWaalsContact CB-OG1 3.29Å; A38-T82 WeakPolarHBondContact CB-OG1 3.28Å; A38-T82 PolarHBondContact N-O 2.89Å; A38-T82 PolarHBondContact O-N 3.39Å; A38-T82 PolarHBondContact O-OG1 3.44Å
39	A	83.5	Confident	88.7	Confident	37 Å²	37	51.6 Å²	51.6	31%	0.306	31%	0.305	S	S	.	.			trans	-108.4	121.3	-178.6	0	0	0	0	0	109.9	A43 L44 L81	A39-A43 HydrophobicContact CB-CB 4.32Å; A39-L44 HydrophobicContact CB-CD1 4.08Å; A39-L44 HydrophobicContact CB-CG 4.03Å; A39-L81 HydrophobicContact CB-CD2 3.48Å; A39-L81 VanDerWaalsContact CB-CD2 3.48Å
40	P	77	Confident	88.5	Confident	51 Å²	51	60.8 Å²	60.8	33%	0.331	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-66.8	159.1	173.5	25.5	-30	0	0	0	112.1	G42 A43 N80	P40-G42 PolarHBondContact O-N 3.15Å; P40-A43 PolarHBondContact O-N 3.12Å; P40-A43 VanDerWaalsContact O-N 3.15Å; P40-N80 VanDerWaalsContact CD-O 3.31Å; P40-N80 WeakPolarHBondContact CD-O 3.41Å; P40-N80 HydrophobicContact CG-CB 3.74Å
41	D	67.8	Low	88.2	Confident	173 Å²	173	63.2 Å²	63.2	93%	0.925	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	54	22.9	165.3	-55.8	-35.2	0	0	0	117.3
42	G	75.7	Confident	88	Confident	45 Å²	45	64.1 Å²	64.1	46%	0.464	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	75.2	24.6	178.1	0	0	0	0	0	114.2	P40 L44 A45	P40-G42 PolarHBondContact O-N 3.15Å; G42-L44 PolarHBondContact O-N 3.06Å; G42-A45 WeakPolarHBondContact O-CB 3.42Å; G42-A45 PolarHBondContact O-N 3.2Å
43	A	81.9	Confident	87.8	Confident	31 Å²	31	63.7 Å²	63.7	26%	0.256	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.3	179.8	0	0	0	0	0	114.7	A39 P40 L79	A39-A43 HydrophobicContact CB-CB 4.32Å; P40-A43 PolarHBondContact O-N 3.12Å; P40-A43 VanDerWaalsContact O-N 3.15Å; A43-L79 HydrophobicContact CB-CB 4.5Å
44	L	89.4	Confident	87.7	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.01	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	29.9	174.2	-54.2	177.9	0	0	0	111.8	R34 A39 G42 D46 W47 L76 L79 L81	R34-L44 HydrophobicContact CG-CD1 4.34Å; R34-L44 PolarHBondContact NH1-O 2.83Å; R34-L44 PolarHBondContact NH2-O 3.35Å; A39-L44 HydrophobicContact CB-CD1 4.08Å; A39-L44 HydrophobicContact CB-CG 4.03Å; G42-L44 PolarHBondContact O-N 3.06Å; L44-D46 VanDerWaalsContact C-N 3.28Å; L44-D46 PolarHBondContact O-N 3.34Å; L44-W47 HydrophobicContact CB-CD2 4.45Å; L44-W47 HydrophobicContact CB-CG 4.27Å; L44-W47 HydrophobicContact CD2-CZ2 4.19Å; L44-W47 PolarHBondContact O-N 3.24Å; L44-L76 HydrophobicContact CD2-CD1 4.28Å; L44-L76 HydrophobicContact CD2-CD2 3.8Å; L44-L79 HydrophobicContact CD2-CD1 4.28Å; L44-L81 HydrophobicContact CD1-CD2 4.33Å
45	A	88.3	Confident	87.7	Confident	70 Å²	70	61.1 Å²	61.1	58%	0.579	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-26.4	-175.6	0	0	0	0	0	113.4	G42 W47	G42-A45 WeakPolarHBondContact O-CB 3.42Å; G42-A45 PolarHBondContact O-N 3.2Å; A45-W47 VanDerWaalsContact C-N 3.29Å
46	D	92.2	Very high	87.6	Confident	56 Å²	56	55.9 Å²	55.9	30%	0.299	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-10.9	177.4	65.4	-30.9	0	0	0	113.6	L44 N48 W57 T58	L44-D46 VanDerWaalsContact C-N 3.28Å; L44-D46 PolarHBondContact O-N 3.34Å; D46-N48 PolarHBondContact O-N 2.84Å; D46-W57 VanDerWaalsContact O-CD1 3.24Å; D46-W57 PolarHBondContact O-NE1 2.89Å; D46-W57 WeakPolarHBondContact OD2-CA 3.47Å; D46-T58 PolarHBondContact OD1-OG1 2.67Å; D46-T58 WeakPolarHBondContact OD2-CB 3.12Å; D46-T58 PolarHBondContact OD2-N 2.98Å; D46-T58 PolarHBondContact OD2-OG1 3.44Å
47	W	93.4	Very high	87.7	Confident	7 Å²	7	54.9 Å²	54.9	3%	0.027	34%	0.343	C	S	.	.			trans	-71.8	88.5	172.9	-71.1	32	0	0	0	110.2	L30 L31 R34 L44 A45 W57 T58 V60 L76	L30-W47 HydrophobicContact CB-CE3 4.34Å; L30-W47 HydrophobicContact CB-CZ3 4.01Å; L30-W47 HydrophobicContact CD2-CH2 3.93Å; L30-W47 HydrophobicContact CD2-CZ3 4.24Å; L30-W47 VanDerWaalsContact O-CZ3 3.3Å; L30-W47 WeakPolarHBondContact O-CZ3 3.32Å; L31-W47 HydrophobicContact CD2-CB 4.3Å; R34-W47 HydrophobicContact CB-CE3 3.9Å; R34-W47 HydrophobicContact CB-CZ3 3.96Å; R34-W47 HydrophobicContact CG-CE3 4.33Å; R34-W47 PolarHBondContact NH1-O 3.36Å; L44-W47 HydrophobicContact CB-CD2 4.45Å; L44-W47 HydrophobicContact CB-CG 4.27Å; L44-W47 HydrophobicContact CD2-CZ2 4.19Å; L44-W47 PolarHBondContact O-N 3.24Å; A45-W47 VanDerWaalsContact C-N 3.29Å; W47-W57 HydrophobicContact CB-CD2 4.05Å; W47-W57 HydrophobicContact CB-CE3 3.87Å; W47-W57 HydrophobicContact CB-CZ3 4.2Å; W47-W57 AromaticContact CD1-CG 3.85Å; W47-W57 HydrophobicContact CD2-CD2 4.44Å; W47-W57 AromaticContact CD2-CE3 3.69Å; W47-W57 HydrophobicContact CD2-CE3 3.69Å; W47-W57 HydrophobicContact CD2-CZ3 4.25Å; W47-W57 HydrophobicContact CE3-CE3 4.11Å; W47-W57 HydrophobicContact CE3-CZ3 4.25Å; W47-W57 HydrophobicContact CG-CB 4.27Å; W47-W57 AromaticContact CG-CD2 3.91Å; W47-W57 HydrophobicContact CG-CD2 3.91Å; W47-W57 AromaticContact CG-CE3 3.59Å; W47-W57 HydrophobicContact CG-CE3 3.59Å; W47-W57 HydrophobicContact CG-CG 4.2Å; W47-W57 HydrophobicContact CG-CZ3 4.26Å; W47-T58 PolarHBondContact NE1-O 3.3Å; W47-V60 HydrophobicContact CZ2-CG2 4.1Å; W47-L76 HydrophobicContact CH2-CD1 4.03Å; W47-L76 HydrophobicContact CZ2-CD1 3.97Å; W47-L76 HydrophobicContact CZ2-CD2 4.2Å
48	N	90.7	Very high	87.8	Confident	67 Å²	67	56.7 Å²	56.7	36%	0.358	36%	0.356	S	S	.	.			trans	-119.1	123.9	-168.8	-175.6	-0.5	0	0	0	112.8	D46 R50 D51 W57	D46-N48 PolarHBondContact O-N 2.84Å; N48-R50 PolarHBondContact O-N 3.37Å; N48-R50 PolarHBondContact OD1-N 3.23Å; N48-R50 VanDerWaalsContact OD1-N 3.13Å; N48-D51 PolarHBondContact O-N 2.66Å; N48-D51 VanDerWaalsContact O-N 3.07Å; N48-W57 VanDerWaalsContact O-CZ2 3.29Å; N48-W57 WeakPolarHBondContact O-CZ2 3.24Å
49	A	91.1	Very high	88.1	Confident	54 Å²	54	55.4 Å²	55.4	45%	0.446	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-13.3	179.8	0	0	0	0	0	115.3	V23 L31	V23-A49 PolarHBondContact N-O 3.41Å; L31-A49 HydrophobicContact CD1-CB 3.68Å
50	R	89.9	Confident	88.7	Confident	204 Å²	204	54.3 Å²	54.3	77%	0.77	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-12.1	177.4	-63.3	-177.6	176.6	174.3	-0.1	114.1	V21 N48	V21-R50 CarbonylContact O-C 3.23Å; N48-R50 PolarHBondContact O-N 3.37Å; N48-R50 PolarHBondContact OD1-N 3.23Å; N48-R50 VanDerWaalsContact OD1-N 3.13Å
51	D	89.9	Confident	89.5	Confident	50 Å²	50	54.9 Å²	54.9	27%	0.267	34%	0.342	S	S	.	.	S	Bend	trans	-74.8	149.7	177.9	-61.2	-28.7	0	0	0	110.1	V23 N48 T53 W57	V23-D51 WeakPolarHBondContact CA-O 3.44Å; V23-D51 WeakPolarHBondContact CB-O 3.44Å; V23-D51 WeakPolarHBondContact CG2-O 3.28Å; V23-D51 PolarHBondContact N-O 2.9Å; N48-D51 PolarHBondContact O-N 2.66Å; N48-D51 VanDerWaalsContact O-N 3.07Å; D51-T53 VanDerWaalsContact C-N 3.3Å; D51-T53 PolarHBondContact O-N 3.3Å; D51-W57 PolarHBondContact OD2-NE1 3.28Å
52	A	88.6	Confident	90.8	Very high	56 Å²	56	48.4 Å²	48.4	46%	0.463	31%	0.31	S	S	.	.	S	Bend	trans	-68.2	-32.8	177	0	0	0	0	0	112.3	V21 N24	V21-A52 VanDerWaalsContact CG1-CA 3.47Å; V21-A52 HydrophobicContact CG1-CB 3.56Å; N24-A52 PolarHBondContact N-O 3.09Å; N24-A52 VanDerWaalsContact N-O 3.14Å
53	T	90.2	Very high	91.5	Very high	35 Å²	35	50.1 Å²	50.1	22%	0.215	31%	0.308	C	S	.	.			trans	-146	147.8	-174.1	73.6	0	0	0	0	109.9	D51 C55 G68	D51-T53 VanDerWaalsContact C-N 3.3Å; D51-T53 PolarHBondContact O-N 3.3Å; T53-C55 PolarHBondContact O-N 2.77Å; T53-G68 WeakPolarHBondContact CG2-O 3.29Å
54	P	93	Very high	91.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-78.7	1.7	175.9	35.7	-40	0	0	0	113.8	N24 D26 L30 S56 W57 V60 V71	N24-P54 WeakPolarHBondContact OD1-CD 3.45Å; D26-P54 HydrophobicContact CB-CG 4.29Å; L30-P54 HydrophobicContact CD1-CB 3.41Å; L30-P54 VanDerWaalsContact CD1-CB 3.41Å; L30-P54 HydrophobicContact CD1-CG 3.73Å; P54-S56 PolarHBondContact O-N 3.31Å; P54-S56 VanDerWaalsContact O-N 3.14Å; P54-W57 HydrophobicContact CB-CD2 3.57Å; P54-W57 HydrophobicContact CB-CE3 3.43Å; P54-W57 VanDerWaalsContact CB-CE3 3.43Å; P54-W57 HydrophobicContact CB-CG 4.21Å; P54-W57 HydrophobicContact CB-CH2 3.99Å; P54-W57 HydrophobicContact CB-CZ2 4.13Å; P54-W57 HydrophobicContact CB-CZ3 3.67Å; P54-W57 WeakPolarHBondContact O-CB 3.48Å; P54-W57 PolarHBondContact O-N 2.82Å; P54-V60 HydrophobicContact CB-CG1 4.47Å; P54-V60 WeakPolarHBondContact O-CB 3.37Å; P54-V60 WeakPolarHBondContact O-CG1 3.28Å; P54-V71 HydrophobicContact CG-CG2 3.64Å
55	C	92.5	Very high	90.1	Very high	40 Å²	40	55.5 Å²	55.5	27%	0.27	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-69.6	-12.9	-169.4	-60.3	0	0	0	0	115.2	T53 C62 G69	T53-C55 PolarHBondContact O-N 2.77Å; C55-C62 WeakPolarHBondContact CA-SG 3.42Å; C55-C62 HydrophobicContact CB-CB 3.7Å; C55-C62 WeakPolarHBondContact CB-SG 3.34Å; C55-C62 WeakPolarHBondContact SG-CB 2.96Å; C55-C62 CovalentContact SG-SG 2.03Å; C55-C62 PolarHBondContact SG-SG 3.04Å; C55-G69 PolarHBondContact SG-O 3.44Å
56	S	90.9	Very high	88.3	Confident	95 Å²	95	60 Å²	60	66%	0.664	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-95.7	-1.5	171.4	56.9	0	0	0	0	113.1	P54	P54-S56 PolarHBondContact O-N 3.31Å; P54-S56 VanDerWaalsContact O-N 3.14Å
57	W	94.9	Very high	86.6	Confident	7 Å²	7	61.2 Å²	61.2	3%	0.027	40%	0.403	C	S	.	.	S	Bend	trans	-75.2	148.6	-177.5	-66.3	-6	0	0	0	111.7	V23 L30 L31 D46 W47 N48 D51 P54 G59 V60	V23-W57 HydrophobicContact CG2-CH2 4.04Å; V23-W57 HydrophobicContact CG2-CZ2 3.88Å; L30-W57 HydrophobicContact CB-CE3 4.22Å; L30-W57 HydrophobicContact CB-CZ3 3.68Å; L30-W57 HydrophobicContact CD1-CE3 4.03Å; L30-W57 HydrophobicContact CD1-CZ3 4.1Å; L31-W57 HydrophobicContact CD1-CH2 3.98Å; L31-W57 HydrophobicContact CD2-CH2 3.97Å; L31-W57 HydrophobicContact CD2-CZ3 4.22Å; L31-W57 HydrophobicContact CG-CH2 3.68Å; L31-W57 HydrophobicContact CG-CZ3 4.03Å; D46-W57 VanDerWaalsContact O-CD1 3.24Å; D46-W57 PolarHBondContact O-NE1 2.89Å; D46-W57 WeakPolarHBondContact OD2-CA 3.47Å; W47-W57 HydrophobicContact CB-CD2 4.05Å; W47-W57 HydrophobicContact CB-CE3 3.87Å; W47-W57 HydrophobicContact CB-CZ3 4.2Å; W47-W57 AromaticContact CD1-CG 3.85Å; W47-W57 HydrophobicContact CD2-CD2 4.44Å; W47-W57 AromaticContact CD2-CE3 3.69Å; W47-W57 HydrophobicContact CD2-CE3 3.69Å; W47-W57 HydrophobicContact CD2-CZ3 4.25Å; W47-W57 HydrophobicContact CE3-CE3 4.11Å; W47-W57 HydrophobicContact CE3-CZ3 4.25Å; W47-W57 HydrophobicContact CG-CB 4.27Å; W47-W57 AromaticContact CG-CD2 3.91Å; W47-W57 HydrophobicContact CG-CD2 3.91Å; W47-W57 AromaticContact CG-CE3 3.59Å; W47-W57 HydrophobicContact CG-CE3 3.59Å; W47-W57 HydrophobicContact CG-CG 4.2Å; W47-W57 HydrophobicContact CG-CZ3 4.26Å; N48-W57 VanDerWaalsContact O-CZ2 3.29Å; N48-W57 WeakPolarHBondContact O-CZ2 3.24Å; D51-W57 PolarHBondContact OD2-NE1 3.28Å; P54-W57 HydrophobicContact CB-CD2 3.57Å; P54-W57 HydrophobicContact CB-CE3 3.43Å; P54-W57 VanDerWaalsContact CB-CE3 3.43Å; P54-W57 HydrophobicContact CB-CG 4.21Å; P54-W57 HydrophobicContact CB-CH2 3.99Å; P54-W57 HydrophobicContact CB-CZ2 4.13Å; P54-W57 HydrophobicContact CB-CZ3 3.67Å; P54-W57 WeakPolarHBondContact O-CB 3.48Å; P54-W57 PolarHBondContact O-N 2.82Å; W57-G59 PolarHBondContact O-N 3.1Å; W57-V60 HydrophobicContact CB-CB 4.25Å; W57-V60 HydrophobicContact CB-CG2 3.82Å; W57-V60 PolarHBondContact O-N 2.78Å
58	T	93.5	Very high	85.2	Confident	59 Å²	59	62.4 Å²	62.4	36%	0.362	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	123.7	178.4	-66.5	0	0	0	0	109.7	D46 W47 V60 L76	D46-T58 PolarHBondContact OD1-OG1 2.67Å; D46-T58 WeakPolarHBondContact OD2-CB 3.12Å; D46-T58 PolarHBondContact OD2-N 2.98Å; D46-T58 PolarHBondContact OD2-OG1 3.44Å; W47-T58 PolarHBondContact NE1-O 3.3Å; T58-V60 VanDerWaalsContact C-N 3.29Å; T58-V60 PolarHBondContact O-N 2.9Å; T58-L76 WeakPolarHBondContact O-CD2 3.4Å
59	G	94.9	Very high	84.7	Confident	24 Å²	24	59.8 Å²	59.8	25%	0.247	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	-0	179.1	0	0	0	0	0	116.1	W57 I74 S75	W57-G59 PolarHBondContact O-N 3.1Å; G59-I74 CarbonylContact O-C 3.48Å; G59-I74 VanDerWaalsContact O-CA 3.3Å; G59-I74 WeakPolarHBondContact O-CA 3.47Å; G59-S75 WeakPolarHBondContact CA-O 3.5Å; G59-S75 PolarHBondContact O-N 2.96Å
60	V	96.5	Very high	84.6	Confident	14 Å²	14	58.5 Å²	58.5	9%	0.085	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	130.7	-178.4	-178.9	0	0	0	0	110.7	L30 W47 P54 W57 T58 V71	L30-V60 HydrophobicContact CD1-CG1 4.12Å; L30-V60 HydrophobicContact CD1-CG2 3.89Å; L30-V60 HydrophobicContact CD2-CG2 4.5Å; W47-V60 HydrophobicContact CZ2-CG2 4.1Å; P54-V60 HydrophobicContact CB-CG1 4.47Å; P54-V60 WeakPolarHBondContact O-CB 3.37Å; P54-V60 WeakPolarHBondContact O-CG1 3.28Å; W57-V60 HydrophobicContact CB-CB 4.25Å; W57-V60 HydrophobicContact CB-CG2 3.82Å; W57-V60 PolarHBondContact O-N 2.78Å; T58-V60 VanDerWaalsContact C-N 3.29Å; T58-V60 PolarHBondContact O-N 2.9Å; V60-V71 HydrophobicContact CG1-CG1 3.95Å; V60-V71 HydrophobicContact CG1-CG2 3.82Å
61	S	94.9	Very high	84.8	Confident	64 Å²	64	48.8 Å²	48.8	45%	0.448	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.6	172.7	-63.7	0	0	0	0	110.3	V71 T72 G73	S61-V71 WeakPolarHBondContact O-CA 3.42Å; S61-T72 PolarHBondContact O-N 3.11Å; S61-T72 PolarHBondContact O-OG1 2.98Å; S61-G73 PolarHBondContact N-O 3.19Å; S61-G73 PolarHBondContact O-N 3.11Å
62	C	94.6	Very high	85.1	Confident	36 Å²	36	48.4 Å²	48.4	24%	0.243	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	158.2	179.7	-68.3	0	0	0	0	112.1	C55 G69 A70	C55-C62 WeakPolarHBondContact CA-SG 3.42Å; C55-C62 HydrophobicContact CB-CB 3.7Å; C55-C62 WeakPolarHBondContact CB-SG 3.34Å; C55-C62 WeakPolarHBondContact SG-CB 2.96Å; C55-C62 CovalentContact SG-SG 2.03Å; C55-C62 PolarHBondContact SG-SG 3.04Å; C62-G69 PolarHBondContact SG-O 2.94Å; C62-G69 VanDerWaalsContact SG-O 3.41Å; C62-A70 VanDerWaalsContact CA-O 3.27Å; C62-A70 WeakPolarHBondContact CA-O 3.31Å
63	D	89.4	Confident	85.5	Confident	81 Å²	81	46.1 Å²	46.1	43%	0.433	34%	0.34	S	S	.	.			trans	-68.8	147.1	170.3	-168.5	6.2	0	0	0	111.6	G65 G69 A70 T72 R94	D63-G65 PolarHBondContact O-N 2.89Å; D63-G69 WeakPolarHBondContact O-CA 3.35Å; D63-A70 PolarHBondContact N-O 3.28Å; D63-T72 HydrophobicContact CB-CG2 3.96Å; D63-R94 IonicContact OD2-NH1 2.78Å
64	A	77.4	Confident	85.9	Confident	104 Å²	104	44.5 Å²	44.5	86%	0.86	33%	0.33	S	S	*	.			trans	-76.8	22.4	-174.5	0	0	0	0	0	114.3
65	G	65.9	Low	86.1	Confident	42 Å²	42	47.4 Å²	47.4	43%	0.433	35%	0.35	S	S	.	.			trans	-75.2	148.4	-173.7	0	0	0	0	0	115	D63 G67	D63-G65 PolarHBondContact O-N 2.89Å; G65-G67 PolarHBondContact O-N 2.98Å
66	V	48.9	Very low	86.2	Confident	164 Å²	164	45.6 Å²	45.6	99%	0.994	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	97.6	174.1	-172.9	0	0	0	0	109.1
67	G	57.8	Low	86.1	Confident	83 Å²	83	42.9 Å²	42.9	86%	0.856	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	148.4	13.5	177.9	0	0	0	0	0	117.3	G65	G65-G67 PolarHBondContact O-N 2.98Å
68	G	63.1	Low	85.6	Confident	31 Å²	31	44.7 Å²	44.7	32%	0.32	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	34.9	175.6	0	0	0	0	0	115.1	N24 T53	N24-G68 PolarHBondContact ND2-O 3.11Å; T53-G68 WeakPolarHBondContact CG2-O 3.29Å
69	G	79.9	Confident	85.2	Confident	12 Å²	12	44.1 Å²	44.1	12%	0.124	34%	0.337	C	S	.	.			trans	43.1	110.2	162.9	0	0	0	0	0	117.1	C55 C62 D63	C55-G69 PolarHBondContact SG-O 3.44Å; C62-G69 PolarHBondContact SG-O 2.94Å; C62-G69 VanDerWaalsContact SG-O 3.41Å; D63-G69 WeakPolarHBondContact O-CA 3.35Å
70	A	90.1	Very high	84.7	Confident	27 Å²	27	46 Å²	46	22%	0.223	34%	0.341	C	S	.	.			trans	-68.2	139.1	168	0	0	0	0	0	110.1	D26 C62 D63 T72 R94	D26-A70 WeakPolarHBondContact OD2-CA 3.35Å; C62-A70 VanDerWaalsContact CA-O 3.27Å; C62-A70 WeakPolarHBondContact CA-O 3.31Å; D63-A70 PolarHBondContact N-O 3.28Å; A70-T72 PolarHBondContact O-N 2.99Å; A70-R94 HydrophobicContact CB-CG 4.49Å
71	V	95	Very high	84.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	122.4	-179.8	176.7	0	0	0	0	109.8	D26 L30 P54 V60 S61 I74 L92 R94	D26-V71 HydrophobicContact CB-CB 4.36Å; D26-V71 HydrophobicContact CB-CG2 3.74Å; D26-V71 PolarHBondContact OD2-N 3.19Å; L30-V71 HydrophobicContact CD1-CG2 4Å; P54-V71 HydrophobicContact CG-CG2 3.64Å; V60-V71 HydrophobicContact CG1-CG1 3.95Å; V60-V71 HydrophobicContact CG1-CG2 3.82Å; S61-V71 WeakPolarHBondContact O-CA 3.42Å; V71-I74 HydrophobicContact CG1-CD1 3.87Å; V71-I74 HydrophobicContact CG1-CG1 4.36Å; V71-L92 HydrophobicContact CB-CD1 4.35Å; V71-L92 HydrophobicContact CB-CD2 4.42Å; V71-L92 HydrophobicContact CG1-CD1 3.97Å; V71-R94 CarbonylContact O-C 3.54Å
72	T	95.5	Very high	84	Confident	43 Å²	43	45.2 Å²	45.2	26%	0.264	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-22.1	-178.9	54.8	0	0	0	0	112.8	S61 D63 A70 A96 S97	S61-T72 PolarHBondContact O-N 3.11Å; S61-T72 PolarHBondContact O-OG1 2.98Å; D63-T72 HydrophobicContact CB-CG2 3.96Å; A70-T72 PolarHBondContact O-N 2.99Å; T72-A96 PolarHBondContact O-N 3.32Å; T72-S97 PolarHBondContact O-N 2.94Å
73	G	97.1	Very high	83.9	Confident	7 Å²	7	45 Å²	45	7%	0.072	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	150.6	-179.6	0	0	0	0	0	113.8	S61 S97	S61-G73 PolarHBondContact N-O 3.19Å; S61-G73 PolarHBondContact O-N 3.11Å; G73-S97 CarbonylContact C-O 3.18Å; G73-S97 VanDerWaalsContact CA-O 3.25Å; G73-S97 WeakPolarHBondContact CA-O 3.27Å
74	I	97.5	Very high	84	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.6	172.4	-61.3	91.4	0	0	0	107.9	L30 G59 V71 L76 L89 L92 V95 S97 I98 D99	L30-I74 HydrophobicContact CD2-CD1 4.37Å; L30-I74 HydrophobicContact CD2-CG1 3.89Å; G59-I74 CarbonylContact O-C 3.48Å; G59-I74 VanDerWaalsContact O-CA 3.3Å; G59-I74 WeakPolarHBondContact O-CA 3.47Å; V71-I74 HydrophobicContact CG1-CD1 3.87Å; V71-I74 HydrophobicContact CG1-CG1 4.36Å; I74-L76 HydrophobicContact CG2-CD1 3.92Å; I74-L76 HydrophobicContact CG2-CG 3.8Å; I74-L89 HydrophobicContact CD1-CD2 4.19Å; I74-L89 HydrophobicContact CG1-CD2 4.24Å; I74-L92 HydrophobicContact CD1-CD1 3.82Å; I74-V95 HydrophobicContact CD1-CB 4.42Å; I74-V95 HydrophobicContact CD1-CG2 3.42Å; I74-V95 VanDerWaalsContact CD1-CG2 3.42Å; I74-S97 PolarHBondContact N-O 2.84Å; I74-I98 CarbonylContact O-C 3.45Å; I74-I98 WeakPolarHBondContact O-CA 3.4Å; I74-D99 PolarHBondContact O-N 3.34Å
75	S	97.2	Very high	84.9	Confident	61 Å²	61	39.3 Å²	39.3	43%	0.427	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	100.9	179.5	179	0	0	0	0	110	G59 D99	G59-S75 WeakPolarHBondContact CA-O 3.5Å; G59-S75 PolarHBondContact O-N 2.96Å; S75-D99 CarbonylContact C-O 3.41Å; S75-D99 WeakPolarHBondContact CA-O 3.48Å
76	L	94.9	Very high	86.3	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.01	28%	0.276	C	S	.	.			trans	-122.8	38.7	-176.8	-58.3	177.1	0	0	0	111.5	L37 L44 W47 T58 I74 L79 L81 D99 L100 N103	L37-L76 HydrophobicContact CD1-CD1 4.44Å; L44-L76 HydrophobicContact CD2-CD1 4.28Å; L44-L76 HydrophobicContact CD2-CD2 3.8Å; W47-L76 HydrophobicContact CH2-CD1 4.03Å; W47-L76 HydrophobicContact CZ2-CD1 3.97Å; W47-L76 HydrophobicContact CZ2-CD2 4.2Å; T58-L76 WeakPolarHBondContact O-CD2 3.4Å; I74-L76 HydrophobicContact CG2-CD1 3.92Å; I74-L76 HydrophobicContact CG2-CG 3.8Å; L76-L79 HydrophobicContact CB-CD1 4.04Å; L76-L79 HydrophobicContact CD2-CD1 3.93Å; L76-L81 HydrophobicContact CB-CD1 3.79Å; L76-L81 HydrophobicContact CD1-CD1 4.14Å; L76-D99 PolarHBondContact N-O 3.08Å; L76-L100 HydrophobicContact CB-CD2 3.91Å; L76-L100 HydrophobicContact CD1-CD2 4.04Å; L76-L100 HydrophobicContact CG-CD2 4.29Å; L76-N103 PolarHBondContact O-ND2 2.93Å
77	A	89.5	Confident	88.5	Confident	38 Å²	38	31.4 Å²	31.4	31%	0.314	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	141.5	-178.6	0	0	0	0	0	112.3	L79 S101	A77-L79 VanDerWaalsContact C-N 3.34Å; A77-L79 PolarHBondContact O-N 3.05Å; A77-S101 CarbonylContact C-O 3.58Å; A77-S101 WeakPolarHBondContact CA-O 3.33Å; A77-S101 WeakPolarHBondContact CB-OG 3.27Å
78	G	84.3	Confident	90.3	Very high	45 Å²	45	27.9 Å²	27.9	46%	0.464	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	23.3	169.2	0	0	0	0	0	115.7	S101 Y102	G78-S101 PolarHBondContact N-O 3.24Å; G78-Y102 WeakPolarHBondContact CA-O 3.47Å; G78-Y102 PolarHBondContact N-O 3.16Å
79	L	85.2	Confident	91.8	Very high	48 Å²	48	26.6 Å²	26.6	25%	0.251	19%	0.193	S	C	.	.	S	Bend	trans	-99.2	11.1	-176.7	-65	-175.2	0	0	0	113.7	A43 L44 L76 A77 L81 N103	A43-L79 HydrophobicContact CB-CB 4.5Å; L44-L79 HydrophobicContact CD2-CD1 4.28Å; L76-L79 HydrophobicContact CB-CD1 4.04Å; L76-L79 HydrophobicContact CD2-CD1 3.93Å; A77-L79 VanDerWaalsContact C-N 3.34Å; A77-L79 PolarHBondContact O-N 3.05Å; L79-L81 HydrophobicContact CB-CD1 4.44Å; L79-L81 HydrophobicContact CB-CD2 4.04Å; L79-L81 HydrophobicContact CB-CG 3.89Å; L79-L81 PolarHBondContact O-N 2.96Å; L79-N103 PolarHBondContact N-OD1 2.95Å; L79-N103 VanDerWaalsContact N-OD1 3.11Å
80	N	83.2	Confident	92.5	Very high	63 Å²	63	26.3 Å²	26.3	34%	0.337	19%	0.189	S	C	.	.			trans	54.5	34.2	-175.2	-64.1	-28.7	0	0	0	113.1	P40 N103 Y104	P40-N80 VanDerWaalsContact CD-O 3.31Å; P40-N80 WeakPolarHBondContact CD-O 3.41Å; P40-N80 HydrophobicContact CG-CB 3.74Å; N80-N103 PolarHBondContact N-OD1 2.91Å; N80-N103 VanDerWaalsContact N-OD1 3.09Å; N80-Y104 HydrophobicContact CB-CD2 4.39Å; N80-Y104 HydrophobicContact CB-CE2 4.11Å
81	L	86.8	Confident	92.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	21%	0.207	C	C	.	.			trans	-67.4	135.2	179.8	-57.4	177.9	0	0	0	110.5	L37 A39 L44 L76 L79 N103 Y104 I105	L37-L81 HydrophobicContact CD1-CD1 4.31Å; A39-L81 HydrophobicContact CB-CD2 3.48Å; A39-L81 VanDerWaalsContact CB-CD2 3.48Å; L44-L81 HydrophobicContact CD1-CD2 4.33Å; L76-L81 HydrophobicContact CB-CD1 3.79Å; L76-L81 HydrophobicContact CD1-CD1 4.14Å; L79-L81 HydrophobicContact CB-CD1 4.44Å; L79-L81 HydrophobicContact CB-CD2 4.04Å; L79-L81 HydrophobicContact CB-CG 3.89Å; L79-L81 PolarHBondContact O-N 2.96Å; L81-N103 HydrophobicContact CB-CB 4.13Å; L81-N103 WeakPolarHBondContact CG-OD1 3.31Å; L81-N103 PolarHBondContact N-OD1 2.87Å; L81-Y104 CarbonylContact O-C 3.59Å; L81-Y104 VanDerWaalsContact O-CA 3.31Å; L81-Y104 WeakPolarHBondContact O-CA 3.45Å; L81-Y104 WeakPolarHBondContact O-CB 3.34Å; L81-Y104 PolarHBondContact O-N 3.01Å; L81-I105 HydrophobicContact CB-CG1 4.33Å
82	T	91.3	Very high	92.6	Very high	61 Å²	61	32.9 Å²	32.9	37%	0.374	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	170.7	172.5	57.6	0	0	0	0	109.9	L37 A38 Y104	L37-T82 CarbonylContact C-O 3.5Å; L37-T82 WeakPolarHBondContact CA-O 3.44Å; A38-T82 VanDerWaalsContact CB-OG1 3.29Å; A38-T82 WeakPolarHBondContact CB-OG1 3.28Å; A38-T82 PolarHBondContact N-O 2.89Å; A38-T82 PolarHBondContact O-N 3.39Å; A38-T82 PolarHBondContact O-OG1 3.44Å; T82-Y104 HydrophobicContact CG2-CD2 4.46Å; T82-Y104 HydrophobicContact CG2-CG 4.44Å
83	G	91.3	Very high	92.4	Very high	32 Å²	32	35.2 Å²	35.2	33%	0.33	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	101	-168.7	-178	0	0	0	0	0	112.5	A36 I105 G106	A36-G83 CarbonylContact O-C 3.59Å; A36-G83 WeakPolarHBondContact O-CA 3.25Å; G83-I105 CarbonylContact O-C 3.2Å; G83-I105 VanDerWaalsContact O-CA 3.32Å; G83-I105 WeakPolarHBondContact O-CA 3.09Å; G83-I105 WeakPolarHBondContact O-CG2 3.42Å; G83-G106 CarbonylContact C-O 3.48Å; G83-G106 VanDerWaalsContact C-O 3.24Å; G83-G106 PolarHBondContact O-N 3.07Å
84	S	93.2	Very high	92.2	Very high	56 Å²	56	41.6 Å²	41.6	39%	0.392	25%	0.247	S	C	.	.	S	Bend	trans	-91.7	164.3	-172.1	59	0	0	0	0	113.1	A36 P86	A36-S84 PolarHBondContact O-N 3.5Å; S84-P86 WeakPolarHBondContact O-CD 3.44Å
85	F	95.6	Very high	92.2	Very high	9 Å²	9	41.6 Å²	41.6	4%	0.039	25%	0.247	C	C	.	.			trans	-53.7	124.6	172.6	177	-97.8	0	0	0	111	A87 L100 L109 A113 V114 L123 L125	F85-A87 VanDerWaalsContact C-N 3.34Å; F85-A87 HydrophobicContact CD1-CB 4.47Å; F85-A87 PolarHBondContact O-N 2.86Å; F85-L100 HydrophobicContact CD2-CD1 4.31Å; F85-L100 HydrophobicContact CE2-CD1 4.4Å; F85-L109 HydrophobicContact CB-CD1 3.75Å; F85-L109 HydrophobicContact CD1-CD1 3.8Å; F85-L109 HydrophobicContact CD2-CD1 3.71Å; F85-L109 HydrophobicContact CE1-CD1 4.32Å; F85-L109 HydrophobicContact CE2-CD1 4.26Å; F85-L109 HydrophobicContact CG-CD1 3.45Å; F85-L109 VanDerWaalsContact CG-CD1 3.45Å; F85-A113 HydrophobicContact CD1-CB 4.06Å; F85-V114 HydrophobicContact CE1-CG1 4.01Å; F85-V114 HydrophobicContact CZ-CG1 4.25Å; F85-L123 HydrophobicContact CE2-CD1 4.25Å; F85-L125 HydrophobicContact CD2-CD1 4Å; F85-L125 HydrophobicContact CD2-CD2 4.01Å; F85-L125 HydrophobicContact CE2-CD1 4.15Å; F85-L125 HydrophobicContact CE2-CD2 4.06Å
86	P	95.4	Very high	92.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.238	C	C	.	.			trans	-78.1	78.4	-173.4	32.3	-37.7	0	0	0	111.9	A33 A36 L37 S84 A88 L89 L100	A33-P86 HydrophobicContact CB-CB 3.97Å; A33-P86 WeakPolarHBondContact O-CB 3.47Å; A36-P86 HydrophobicContact CB-CB 4.14Å; L37-P86 HydrophobicContact CD1-CB 4.28Å; L37-P86 HydrophobicContact CD1-CG 4.16Å; L37-P86 HydrophobicContact CD2-CG 4.32Å; L37-P86 HydrophobicContact CG-CB 4.21Å; L37-P86 HydrophobicContact CG-CG 4.34Å; S84-P86 WeakPolarHBondContact O-CD 3.44Å; P86-A88 PolarHBondContact O-N 3.42Å; P86-L89 HydrophobicContact CB-CD1 4.34Å; P86-L89 HydrophobicContact CB-CG 4.18Å; P86-L89 HydrophobicContact CG-CD1 3.6Å; P86-L89 HydrophobicContact CG-CG 3.99Å; P86-L89 WeakPolarHBondContact O-CB 3.36Å; P86-L89 WeakPolarHBondContact O-CG 3.33Å; P86-L89 PolarHBondContact O-N 3.09Å; P86-L100 HydrophobicContact CG-CD1 3.78Å
87	A	94.7	Very high	92.3	Very high	41 Å²	41	42 Å²	42	34%	0.339	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-56	-24.6	-174.5	0	0	0	0	0	114.9	F85 L89 C90 A113	F85-A87 VanDerWaalsContact C-N 3.34Å; F85-A87 HydrophobicContact CD1-CB 4.47Å; F85-A87 PolarHBondContact O-N 2.86Å; A87-L89 PolarHBondContact O-N 3.26Å; A87-C90 WeakPolarHBondContact O-CB 3.49Å; A87-C90 PolarHBondContact O-N 3.05Å; A87-A113 HydrophobicContact CB-CB 3.93Å
88	A	95.2	Very high	92.8	Very high	9 Å²	9	40.2 Å²	40.2	7%	0.074	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-63.8	-20.1	175.6	0	0	0	0	0	113.2	D32 A33 P86 C90 R91	D32-A88 HydrophobicContact CB-CB 4.1Å; A33-A88 HydrophobicContact CB-CB 3.99Å; P86-A88 PolarHBondContact O-N 3.42Å; A88-C90 PolarHBondContact O-N 3.35Å; A88-R91 WeakPolarHBondContact O-CB 3.48Å; A88-R91 PolarHBondContact O-N 3.1Å; A88-R91 VanDerWaalsContact O-N 3.07Å
89	L	95.7	Very high	93.4	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.016	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-58	-34.5	169.7	-66	-174	0	0	0	111.7	L30 A33 I74 P86 A87 R91 L92 I98	L30-L89 HydrophobicContact CD2-CD2 3.55Å; A33-L89 HydrophobicContact CB-CD2 3.52Å; A33-L89 HydrophobicContact CB-CG 3.81Å; I74-L89 HydrophobicContact CD1-CD2 4.19Å; I74-L89 HydrophobicContact CG1-CD2 4.24Å; P86-L89 HydrophobicContact CB-CD1 4.34Å; P86-L89 HydrophobicContact CB-CG 4.18Å; P86-L89 HydrophobicContact CG-CD1 3.6Å; P86-L89 HydrophobicContact CG-CG 3.99Å; P86-L89 WeakPolarHBondContact O-CB 3.36Å; P86-L89 WeakPolarHBondContact O-CG 3.33Å; P86-L89 PolarHBondContact O-N 3.09Å; A87-L89 PolarHBondContact O-N 3.26Å; L89-R91 PolarHBondContact O-N 3.33Å; L89-R91 VanDerWaalsContact O-N 3.12Å; L89-L92 HydrophobicContact CD2-CD1 4.28Å; L89-L92 VanDerWaalsContact O-CB 3.31Å; L89-L92 WeakPolarHBondContact O-CB 3.14Å; L89-L92 WeakPolarHBondContact O-CG 3.29Å; L89-L92 PolarHBondContact O-N 2.9Å; L89-L92 VanDerWaalsContact O-N 3.09Å; L89-I98 HydrophobicContact CB-CD1 3.97Å; L89-I98 HydrophobicContact CD1-CD1 4.17Å; L89-I98 HydrophobicContact CD1-CG1 4.41Å; L89-I98 HydrophobicContact CD1-CG2 4.12Å
90	C	94.8	Very high	93.9	Very high	6 Å²	6	37.5 Å²	37.5	4%	0.041	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-69.6	-5.2	178.6	-65.2	0	0	0	0	114.1	A87 A88 L92 A113 P116 C117	A87-C90 WeakPolarHBondContact O-CB 3.49Å; A87-C90 PolarHBondContact O-N 3.05Å; A88-C90 PolarHBondContact O-N 3.35Å; C90-L92 VanDerWaalsContact C-N 3.35Å; C90-A113 PolarHBondContact SG-O 3.36Å; C90-A113 VanDerWaalsContact SG-O 3.33Å; C90-P116 HydrophobicContact CB-CB 3.83Å; C90-P116 HydrophobicContact CB-CG 4.44Å; C90-P116 CarbonylContact O-C 3.55Å; C90-C117 WeakPolarHBondContact CA-SG 3.03Å; C90-C117 HydrophobicContact CB-CB 3.84Å; C90-C117 WeakPolarHBondContact CB-SG 3.31Å; C90-C117 WeakPolarHBondContact SG-CB 3.31Å; C90-C117 CovalentContact SG-SG 2.03Å; C90-C117 PolarHBondContact SG-SG 3.35Å
91	R	92.3	Very high	94.2	Very high	161 Å²	161	34.8 Å²	34.8	61%	0.608	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-82.5	-14.7	171.4	-61.5	-178.8	-173.6	150.2	5.7	112.7	D32 A88 L89 P93	D32-R91 IonicContact OD2-CZ 3.76Å; D32-R91 IonicContact OD2-NH1 2.78Å; D32-R91 PolarHBondContact OD2-NH1 3.35Å; D32-R91 IonicContact OD2-NH2 3.35Å; A88-R91 WeakPolarHBondContact O-CB 3.48Å; A88-R91 PolarHBondContact O-N 3.1Å; A88-R91 VanDerWaalsContact O-N 3.07Å; L89-R91 PolarHBondContact O-N 3.33Å; L89-R91 VanDerWaalsContact O-N 3.12Å; R91-P93 WeakPolarHBondContact O-CD 3.4Å
92	L	94.3	Very high	94.1	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	23%	0.225	C	C	.	.			trans	-69.7	117.9	177.9	-65.7	169.7	0	0	0	109.2	D26 L30 V71 I74 L89 C90 R94 V95	D26-L92 HydrophobicContact CB-CD2 3.66Å; L30-L92 HydrophobicContact CD2-CD1 4.13Å; L30-L92 HydrophobicContact CG-CD1 4.33Å; V71-L92 HydrophobicContact CB-CD1 4.35Å; V71-L92 HydrophobicContact CB-CD2 4.42Å; V71-L92 HydrophobicContact CG1-CD1 3.97Å; I74-L92 HydrophobicContact CD1-CD1 3.82Å; L89-L92 HydrophobicContact CD2-CD1 4.28Å; L89-L92 VanDerWaalsContact O-CB 3.31Å; L89-L92 WeakPolarHBondContact O-CB 3.14Å; L89-L92 WeakPolarHBondContact O-CG 3.29Å; L89-L92 PolarHBondContact O-N 2.9Å; L89-L92 VanDerWaalsContact O-N 3.09Å; C90-L92 VanDerWaalsContact C-N 3.35Å; L92-R94 PolarHBondContact O-N 3.43Å; L92-R94 VanDerWaalsContact O-N 3.15Å; L92-V95 HydrophobicContact CB-CB 3.84Å; L92-V95 HydrophobicContact CB-CG1 3.9Å; L92-V95 HydrophobicContact CD1-CB 4.34Å; L92-V95 WeakPolarHBondContact O-CG1 3.27Å; L92-V95 PolarHBondContact O-N 2.9Å
93	P	91	Very high	93.8	Very high	93 Å²	93	39.1 Å²	39.1	60%	0.604	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.7	-168.5	26.5	-34.9	0	0	0	113.7	R91	R91-P93 WeakPolarHBondContact O-CD 3.4Å
94	R	93.6	Very high	93.6	Very high	141 Å²	141	40.9 Å²	40.9	53%	0.532	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	8	-176	-64.2	-168.7	-177.3	175.9	1	114.2	D63 A70 V71 L92 A96	D63-R94 IonicContact OD2-NH1 2.78Å; A70-R94 HydrophobicContact CB-CG 4.49Å; V71-R94 CarbonylContact O-C 3.54Å; L92-R94 PolarHBondContact O-N 3.43Å; L92-R94 VanDerWaalsContact O-N 3.15Å; R94-A96 PolarHBondContact O-N 3.43Å
95	V	96.2	Very high	93.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	19%	0.187	C	C	.	.			trans	-65.4	110.1	179.2	68.6	0	0	0	0	110.2	I74 L92 I98 A119 L120	I74-V95 HydrophobicContact CD1-CB 4.42Å; I74-V95 HydrophobicContact CD1-CG2 3.42Å; I74-V95 VanDerWaalsContact CD1-CG2 3.42Å; L92-V95 HydrophobicContact CB-CB 3.84Å; L92-V95 HydrophobicContact CB-CG1 3.9Å; L92-V95 HydrophobicContact CD1-CB 4.34Å; L92-V95 WeakPolarHBondContact O-CG1 3.27Å; L92-V95 PolarHBondContact O-N 2.9Å; V95-I98 HydrophobicContact CG2-CD1 4.19Å; V95-I98 HydrophobicContact CG2-CG1 3.74Å; V95-A119 CarbonylContact O-C 3.58Å; V95-A119 VanDerWaalsContact O-C 3.29Å; V95-L120 WeakPolarHBondContact O-CA 3.25Å; V95-L120 PolarHBondContact O-N 3.17Å
96	A	97.6	Very high	93	Very high	30 Å²	30	38.5 Å²	38.5	25%	0.248	19%	0.193	C	C	.	.			trans	-101.6	-22.6	-179.5	0	0	0	0	0	112	T72 R94 R121 R122	T72-A96 PolarHBondContact O-N 3.32Å; R94-A96 PolarHBondContact O-N 3.43Å; A96-R121 HydrophobicContact CB-CB 4.5Å; A96-R121 HydrophobicContact CB-CG 4.32Å; A96-R121 CarbonylContact O-C 3.59Å; A96-R121 WeakPolarHBondContact O-CA 3.12Å; A96-R121 WeakPolarHBondContact O-CB 3.4Å; A96-R121 PolarHBondContact O-N 2.91Å; A96-R122 PolarHBondContact O-N 2.84Å
97	S	98.4	Very high	92.3	Very high	42 Å²	42	42.3 Å²	42.3	29%	0.294	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	128.4	-178.8	-164.3	0	0	0	0	111.4	T72 G73 I74 R122	T72-S97 PolarHBondContact O-N 2.94Å; G73-S97 CarbonylContact C-O 3.18Å; G73-S97 VanDerWaalsContact CA-O 3.25Å; G73-S97 WeakPolarHBondContact CA-O 3.27Å; I74-S97 PolarHBondContact N-O 2.84Å; S97-R122 WeakPolarHBondContact CA-O 3.3Å
98	I	98.3	Very high	91.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	115.7	168.9	-64	172.9	0	0	0	107.1	I74 L89 V95 L100 L120 R122 L123 D124	I74-I98 CarbonylContact O-C 3.45Å; I74-I98 WeakPolarHBondContact O-CA 3.4Å; L89-I98 HydrophobicContact CB-CD1 3.97Å; L89-I98 HydrophobicContact CD1-CD1 4.17Å; L89-I98 HydrophobicContact CD1-CG1 4.41Å; L89-I98 HydrophobicContact CD1-CG2 4.12Å; V95-I98 HydrophobicContact CG2-CD1 4.19Å; V95-I98 HydrophobicContact CG2-CG1 3.74Å; I98-L100 HydrophobicContact CG2-CD1 4.08Å; I98-L100 HydrophobicContact CG2-CG 3.89Å; I98-L120 HydrophobicContact CB-CD1 4.15Å; I98-L120 HydrophobicContact CD1-CD1 3.8Å; I98-L120 HydrophobicContact CG1-CD1 3.71Å; I98-R122 PolarHBondContact N-O 2.94Å; I98-L123 HydrophobicContact CB-CD1 4.03Å; I98-L123 HydrophobicContact CG2-CD1 4.07Å; I98-L123 WeakPolarHBondContact O-CA 3.5Å; I98-D124 PolarHBondContact O-N 2.96Å
99	D	97.8	Very high	91.5	Very high	36 Å²	36	44.9 Å²	44.9	19%	0.193	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	112.3	172.6	176.6	4.1	0	0	0	108.8	I74 S75 L76 S101 D124	I74-D99 PolarHBondContact O-N 3.34Å; S75-D99 CarbonylContact C-O 3.41Å; S75-D99 WeakPolarHBondContact CA-O 3.48Å; L76-D99 PolarHBondContact N-O 3.08Å; D99-S101 VanDerWaalsContact OD1-CB 3.23Å; D99-S101 WeakPolarHBondContact OD1-CB 3.45Å; D99-S101 PolarHBondContact OD1-N 3.17Å; D99-S101 PolarHBondContact OD1-OG 3.18Å; D99-D124 HydrophobicContact CB-CB 4.31Å
100	L	96	Very high	91.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.243	C	C	.	.			trans	-122.5	26.3	174.1	-53.3	173.6	0	0	0	110.5	L76 F85 P86 I98 N103 I105 D124 L125 N128	L76-L100 HydrophobicContact CB-CD2 3.91Å; L76-L100 HydrophobicContact CD1-CD2 4.04Å; L76-L100 HydrophobicContact CG-CD2 4.29Å; F85-L100 HydrophobicContact CD2-CD1 4.31Å; F85-L100 HydrophobicContact CE2-CD1 4.4Å; P86-L100 HydrophobicContact CG-CD1 3.78Å; I98-L100 HydrophobicContact CG2-CD1 4.08Å; I98-L100 HydrophobicContact CG2-CG 3.89Å; L100-N103 PolarHBondContact O-ND2 2.78Å; L100-I105 HydrophobicContact CB-CD1 3.62Å; L100-I105 HydrophobicContact CD1-CD1 3.82Å; L100-I105 HydrophobicContact CG-CD1 4.21Å; L100-D124 PolarHBondContact N-O 2.98Å; L100-L125 HydrophobicContact CB-CD2 3.88Å; L100-L125 HydrophobicContact CD1-CD2 3.9Å; L100-L125 HydrophobicContact CG-CD2 4.18Å; L100-N128 PolarHBondContact O-ND2 2.8Å
101	S	88.2	Confident	91.5	Very high	6 Å²	6	49.1 Å²	49.1	4%	0.042	25%	0.254	C	S	.	.			trans	-63.8	161.5	-176.2	60.5	0	0	0	0	113.2	A77 G78 D99 N103 S126	A77-S101 CarbonylContact C-O 3.58Å; A77-S101 WeakPolarHBondContact CA-O 3.33Å; A77-S101 WeakPolarHBondContact CB-OG 3.27Å; G78-S101 PolarHBondContact N-O 3.24Å; D99-S101 VanDerWaalsContact OD1-CB 3.23Å; D99-S101 WeakPolarHBondContact OD1-CB 3.45Å; D99-S101 PolarHBondContact OD1-N 3.17Å; D99-S101 PolarHBondContact OD1-OG 3.18Å; S101-N103 PolarHBondContact O-N 3.07Å; S101-N103 PolarHBondContact O-ND2 3.22Å; S101-S126 CarbonylContact C-O 3.43Å; S101-S126 WeakPolarHBondContact CA-O 3.27Å; S101-S126 VanDerWaalsContact CB-OG 3.23Å; S101-S126 WeakPolarHBondContact CB-OG 3.33Å
102	Y	85.3	Confident	91.6	Very high	146 Å²	146	48.1 Å²	48.1	57%	0.573	26%	0.261	S	S	*	.	S	Bend	trans	55	50.5	177.5	-60.2	-89.3	0	0	0	113.2	G78 S126 M127	G78-Y102 WeakPolarHBondContact CA-O 3.47Å; G78-Y102 PolarHBondContact N-O 3.16Å; Y102-S126 PolarHBondContact N-O 2.73Å; Y102-M127 WeakPolarHBondContact CA-O 3.3Å; Y102-M127 HydrophobicContact CD1-CB 3.97Å; Y102-M127 HydrophobicContact CD1-CG 3.97Å; Y102-M127 HydrophobicContact CE1-CB 4.32Å; Y102-M127 HydrophobicContact CE1-CG 3.81Å; Y102-M127 HydrophobicContact CG-CB 4.19Å; Y102-M127 PolarHBondContact N-O 3.23Å
103	N	84.6	Confident	91.6	Very high	6 Å²	6	48.7 Å²	48.7	3%	0.032	27%	0.266	C	S	.	.	S	Bend	trans	-134.9	-168.3	178.4	-75.5	-62.7	0	0	0	110.3	L76 L79 N80 L81 L100 S101 I105 M127 N128	L76-N103 PolarHBondContact O-ND2 2.93Å; L79-N103 PolarHBondContact N-OD1 2.95Å; L79-N103 VanDerWaalsContact N-OD1 3.11Å; N80-N103 PolarHBondContact N-OD1 2.91Å; N80-N103 VanDerWaalsContact N-OD1 3.09Å; L81-N103 HydrophobicContact CB-CB 4.13Å; L81-N103 WeakPolarHBondContact CG-OD1 3.31Å; L81-N103 PolarHBondContact N-OD1 2.87Å; L100-N103 PolarHBondContact O-ND2 2.78Å; S101-N103 PolarHBondContact O-N 3.07Å; S101-N103 PolarHBondContact O-ND2 3.22Å; N103-I105 HydrophobicContact CB-CD1 4.31Å; N103-I105 HydrophobicContact CB-CG1 4.07Å; N103-M127 PolarHBondContact N-O 3.31Å; N103-N128 VanDerWaalsContact CB-OD1 3.25Å; N103-N128 WeakPolarHBondContact CB-OD1 3.42Å; N103-N128 WeakPolarHBondContact O-CA 3.43Å; N103-N128 PolarHBondContact O-OD1 3.11Å
104	Y	87.3	Confident	91.8	Very high	68 Å²	68	44.3 Å²	44.3	27%	0.267	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	31.3	178.2	-58.9	-84.1	0	0	0	111.6	N80 L81 T82 G106 N128 H815	N80-Y104 HydrophobicContact CB-CD2 4.39Å; N80-Y104 HydrophobicContact CB-CE2 4.11Å; L81-Y104 CarbonylContact O-C 3.59Å; L81-Y104 VanDerWaalsContact O-CA 3.31Å; L81-Y104 WeakPolarHBondContact O-CA 3.45Å; L81-Y104 WeakPolarHBondContact O-CB 3.34Å; L81-Y104 PolarHBondContact O-N 3.01Å; T82-Y104 HydrophobicContact CG2-CD2 4.46Å; T82-Y104 HydrophobicContact CG2-CG 4.44Å; Y104-G106 PolarHBondContact O-N 3.34Å; Y104-N128 PolarHBondContact N-OD1 3.03Å; Y104-H815 PolarHBondContact OH-O 3.45Å; Y104-H815 VanDerWaalsContact OH-O 3.1Å
105	I	87.3	Confident	91.8	Very high	1 Å²	1	39 Å²	39	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	131.8	-176.6	-59.6	175.4	0	0	0	109.4	L37 L81 G83 L100 N103 N128 A129 L130	L37-I105 HydrophobicContact CD2-CD1 3.97Å; L37-I105 HydrophobicContact CD2-CG1 4.26Å; L81-I105 HydrophobicContact CB-CG1 4.33Å; G83-I105 CarbonylContact O-C 3.2Å; G83-I105 VanDerWaalsContact O-CA 3.32Å; G83-I105 WeakPolarHBondContact O-CA 3.09Å; G83-I105 WeakPolarHBondContact O-CG2 3.42Å; L100-I105 HydrophobicContact CB-CD1 3.62Å; L100-I105 HydrophobicContact CD1-CD1 3.82Å; L100-I105 HydrophobicContact CG-CD1 4.21Å; N103-I105 HydrophobicContact CB-CD1 4.31Å; N103-I105 HydrophobicContact CB-CG1 4.07Å; I105-N128 VanDerWaalsContact CB-OD1 3.26Å; I105-N128 WeakPolarHBondContact CB-OD1 3.23Å; I105-N128 PolarHBondContact N-OD1 3.38Å; I105-A129 CarbonylContact O-C 3.53Å; I105-A129 WeakPolarHBondContact O-CA 3.05Å; I105-A129 PolarHBondContact O-N 3.21Å; I105-L130 HydrophobicContact CG2-CD2 4.42Å; I105-L130 PolarHBondContact O-N 2.95Å
106	G	88.3	Confident	91.8	Very high	15 Å²	15	42.2 Å²	42.2	16%	0.155	25%	0.245	C	C	.	.			trans	177.8	174.4	-174.2	0	0	0	0	0	112.9	G83 Y104	G83-G106 CarbonylContact C-O 3.48Å; G83-G106 VanDerWaalsContact C-O 3.24Å; G83-G106 PolarHBondContact O-N 3.07Å; Y104-G106 PolarHBondContact O-N 3.34Å
107	P	80.9	Confident	91.7	Very high	79 Å²	79	40.8 Å²	40.8	51%	0.513	23%	0.233	S	C	.	.	S	Bend	cis	-84.7	-36.9	1.3	30.9	-33.3	0	0	0	113.8	L130 V131	P107-L130 CarbonylContact O-C 3.29Å; P107-L130 VanDerWaalsContact O-CA 3.29Å; P107-L130 WeakPolarHBondContact O-CA 3.34Å; P107-V131 HydrophobicContact CB-CG2 3.78Å; P107-V131 WeakPolarHBondContact O-CG2 3.35Å; P107-V131 PolarHBondContact O-N 2.95Å
108	N	80.2	Confident	91.5	Very high	96 Å²	96	44.4 Å²	44.4	51%	0.513	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-114.6	143.9	-164.5	-64.9	-7.3	0	0	0	113.8	V131	N108-V131 VanDerWaalsContact OD1-CG2 3.25Å; N108-V131 WeakPolarHBondContact OD1-CG2 3.2Å
109	L	94.6	Very high	91.4	Very high	8 Å²	8	45.8 Å²	45.8	4%	0.042	26%	0.255	C	S	.	.			trans	-108.4	101.6	163.2	-173.6	66.4	0	0	0	108	F85 V114 L125 L130 P135 L149 F154	F85-L109 HydrophobicContact CB-CD1 3.75Å; F85-L109 HydrophobicContact CD1-CD1 3.8Å; F85-L109 HydrophobicContact CD2-CD1 3.71Å; F85-L109 HydrophobicContact CE1-CD1 4.32Å; F85-L109 HydrophobicContact CE2-CD1 4.26Å; F85-L109 HydrophobicContact CG-CD1 3.45Å; F85-L109 VanDerWaalsContact CG-CD1 3.45Å; L109-V114 HydrophobicContact CD1-CG1 3.59Å; L109-V114 HydrophobicContact CD2-CG1 4.5Å; L109-V114 HydrophobicContact CG-CG1 4.06Å; L109-L125 HydrophobicContact CD1-CD1 3.96Å; L109-L125 HydrophobicContact CD2-CD1 3.66Å; L109-L125 HydrophobicContact CG-CD1 4.43Å; L109-L130 HydrophobicContact CB-CD2 4.31Å; L109-P135 HydrophobicContact CB-CG 4.27Å; L109-P135 HydrophobicContact CD2-CG 3.7Å; L109-P135 HydrophobicContact CG-CG 3.73Å; L109-P135 WeakPolarHBondContact O-CG 3.4Å; L109-L149 HydrophobicContact CD2-CD2 4.41Å; L109-F154 HydrophobicContact CB-CE1 4.14Å; L109-F154 HydrophobicContact CB-CZ 4.28Å; L109-F154 HydrophobicContact CD2-CE1 4.45Å; L109-F154 HydrophobicContact CD2-CZ 4.08Å
110	S	93.5	Very high	91.4	Very high	60 Å²	60	44.1 Å²	44.1	42%	0.42	25%	0.246	S	C	.	.			trans	-89.6	153.7	-179	66.7	0	0	0	0	112.3	D112 A113 V114	S110-D112 VanDerWaalsContact C-N 3.27Å; S110-D112 PolarHBondContact O-N 2.94Å; S110-A113 WeakPolarHBondContact O-CB 3.44Å; S110-A113 PolarHBondContact O-N 3.05Å; S110-A113 VanDerWaalsContact O-N 3.1Å; S110-A113 WeakPolarHBondContact OG-CB 3.14Å; S110-A113 PolarHBondContact OG-N 2.81Å; S110-V114 PolarHBondContact O-N 2.94Å
111	S	95.3	Very high	91.6	Very high	39 Å²	39	50.2 Å²	50.2	27%	0.273	27%	0.269	S	S	.	.	H	α-helix	trans	-56.1	-40.6	174.2	-73.2	0	0	0	0	112.4	A113 V114 A115 D136 A137	S111-A113 VanDerWaalsContact C-N 3.27Å; S111-A113 PolarHBondContact O-N 3.28Å; S111-V114 WeakPolarHBondContact O-CG2 3.27Å; S111-V114 PolarHBondContact O-N 2.82Å; S111-A115 VanDerWaalsContact O-CB 3.27Å; S111-A115 WeakPolarHBondContact O-CB 3.28Å; S111-A115 PolarHBondContact O-N 2.92Å; S111-D136 PolarHBondContact OG-N 3.03Å; S111-A137 WeakPolarHBondContact O-CB 3.47Å; S111-A137 PolarHBondContact OG-N 3.17Å
112	D	94.4	Very high	92.1	Very high	139 Å²	139	56.1 Å²	56.1	74%	0.743	29%	0.29	S	S	*	.	H	α-helix	trans	-65.6	-29.2	178.6	-64.4	-27.4	0	0	0	112.9	S110 P116	S110-D112 VanDerWaalsContact C-N 3.27Å; S110-D112 PolarHBondContact O-N 2.94Å; D112-P116 WeakPolarHBondContact O-CD 3.28Å
113	A	93.9	Very high	92.7	Very high	16 Å²	16	49.2 Å²	49.2	13%	0.132	26%	0.263	C	S	.	.	H	α-helix	trans	-71.9	-34.7	178.9	0	0	0	0	0	112.4	F85 A87 C90 S110 S111	F85-A113 HydrophobicContact CD1-CB 4.06Å; A87-A113 HydrophobicContact CB-CB 3.93Å; C90-A113 PolarHBondContact SG-O 3.36Å; C90-A113 VanDerWaalsContact SG-O 3.33Å; S110-A113 WeakPolarHBondContact O-CB 3.44Å; S110-A113 PolarHBondContact O-N 3.05Å; S110-A113 VanDerWaalsContact O-N 3.1Å; S110-A113 WeakPolarHBondContact OG-CB 3.14Å; S110-A113 PolarHBondContact OG-N 2.81Å; S111-A113 VanDerWaalsContact C-N 3.27Å; S111-A113 PolarHBondContact O-N 3.28Å
114	V	95.3	Very high	93.3	Very high	1 Å²	1	51 Å²	51	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-98.2	-24.5	-176.8	-60.9	0	0	0	0	113.5	F85 L109 S110 S111 P116 C117 P135 A137 L138	F85-V114 HydrophobicContact CE1-CG1 4.01Å; F85-V114 HydrophobicContact CZ-CG1 4.25Å; L109-V114 HydrophobicContact CD1-CG1 3.59Å; L109-V114 HydrophobicContact CD2-CG1 4.5Å; L109-V114 HydrophobicContact CG-CG1 4.06Å; S110-V114 PolarHBondContact O-N 2.94Å; S111-V114 WeakPolarHBondContact O-CG2 3.27Å; S111-V114 PolarHBondContact O-N 2.82Å; V114-P116 VanDerWaalsContact C-N 3.28Å; V114-P116 VanDerWaalsContact O-N 3.12Å; V114-C117 VanDerWaalsContact O-CB 3.28Å; V114-C117 WeakPolarHBondContact O-CB 3.44Å; V114-C117 PolarHBondContact O-N 2.91Å; V114-P135 HydrophobicContact CG2-CB 4.28Å; V114-A137 HydrophobicContact CG2-CB 4.07Å; V114-L138 HydrophobicContact CB-CD2 4.2Å; V114-L138 HydrophobicContact CG1-CD2 4.32Å; V114-L138 HydrophobicContact CG2-CD2 4.01Å; V114-L138 HydrophobicContact CG2-CG 4.22Å
115	A	95.1	Very high	93.8	Very high	31 Å²	31	47.8 Å²	47.8	26%	0.256	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-33.5	-178.2	0	0	0	0	0	115.5	S111 C117 K118 A137	S111-A115 VanDerWaalsContact O-CB 3.27Å; S111-A115 WeakPolarHBondContact O-CB 3.28Å; S111-A115 PolarHBondContact O-N 2.92Å; A115-C117 VanDerWaalsContact C-N 3.3Å; A115-C117 PolarHBondContact O-N 3.48Å; A115-K118 VanDerWaalsContact O-CE 3.27Å; A115-K118 WeakPolarHBondContact O-CE 3.29Å; A115-K118 PolarHBondContact O-NZ 3.29Å; A115-A137 HydrophobicContact CB-CB 4.05Å
116	P	95.9	Very high	93.8	Very high	67 Å²	67	48 Å²	48	44%	0.435	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-13.5	177.5	-17.7	32.3	0	0	0	114.8	C90 D112 V114 K118	C90-P116 HydrophobicContact CB-CB 3.83Å; C90-P116 HydrophobicContact CB-CG 4.44Å; C90-P116 CarbonylContact O-C 3.55Å; D112-P116 WeakPolarHBondContact O-CD 3.28Å; V114-P116 VanDerWaalsContact C-N 3.28Å; V114-P116 VanDerWaalsContact O-N 3.12Å; P116-K118 PolarHBondContact O-N 3.24Å
117	C	95.3	Very high	93.7	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.007	27%	0.274	C	S	.	.			trans	-72.7	55.6	-175.9	-91.6	0	0	0	0	113.4	C90 V114 A115 A119 L120 L141	C90-C117 WeakPolarHBondContact CA-SG 3.03Å; C90-C117 HydrophobicContact CB-CB 3.84Å; C90-C117 WeakPolarHBondContact CB-SG 3.31Å; C90-C117 WeakPolarHBondContact SG-CB 3.31Å; C90-C117 CovalentContact SG-SG 2.03Å; C90-C117 PolarHBondContact SG-SG 3.35Å; V114-C117 VanDerWaalsContact O-CB 3.28Å; V114-C117 WeakPolarHBondContact O-CB 3.44Å; V114-C117 PolarHBondContact O-N 2.91Å; A115-C117 VanDerWaalsContact C-N 3.3Å; A115-C117 PolarHBondContact O-N 3.48Å; C117-A119 VanDerWaalsContact C-N 3.31Å; C117-A119 PolarHBondContact O-N 3.01Å; C117-L120 HydrophobicContact CB-CB 3.92Å; C117-L120 HydrophobicContact CB-CD2 3.97Å; C117-L120 VanDerWaalsContact O-CB 3.28Å; C117-L120 WeakPolarHBondContact O-CB 3.38Å; C117-L120 PolarHBondContact O-N 2.99Å; C117-L141 HydrophobicContact CB-CD2 4.4Å
118	K	94.7	Very high	93.8	Very high	118 Å²	118	47.9 Å²	47.9	51%	0.513	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-26.9	-169.9	-61.3	-52.2	-173.5	-161.4	0	115.2	A115 P116 P142	A115-K118 VanDerWaalsContact O-CE 3.27Å; A115-K118 WeakPolarHBondContact O-CE 3.29Å; A115-K118 PolarHBondContact O-NZ 3.29Å; P116-K118 PolarHBondContact O-N 3.24Å; K118-P142 WeakPolarHBondContact O-CG 3.27Å
119	A	96.1	Very high	94.1	Very high	28 Å²	28	45.1 Å²	45.1	23%	0.231	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-5.3	179.4	0	0	0	0	0	113.7	V95 C117 R121	V95-A119 CarbonylContact O-C 3.58Å; V95-A119 VanDerWaalsContact O-C 3.29Å; C117-A119 VanDerWaalsContact C-N 3.31Å; C117-A119 PolarHBondContact O-N 3.01Å; A119-R121 PolarHBondContact O-N 2.81Å
120	L	98.1	Very high	93.9	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.241	C	C	.	.			trans	-68.9	126.1	-169.3	-166.3	69.2	0	0	0	111.5	V95 I98 C117 R122 L123 L141 E143 L144	V95-L120 WeakPolarHBondContact O-CA 3.25Å; V95-L120 PolarHBondContact O-N 3.17Å; I98-L120 HydrophobicContact CB-CD1 4.15Å; I98-L120 HydrophobicContact CD1-CD1 3.8Å; I98-L120 HydrophobicContact CG1-CD1 3.71Å; C117-L120 HydrophobicContact CB-CB 3.92Å; C117-L120 HydrophobicContact CB-CD2 3.97Å; C117-L120 VanDerWaalsContact O-CB 3.28Å; C117-L120 WeakPolarHBondContact O-CB 3.38Å; C117-L120 PolarHBondContact O-N 2.99Å; L120-R122 WeakPolarHBondContact CD1-O 3.22Å; L120-L123 HydrophobicContact CD2-CB 3.9Å; L120-L123 HydrophobicContact CD2-CD1 4.26Å; L120-L123 HydrophobicContact CD2-CD2 4.26Å; L120-L123 HydrophobicContact CD2-CG 4.37Å; L120-L141 HydrophobicContact CD2-CD1 4.22Å; L120-E143 CarbonylContact O-C 3.23Å; L120-L144 HydrophobicContact CD2-CD1 4.36Å; L120-L144 HydrophobicContact CG-CD1 4.3Å; L120-L144 WeakPolarHBondContact O-CA 3.38Å; L120-L144 PolarHBondContact O-N 3.03Å
121	R	98.5	Very high	93.9	Very high	128 Å²	128	44.5 Å²	44.5	48%	0.483	24%	0.236	S	C	.	.			trans	-109.1	-32.6	177.8	-63.6	-173.5	164.6	-154.1	-9	112.6	A96 A119 E143 V145 Y146	A96-R121 HydrophobicContact CB-CB 4.5Å; A96-R121 HydrophobicContact CB-CG 4.32Å; A96-R121 CarbonylContact O-C 3.59Å; A96-R121 WeakPolarHBondContact O-CA 3.12Å; A96-R121 WeakPolarHBondContact O-CB 3.4Å; A96-R121 PolarHBondContact O-N 2.91Å; A119-R121 PolarHBondContact O-N 2.81Å; R121-E143 WeakPolarHBondContact CA-O 3.36Å; R121-E143 HydrophobicContact CG-CB 4.01Å; R121-E143 WeakPolarHBondContact CG-O 3.42Å; R121-E143 IonicContact CZ-OE2 3.47Å; R121-E143 IonicContact NE-OE2 3.83Å; R121-E143 IonicContact NH2-OE2 3.86Å; R121-E143 PolarHBondContact NH2-OE2 2.97Å; R121-V145 WeakPolarHBondContact O-CA 3.28Å; R121-V145 PolarHBondContact O-N 3.23Å; R121-Y146 PolarHBondContact O-N 3.19Å
122	R	98.7	Very high	93.7	Very high	130 Å²	130	43.4 Å²	43.4	49%	0.491	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124	-179.3	-59.6	-168.8	170.9	175.9	-2	109.8	A96 S97 I98 L120 Y146	A96-R122 PolarHBondContact O-N 2.84Å; S97-R122 WeakPolarHBondContact CA-O 3.3Å; I98-R122 PolarHBondContact N-O 2.94Å; L120-R122 WeakPolarHBondContact CD1-O 3.22Å; R122-Y146 WeakPolarHBondContact CA-O 3.34Å; R122-Y146 HydrophobicContact CG-CD2 3.67Å; R122-Y146 HydrophobicContact CG-CG 4.18Å
123	L	98.5	Very high	93.8	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	115	170.8	-177.8	58.3	0	0	0	108.7	F85 I98 L120 L125 L138 L144 Y146 L147 K148	F85-L123 HydrophobicContact CE2-CD1 4.25Å; I98-L123 HydrophobicContact CB-CD1 4.03Å; I98-L123 HydrophobicContact CG2-CD1 4.07Å; I98-L123 WeakPolarHBondContact O-CA 3.5Å; L120-L123 HydrophobicContact CD2-CB 3.9Å; L120-L123 HydrophobicContact CD2-CD1 4.26Å; L120-L123 HydrophobicContact CD2-CD2 4.26Å; L120-L123 HydrophobicContact CD2-CG 4.37Å; L123-L125 HydrophobicContact CD1-CD1 4.1Å; L123-L125 HydrophobicContact CD1-CD2 4.05Å; L123-L125 HydrophobicContact CD1-CG 3.84Å; L123-L125 HydrophobicContact CD2-CD1 4.22Å; L123-L125 HydrophobicContact CG-CD1 4.24Å; L123-L125 HydrophobicContact CG-CG 4.09Å; L123-L138 HydrophobicContact CD2-CD2 3.78Å; L123-L144 HydrophobicContact CB-CD1 4.3Å; L123-Y146 PolarHBondContact N-O 2.89Å; L123-L147 HydrophobicContact CB-CD1 4.08Å; L123-L147 HydrophobicContact CD2-CD1 3.98Å; L123-L147 HydrophobicContact CG-CD1 4.24Å; L123-K148 PolarHBondContact O-N 3.24Å
124	D	97.9	Very high	94	Very high	42 Å²	42	40.8 Å²	40.8	23%	0.225	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	111.4	173	-161.2	-28	0	0	0	109.8	I98 D99 L100 S126 K148	I98-D124 PolarHBondContact O-N 2.96Å; D99-D124 HydrophobicContact CB-CB 4.31Å; L100-D124 PolarHBondContact N-O 2.98Å; D124-S126 VanDerWaalsContact OD1-CB 3.23Å; D124-S126 WeakPolarHBondContact OD1-CB 3.24Å; D124-S126 PolarHBondContact OD1-N 2.75Å; D124-S126 PolarHBondContact OD1-OG 2.93Å; D124-K148 HydrophobicContact CB-CB 4.29Å
125	L	96.9	Very high	94	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.221	C	C	.	.			trans	-122.1	22.1	173.8	-56.6	175.5	0	0	0	110.4	F85 L100 L109 L123 N128 L130 K148 L149 N152	F85-L125 HydrophobicContact CD2-CD1 4Å; F85-L125 HydrophobicContact CD2-CD2 4.01Å; F85-L125 HydrophobicContact CE2-CD1 4.15Å; F85-L125 HydrophobicContact CE2-CD2 4.06Å; L100-L125 HydrophobicContact CB-CD2 3.88Å; L100-L125 HydrophobicContact CD1-CD2 3.9Å; L100-L125 HydrophobicContact CG-CD2 4.18Å; L109-L125 HydrophobicContact CD1-CD1 3.96Å; L109-L125 HydrophobicContact CD2-CD1 3.66Å; L109-L125 HydrophobicContact CG-CD1 4.43Å; L123-L125 HydrophobicContact CD1-CD1 4.1Å; L123-L125 HydrophobicContact CD1-CD2 4.05Å; L123-L125 HydrophobicContact CD1-CG 3.84Å; L123-L125 HydrophobicContact CD2-CD1 4.22Å; L123-L125 HydrophobicContact CG-CD1 4.24Å; L123-L125 HydrophobicContact CG-CG 4.09Å; L125-N128 PolarHBondContact O-ND2 2.92Å; L125-N128 VanDerWaalsContact O-ND2 3.13Å; L125-L130 HydrophobicContact CB-CD1 3.87Å; L125-L130 HydrophobicContact CD1-CD1 3.99Å; L125-K148 PolarHBondContact N-O 3.05Å; L125-L149 HydrophobicContact CB-CD2 3.91Å; L125-L149 HydrophobicContact CD1-CD2 3.99Å; L125-L149 HydrophobicContact CG-CD2 4.24Å; L125-N152 PolarHBondContact O-ND2 3.34Å
126	S	87.2	Confident	94	Very high	6 Å²	6	43.8 Å²	43.8	4%	0.042	23%	0.232	C	C	.	.			trans	-59.6	155	-179.6	57.8	0	0	0	0	112.2	S101 Y102 D124 N128 D150	S101-S126 CarbonylContact C-O 3.43Å; S101-S126 WeakPolarHBondContact CA-O 3.27Å; S101-S126 VanDerWaalsContact CB-OG 3.23Å; S101-S126 WeakPolarHBondContact CB-OG 3.33Å; Y102-S126 PolarHBondContact N-O 2.73Å; D124-S126 VanDerWaalsContact OD1-CB 3.23Å; D124-S126 WeakPolarHBondContact OD1-CB 3.24Å; D124-S126 PolarHBondContact OD1-N 2.75Å; D124-S126 PolarHBondContact OD1-OG 2.93Å; S126-N128 PolarHBondContact O-N 2.96Å; S126-N128 PolarHBondContact O-ND2 3.45Å; S126-D150 CarbonylContact C-O 3.15Å; S126-D150 WeakPolarHBondContact CA-O 3.39Å; S126-D150 WeakPolarHBondContact CB-OD2 3.47Å
127	M	86.9	Confident	94	Very high	81 Å²	81	41.4 Å²	41.4	40%	0.399	22%	0.218	S	C	.	.	S	Bend	trans	53.5	58.9	176.3	-66.1	-82	-176	0	0	112.3	Y102 N103 D150 S151	Y102-M127 WeakPolarHBondContact CA-O 3.3Å; Y102-M127 HydrophobicContact CD1-CB 3.97Å; Y102-M127 HydrophobicContact CD1-CG 3.97Å; Y102-M127 HydrophobicContact CE1-CB 4.32Å; Y102-M127 HydrophobicContact CE1-CG 3.81Å; Y102-M127 HydrophobicContact CG-CB 4.19Å; Y102-M127 PolarHBondContact N-O 3.23Å; N103-M127 PolarHBondContact N-O 3.31Å; M127-D150 PolarHBondContact N-O 2.78Å; M127-S151 WeakPolarHBondContact CA-O 3.38Å; M127-S151 WeakPolarHBondContact CE-OG 3.46Å; M127-S151 WeakPolarHBondContact SD-CB 3.44Å
128	N	82.5	Confident	94.2	Very high	10 Å²	10	41.3 Å²	41.3	5%	0.053	22%	0.218	C	C	.	.	S	Bend	trans	-132.7	-173.5	178.3	-87.8	-77	0	0	0	111.1	L100 N103 Y104 I105 L125 S126 L130 S151 N152	L100-N128 PolarHBondContact O-ND2 2.8Å; N103-N128 VanDerWaalsContact CB-OD1 3.25Å; N103-N128 WeakPolarHBondContact CB-OD1 3.42Å; N103-N128 WeakPolarHBondContact O-CA 3.43Å; N103-N128 PolarHBondContact O-OD1 3.11Å; Y104-N128 PolarHBondContact N-OD1 3.03Å; I105-N128 VanDerWaalsContact CB-OD1 3.26Å; I105-N128 WeakPolarHBondContact CB-OD1 3.23Å; I105-N128 PolarHBondContact N-OD1 3.38Å; L125-N128 PolarHBondContact O-ND2 2.92Å; L125-N128 VanDerWaalsContact O-ND2 3.13Å; S126-N128 PolarHBondContact O-N 2.96Å; S126-N128 PolarHBondContact O-ND2 3.45Å; N128-L130 HydrophobicContact CB-CD1 4.37Å; N128-L130 HydrophobicContact CB-CG 4.31Å; N128-S151 PolarHBondContact N-O 2.94Å; N128-N152 WeakPolarHBondContact CA-OD1 3.4Å; N128-N152 WeakPolarHBondContact CB-OD1 3.43Å; N128-N152 PolarHBondContact O-OD1 3.15Å
129	A	85.8	Confident	94.2	Very high	39 Å²	39	36.3 Å²	36.3	32%	0.322	20%	0.198	S	C	.	.			trans	-106.1	25.7	-179.8	0	0	0	0	0	113	I105	I105-A129 CarbonylContact O-C 3.53Å; I105-A129 WeakPolarHBondContact O-CA 3.05Å; I105-A129 PolarHBondContact O-N 3.21Å
130	L	90.8	Very high	94.2	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	21%	0.214	C	C	.	.			trans	-72.1	135.9	-175.1	-61.9	163.6	0	0	0	111.4	I105 P107 L109 L125 N128 N152 N153 F154	I105-L130 HydrophobicContact CG2-CD2 4.42Å; I105-L130 PolarHBondContact O-N 2.95Å; P107-L130 CarbonylContact O-C 3.29Å; P107-L130 VanDerWaalsContact O-CA 3.29Å; P107-L130 WeakPolarHBondContact O-CA 3.34Å; L109-L130 HydrophobicContact CB-CD2 4.31Å; L125-L130 HydrophobicContact CB-CD1 3.87Å; L125-L130 HydrophobicContact CD1-CD1 3.99Å; N128-L130 HydrophobicContact CB-CD1 4.37Å; N128-L130 HydrophobicContact CB-CG 4.31Å; L130-N152 HydrophobicContact CB-CB 4.38Å; L130-N152 VanDerWaalsContact CB-OD1 3.28Å; L130-N152 WeakPolarHBondContact CB-OD1 3.27Å; L130-N152 PolarHBondContact N-OD1 2.96Å; L130-N153 CarbonylContact O-C 3.59Å; L130-N153 WeakPolarHBondContact O-CA 3.07Å; L130-N153 VanDerWaalsContact O-CB 3.24Å; L130-N153 WeakPolarHBondContact O-CB 3.37Å; L130-N153 PolarHBondContact O-N 3.26Å; L130-F154 HydrophobicContact CB-CE1 4.01Å; L130-F154 HydrophobicContact CB-CE2 3.9Å; L130-F154 HydrophobicContact CB-CZ 3.54Å; L130-F154 HydrophobicContact CD1-CE2 4.12Å; L130-F154 HydrophobicContact CD1-CZ 3.73Å; L130-F154 HydrophobicContact CG-CZ 4.21Å; L130-F154 PolarHBondContact O-N 3.2Å
131	V	93.3	Very high	94.2	Very high	54 Å²	54	38.4 Å²	38.4	33%	0.327	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	171.6	-178.3	-52.1	0	0	0	0	111	P107 N108 N153	P107-V131 HydrophobicContact CB-CG2 3.78Å; P107-V131 WeakPolarHBondContact O-CG2 3.35Å; P107-V131 PolarHBondContact O-N 2.95Å; N108-V131 VanDerWaalsContact OD1-CG2 3.25Å; N108-V131 WeakPolarHBondContact OD1-CG2 3.2Å; V131-N153 HydrophobicContact CB-CB 4.42Å; V131-N153 HydrophobicContact CG1-CB 3.73Å
132	G	92	Very high	94	Very high	16 Å²	16	35.3 Å²	35.3	17%	0.165	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	87.6	-172.5	177.1	0	0	0	0	0	113.2	F154 S155	G132-F154 CarbonylContact O-C 3.58Å; G132-F154 VanDerWaalsContact O-CA 3.27Å; G132-F154 WeakPolarHBondContact O-CA 3.42Å; G132-S155 PolarHBondContact O-N 3.5Å
133	P	96.1	Very high	94	Very high	97 Å²	97	31.4 Å²	31.4	63%	0.63	20%	0.198	S	C	*	.	S	Bend	trans	-71	153.9	-178.6	29.9	-34.9	0	0	0	112.8	S155	P133-S155 VanDerWaalsContact CA-O 3.29Å; P133-S155 WeakPolarHBondContact CA-O 3.17Å
134	L	97.7	Very high	94	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.016	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-63.6	134.3	170	-69.8	168.8	0	0	0	109.9	D136 L149 F154 I158 P159 F162 L173 L178	L134-D136 PolarHBondContact O-N 2.95Å; L134-L149 HydrophobicContact CD2-CD1 3.63Å; L134-F154 HydrophobicContact CD2-CB 4.05Å; L134-F154 HydrophobicContact CD2-CD1 4.02Å; L134-F154 HydrophobicContact CD2-CD2 4.1Å; L134-F154 HydrophobicContact CD2-CE1 4.49Å; L134-F154 HydrophobicContact CD2-CG 3.8Å; L134-F154 HydrophobicContact CG-CB 4.38Å; L134-I158 HydrophobicContact CD1-CG1 4.17Å; L134-P159 HydrophobicContact CB-CG 4.1Å; L134-F162 HydrophobicContact CB-CZ 4.03Å; L134-F162 HydrophobicContact CD1-CE1 4.14Å; L134-F162 HydrophobicContact CD1-CZ 4.43Å; L134-L173 HydrophobicContact CD1-CD1 3.87Å; L134-L173 HydrophobicContact CD1-CD2 4.33Å; L134-L173 HydrophobicContact CD2-CD2 4.1Å; L134-L178 HydrophobicContact CD1-CD1 4.12Å; L134-L178 HydrophobicContact CD1-CD2 3.67Å; L134-L178 HydrophobicContact CG-CD2 3.95Å
135	P	96.5	Very high	94	Very high	4 Å²	4	30.4 Å²	30.4	3%	0.026	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-75.8	117.8	-176.8	9.1	-5.8	0	0	0	113.4	L109 V114 A137 L138	L109-P135 HydrophobicContact CB-CG 4.27Å; L109-P135 HydrophobicContact CD2-CG 3.7Å; L109-P135 HydrophobicContact CG-CG 3.73Å; L109-P135 WeakPolarHBondContact O-CG 3.4Å; V114-P135 HydrophobicContact CG2-CB 4.28Å; P135-A137 PolarHBondContact O-N 2.74Å; P135-A137 VanDerWaalsContact O-N 3.11Å; P135-L138 HydrophobicContact CB-CD1 4.45Å; P135-L138 HydrophobicContact CB-CG 4.38Å; P135-L138 HydrophobicContact CG-CD1 3.75Å; P135-L138 HydrophobicContact CG-CG 4.07Å; P135-L138 WeakPolarHBondContact O-CB 3.48Å; P135-L138 WeakPolarHBondContact O-CG 3.4Å; P135-L138 PolarHBondContact O-N 3.44Å; P135-L138 VanDerWaalsContact O-N 3.08Å
136	D	95.2	Very high	94.1	Very high	90 Å²	90	33.7 Å²	33.7	48%	0.481	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-52.4	-33.7	176.7	-66.3	-12.7	0	0	0	114	S111 L134 L138 A139 P159	S111-D136 PolarHBondContact OG-N 3.03Å; L134-D136 PolarHBondContact O-N 2.95Å; D136-L138 PolarHBondContact O-N 2.75Å; D136-L138 VanDerWaalsContact O-N 3.15Å; D136-A139 PolarHBondContact O-N 2.97Å; D136-A139 VanDerWaalsContact O-N 3.16Å; D136-P159 WeakPolarHBondContact OD1-CB 3.39Å; D136-P159 WeakPolarHBondContact OD1-CG 3.29Å
137	A	96.3	Very high	94.7	Very high	17 Å²	17	33.4 Å²	33.4	14%	0.14	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-64.2	-18.2	-177.8	0	0	0	0	0	113.5	S111 V114 A115 P135 A139 A140	S111-A137 WeakPolarHBondContact O-CB 3.47Å; S111-A137 PolarHBondContact OG-N 3.17Å; V114-A137 HydrophobicContact CG2-CB 4.07Å; A115-A137 HydrophobicContact CB-CB 4.05Å; P135-A137 PolarHBondContact O-N 2.74Å; P135-A137 VanDerWaalsContact O-N 3.11Å; A137-A139 VanDerWaalsContact C-N 3.26Å; A137-A139 PolarHBondContact O-N 2.8Å; A137-A140 WeakPolarHBondContact O-CB 3.4Å; A137-A140 PolarHBondContact O-N 3.32Å
138	L	97.8	Very high	95.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-57.8	-41.8	173.8	-69.8	170.9	0	0	0	111	V114 L123 P135 D136 A140 L141 L147 L149 F162 F165	V114-L138 HydrophobicContact CB-CD2 4.2Å; V114-L138 HydrophobicContact CG1-CD2 4.32Å; V114-L138 HydrophobicContact CG2-CD2 4.01Å; V114-L138 HydrophobicContact CG2-CG 4.22Å; L123-L138 HydrophobicContact CD2-CD2 3.78Å; P135-L138 HydrophobicContact CB-CD1 4.45Å; P135-L138 HydrophobicContact CB-CG 4.38Å; P135-L138 HydrophobicContact CG-CD1 3.75Å; P135-L138 HydrophobicContact CG-CG 4.07Å; P135-L138 WeakPolarHBondContact O-CB 3.48Å; P135-L138 WeakPolarHBondContact O-CG 3.4Å; P135-L138 PolarHBondContact O-N 3.44Å; P135-L138 VanDerWaalsContact O-N 3.08Å; D136-L138 PolarHBondContact O-N 2.75Å; D136-L138 VanDerWaalsContact O-N 3.15Å; L138-A140 PolarHBondContact O-N 3.03Å; L138-L141 HydrophobicContact CD2-CD1 4.22Å; L138-L141 WeakPolarHBondContact O-CB 3.27Å; L138-L141 WeakPolarHBondContact O-CG 3.27Å; L138-L141 PolarHBondContact O-N 3.06Å; L138-L141 VanDerWaalsContact O-N 3.12Å; L138-L147 HydrophobicContact CB-CD2 4.49Å; L138-L147 HydrophobicContact CD1-CD1 4.31Å; L138-L147 HydrophobicContact CD1-CD2 4.04Å; L138-L147 HydrophobicContact CD2-CD1 4.41Å; L138-L149 HydrophobicContact CD1-CD1 4.04Å; L138-F162 HydrophobicContact CB-CE2 4.24Å; L138-F162 HydrophobicContact CB-CZ 4.36Å; L138-F162 HydrophobicContact CD1-CZ 4.05Å; L138-F165 HydrophobicContact CB-CZ 4.27Å; L138-F165 VanDerWaalsContact O-CE1 3.27Å; L138-F165 WeakPolarHBondContact O-CE1 3.39Å
139	A	96.5	Very high	95.9	Very high	12 Å²	12	31.4 Å²	31.4	10%	0.099	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-66.8	-18.8	177.7	0	0	0	0	0	114.2	D136 A137 S161 F162 F165	D136-A139 PolarHBondContact O-N 2.97Å; D136-A139 VanDerWaalsContact O-N 3.16Å; A137-A139 VanDerWaalsContact C-N 3.26Å; A137-A139 PolarHBondContact O-N 2.8Å; A139-S161 WeakPolarHBondContact CB-O 3.37Å; A139-F162 HydrophobicContact CB-CD2 4.2Å; A139-F165 HydrophobicContact CB-CD1 4.34Å; A139-F165 HydrophobicContact CB-CE1 4.11Å; A139-F165 HydrophobicContact CB-CE2 4.3Å; A139-F165 HydrophobicContact CB-CZ 4.05Å
140	A	96.1	Very high	95.8	Very high	68 Å²	68	30.8 Å²	30.8	56%	0.562	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-87.4	-2.5	176.3	0	0	0	0	0	113.4	A137 L138 P142	A137-A140 WeakPolarHBondContact O-CB 3.4Å; A137-A140 PolarHBondContact O-N 3.32Å; L138-A140 PolarHBondContact O-N 3.03Å; A140-P142 WeakPolarHBondContact O-CD 3.4Å
141	L	96.6	Very high	95.6	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	19%	0.194	C	C	.	.			trans	-75.8	115.4	176.2	-60.4	-175	0	0	0	109.9	C117 L120 L138 E143 L144	C117-L141 HydrophobicContact CB-CD2 4.4Å; L120-L141 HydrophobicContact CD2-CD1 4.22Å; L138-L141 HydrophobicContact CD2-CD1 4.22Å; L138-L141 WeakPolarHBondContact O-CB 3.27Å; L138-L141 WeakPolarHBondContact O-CG 3.27Å; L138-L141 PolarHBondContact O-N 3.06Å; L138-L141 VanDerWaalsContact O-N 3.12Å; L141-E143 VanDerWaalsContact C-N 3.31Å; L141-E143 PolarHBondContact O-N 2.78Å; L141-L144 HydrophobicContact CB-CB 3.94Å; L141-L144 HydrophobicContact CD1-CD1 4.4Å; L141-L144 HydrophobicContact CD1-CD2 4.39Å
142	P	95.8	Very high	95.1	Very high	62 Å²	62	29.9 Å²	29.9	40%	0.403	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-22.9	-167.8	28.6	-35.2	0	0	0	113.8	K118 A140 K167	K118-P142 WeakPolarHBondContact O-CG 3.27Å; A140-P142 WeakPolarHBondContact O-CD 3.4Å; P142-K167 WeakPolarHBondContact O-CD 3.45Å
143	E	97.6	Very high	94.9	Very high	48 Å²	48	31.2 Å²	31.2	22%	0.224	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-1.2	-175.8	-64.3	-58.8	123.2	0	0	113.7	L120 R121 L141 V145 K167	L120-E143 CarbonylContact O-C 3.23Å; R121-E143 WeakPolarHBondContact CA-O 3.36Å; R121-E143 HydrophobicContact CG-CB 4.01Å; R121-E143 WeakPolarHBondContact CG-O 3.42Å; R121-E143 IonicContact CZ-OE2 3.47Å; R121-E143 IonicContact NE-OE2 3.83Å; R121-E143 IonicContact NH2-OE2 3.86Å; R121-E143 PolarHBondContact NH2-OE2 2.97Å; L141-E143 VanDerWaalsContact C-N 3.31Å; L141-E143 PolarHBondContact O-N 2.78Å; E143-V145 WeakPolarHBondContact O-CG2 3.28Å; E143-V145 PolarHBondContact O-N 3.04Å; E143-K167 IonicContact OE1-NZ 2.66Å; E143-K167 PolarHBondContact OE1-NZ 3.07Å; E143-K167 IonicContact OE2-NZ 2.9Å; E143-K167 PolarHBondContact OE2-NZ 3.12Å
144	L	98.5	Very high	94.7	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	15%	0.154	C	C	.	.			trans	-68.3	125.6	-171.5	-164.8	72.3	0	0	0	112	L120 L123 L141 L147 F165 K167 L168	L120-L144 HydrophobicContact CD2-CD1 4.36Å; L120-L144 HydrophobicContact CG-CD1 4.3Å; L120-L144 WeakPolarHBondContact O-CA 3.38Å; L120-L144 PolarHBondContact O-N 3.03Å; L123-L144 HydrophobicContact CB-CD1 4.3Å; L141-L144 HydrophobicContact CB-CB 3.94Å; L141-L144 HydrophobicContact CD1-CD1 4.4Å; L141-L144 HydrophobicContact CD1-CD2 4.39Å; L144-L147 HydrophobicContact CD2-CB 4.2Å; L144-L147 HydrophobicContact CD2-CD1 4.48Å; L144-L147 HydrophobicContact CD2-CD2 4.25Å; L144-F165 HydrophobicContact CD2-CD1 4.5Å; L144-F165 HydrophobicContact CD2-CE1 3.7Å; L144-F165 HydrophobicContact CD2-CZ 4.42Å; L144-K167 CarbonylContact O-C 3.51Å; L144-K167 VanDerWaalsContact O-C 3.23Å; L144-L168 HydrophobicContact CD2-CD1 4.11Å; L144-L168 HydrophobicContact CG-CD1 4.07Å; L144-L168 WeakPolarHBondContact O-CA 3.36Å; L144-L168 PolarHBondContact O-N 3.02Å
145	V	98.7	Very high	94.5	Very high	23 Å²	23	28.4 Å²	28.4	14%	0.139	17%	0.167	C	C	.	.			trans	-118.3	-39.9	-177.5	-175.4	0	0	0	0	111.9	R121 E143 K167 L168 E169 S170	R121-V145 WeakPolarHBondContact O-CA 3.28Å; R121-V145 PolarHBondContact O-N 3.23Å; E143-V145 WeakPolarHBondContact O-CG2 3.28Å; E143-V145 PolarHBondContact O-N 3.04Å; V145-K167 HydrophobicContact CG2-CB 4.38Å; V145-L168 WeakPolarHBondContact O-CD1 3.13Å; V145-E169 HydrophobicContact CG1-CB 3.81Å; V145-E169 HydrophobicContact CG1-CG 3.73Å; V145-E169 PolarHBondContact O-N 3.09Å; V145-S170 PolarHBondContact O-N 3.27Å
146	Y	98.7	Very high	94.4	Very high	70 Å²	70	29.7 Å²	29.7	28%	0.275	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	124.9	-179.4	-59.9	-96.1	0	0	0	110.3	R121 R122 L123	R121-Y146 PolarHBondContact O-N 3.19Å; R122-Y146 WeakPolarHBondContact CA-O 3.34Å; R122-Y146 HydrophobicContact CG-CD2 3.67Å; R122-Y146 HydrophobicContact CG-CG 4.18Å; L123-Y146 PolarHBondContact N-O 2.89Å
147	L	98.7	Very high	94.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	109.5	177	-179.2	59.5	0	0	0	109.7	L123 L138 L144 L149 F162 F165 L168 S170 L171 S172	L123-L147 HydrophobicContact CB-CD1 4.08Å; L123-L147 HydrophobicContact CD2-CD1 3.98Å; L123-L147 HydrophobicContact CG-CD1 4.24Å; L138-L147 HydrophobicContact CB-CD2 4.49Å; L138-L147 HydrophobicContact CD1-CD1 4.31Å; L138-L147 HydrophobicContact CD1-CD2 4.04Å; L138-L147 HydrophobicContact CD2-CD1 4.41Å; L144-L147 HydrophobicContact CD2-CB 4.2Å; L144-L147 HydrophobicContact CD2-CD1 4.48Å; L144-L147 HydrophobicContact CD2-CD2 4.25Å; L147-L149 HydrophobicContact CD1-CD1 4Å; L147-L149 HydrophobicContact CD1-CD2 3.97Å; L147-L149 HydrophobicContact CD1-CG 3.8Å; L147-L149 HydrophobicContact CD2-CD1 4.32Å; L147-L149 HydrophobicContact CG-CD1 4.19Å; L147-L149 HydrophobicContact CG-CG 4.1Å; L147-F162 HydrophobicContact CD2-CE1 4.4Å; L147-F165 HydrophobicContact CD2-CZ 4.05Å; L147-L168 HydrophobicContact CB-CD1 3.9Å; L147-S170 PolarHBondContact N-O 3.17Å; L147-L171 HydrophobicContact CB-CD1 4.23Å; L147-L171 HydrophobicContact CD2-CD1 3.84Å; L147-L171 HydrophobicContact CG-CD1 4.12Å; L147-S172 PolarHBondContact O-N 2.97Å
148	K	97.3	Very high	94.5	Very high	48 Å²	48	29.3 Å²	29.3	21%	0.209	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	111.3	177.2	-57.5	-63	-169.5	-176.6	0	109.1	L123 D124 L125 S170 E194	L123-K148 PolarHBondContact O-N 3.24Å; D124-K148 HydrophobicContact CB-CB 4.29Å; L125-K148 PolarHBondContact N-O 3.05Å; K148-S170 WeakPolarHBondContact CE-OG 3.18Å; K148-S170 PolarHBondContact NZ-OG 3.1Å; K148-E194 IonicContact NZ-OE2 3.23Å; K148-E194 PolarHBondContact NZ-OE2 3.18Å
149	L	97.1	Very high	94.5	Very high	0 Å²	0	30 Å²	30	0%	0	19%	0.186	C	C	.	.			trans	-126.5	18.6	179	-57.2	177.6	0	0	0	111	L109 L125 L134 L138 L147 N152 F154 S172 L173 N176	L109-L149 HydrophobicContact CD2-CD2 4.41Å; L125-L149 HydrophobicContact CB-CD2 3.91Å; L125-L149 HydrophobicContact CD1-CD2 3.99Å; L125-L149 HydrophobicContact CG-CD2 4.24Å; L134-L149 HydrophobicContact CD2-CD1 3.63Å; L138-L149 HydrophobicContact CD1-CD1 4.04Å; L147-L149 HydrophobicContact CD1-CD1 4Å; L147-L149 HydrophobicContact CD1-CD2 3.97Å; L147-L149 HydrophobicContact CD1-CG 3.8Å; L147-L149 HydrophobicContact CD2-CD1 4.32Å; L147-L149 HydrophobicContact CG-CD1 4.19Å; L147-L149 HydrophobicContact CG-CG 4.1Å; L149-N152 PolarHBondContact O-ND2 2.62Å; L149-F154 HydrophobicContact CB-CD2 4.27Å; L149-F154 HydrophobicContact CB-CE2 3.87Å; L149-F154 HydrophobicContact CD1-CE2 4.38Å; L149-F154 HydrophobicContact CD2-CE2 4.33Å; L149-F154 HydrophobicContact CD2-CZ 4.5Å; L149-F154 HydrophobicContact CG-CE2 4.43Å; L149-S172 PolarHBondContact N-O 3.2Å; L149-L173 HydrophobicContact CB-CD2 3.88Å; L149-L173 HydrophobicContact CD1-CD2 4.02Å; L149-L173 HydrophobicContact CG-CD2 4.33Å; L149-N176 PolarHBondContact O-ND2 3.45Å
150	D	84.9	Confident	94.6	Very high	26 Å²	26	36.7 Å²	36.7	14%	0.139	22%	0.215	C	C	.	.			trans	-66.1	159.8	-177.9	50.2	-89.7	0	0	0	113.2	S126 M127 N152 S172 V174	S126-D150 CarbonylContact C-O 3.15Å; S126-D150 WeakPolarHBondContact CA-O 3.39Å; S126-D150 WeakPolarHBondContact CB-OD2 3.47Å; M127-D150 PolarHBondContact N-O 2.78Å; D150-N152 PolarHBondContact O-N 3.33Å; D150-N152 PolarHBondContact O-ND2 3.14Å; D150-S172 WeakPolarHBondContact CB-OG 3.35Å; D150-S172 WeakPolarHBondContact OD1-CB 3.47Å; D150-S172 PolarHBondContact OD1-OG 3.08Å; D150-V174 CarbonylContact C-O 3.11Å; D150-V174 WeakPolarHBondContact CA-O 3.46Å; D150-V174 HydrophobicContact CB-CB 3.85Å; D150-V174 HydrophobicContact CB-CG2 4.4Å; D150-V174 WeakPolarHBondContact CB-O 3.47Å
151	S	85.9	Confident	94.6	Very high	30 Å²	30	34.6 Å²	34.6	21%	0.21	20%	0.196	C	C	.	.	S	Bend	trans	54.4	49.8	176.9	-51.1	0	0	0	0	112.8	M127 N128 V174 Y175	M127-S151 WeakPolarHBondContact CA-O 3.38Å; M127-S151 WeakPolarHBondContact CE-OG 3.46Å; M127-S151 WeakPolarHBondContact SD-CB 3.44Å; N128-S151 PolarHBondContact N-O 2.94Å; S151-V174 PolarHBondContact N-O 3.27Å; S151-Y175 WeakPolarHBondContact CA-O 3.47Å; S151-Y175 PolarHBondContact N-O 2.92Å
152	N	83.4	Confident	94.7	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.032	19%	0.194	C	C	.	.	S	Bend	trans	-125.4	-164.6	174.4	-85.4	-84.6	0	0	0	109.3	L125 N128 L130 L149 D150 F154 Y175 N176	L125-N152 PolarHBondContact O-ND2 3.34Å; N128-N152 WeakPolarHBondContact CA-OD1 3.4Å; N128-N152 WeakPolarHBondContact CB-OD1 3.43Å; N128-N152 PolarHBondContact O-OD1 3.15Å; L130-N152 HydrophobicContact CB-CB 4.38Å; L130-N152 VanDerWaalsContact CB-OD1 3.28Å; L130-N152 WeakPolarHBondContact CB-OD1 3.27Å; L130-N152 PolarHBondContact N-OD1 2.96Å; L149-N152 PolarHBondContact O-ND2 2.62Å; D150-N152 PolarHBondContact O-N 3.33Å; D150-N152 PolarHBondContact O-ND2 3.14Å; N152-F154 HydrophobicContact CB-CD2 3.65Å; N152-F154 HydrophobicContact CB-CE2 3.78Å; N152-Y175 PolarHBondContact N-O 3.3Å; N152-Y175 VanDerWaalsContact O-O 3.1Å; N152-N176 WeakPolarHBondContact CA-OD1 3.45Å; N152-N176 WeakPolarHBondContact CB-OD1 3.15Å; N152-N176 PolarHBondContact O-OD1 3.32Å
153	N	86.6	Confident	94.7	Very high	44 Å²	44	32.2 Å²	32.2	24%	0.235	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	28.7	177.7	-73.2	-48.7	0	0	0	112.1	L130 V131 N176 K967	L130-N153 CarbonylContact O-C 3.59Å; L130-N153 WeakPolarHBondContact O-CA 3.07Å; L130-N153 VanDerWaalsContact O-CB 3.24Å; L130-N153 WeakPolarHBondContact O-CB 3.37Å; L130-N153 PolarHBondContact O-N 3.26Å; V131-N153 HydrophobicContact CB-CB 4.42Å; V131-N153 HydrophobicContact CG1-CB 3.73Å; N153-N176 PolarHBondContact N-OD1 3.41Å; N153-K967 PolarHBondContact OD1-NZ 3.46Å
154	F	93	Very high	94.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	137.8	175.2	-69.4	-71.5	0	0	0	110.5	L109 L130 G132 L134 L149 N152 N176 L177 L178	L109-F154 HydrophobicContact CB-CE1 4.14Å; L109-F154 HydrophobicContact CB-CZ 4.28Å; L109-F154 HydrophobicContact CD2-CE1 4.45Å; L109-F154 HydrophobicContact CD2-CZ 4.08Å; L130-F154 HydrophobicContact CB-CE1 4.01Å; L130-F154 HydrophobicContact CB-CE2 3.9Å; L130-F154 HydrophobicContact CB-CZ 3.54Å; L130-F154 HydrophobicContact CD1-CE2 4.12Å; L130-F154 HydrophobicContact CD1-CZ 3.73Å; L130-F154 HydrophobicContact CG-CZ 4.21Å; L130-F154 PolarHBondContact O-N 3.2Å; G132-F154 CarbonylContact O-C 3.58Å; G132-F154 VanDerWaalsContact O-CA 3.27Å; G132-F154 WeakPolarHBondContact O-CA 3.42Å; L134-F154 HydrophobicContact CD2-CB 4.05Å; L134-F154 HydrophobicContact CD2-CD1 4.02Å; L134-F154 HydrophobicContact CD2-CD2 4.1Å; L134-F154 HydrophobicContact CD2-CE1 4.49Å; L134-F154 HydrophobicContact CD2-CG 3.8Å; L134-F154 HydrophobicContact CG-CB 4.38Å; L149-F154 HydrophobicContact CB-CD2 4.27Å; L149-F154 HydrophobicContact CB-CE2 3.87Å; L149-F154 HydrophobicContact CD1-CE2 4.38Å; L149-F154 HydrophobicContact CD2-CE2 4.33Å; L149-F154 HydrophobicContact CD2-CZ 4.5Å; L149-F154 HydrophobicContact CG-CE2 4.43Å; N152-F154 HydrophobicContact CB-CD2 3.65Å; N152-F154 HydrophobicContact CB-CE2 3.78Å; F154-N176 HydrophobicContact CB-CB 4.36Å; F154-N176 WeakPolarHBondContact CB-OD1 3.21Å; F154-N176 VanDerWaalsContact CD2-OD1 3.31Å; F154-N176 WeakPolarHBondContact CD2-OD1 3.14Å; F154-N176 PolarHBondContact N-OD1 3.18Å; F154-L177 CarbonylContact O-C 3.22Å; F154-L177 WeakPolarHBondContact O-CA 3.32Å; F154-L177 VanDerWaalsContact O-CB 3.23Å; F154-L177 WeakPolarHBondContact O-CB 3.44Å; F154-L177 PolarHBondContact O-N 3.11Å; F154-L178 HydrophobicContact CB-CD2 4.08Å; F154-L178 PolarHBondContact O-N 2.78Å
155	S	93.8	Very high	94.6	Very high	42 Å²	42	38.8 Å²	38.8	29%	0.294	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	163.7	-170	60.9	0	0	0	0	112.1	G132 P133 L177	G132-S155 PolarHBondContact O-N 3.5Å; P133-S155 VanDerWaalsContact CA-O 3.29Å; P133-S155 WeakPolarHBondContact CA-O 3.17Å; S155-L177 WeakPolarHBondContact CA-O 3.41Å
156	G	93.3	Very high	94.4	Very high	31 Å²	31	45.3 Å²	45.3	32%	0.32	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	83	-177.2	-174.9	0	0	0	0	0	112.7	L178 G179	G156-L178 WeakPolarHBondContact O-CA 3.42Å; G156-G179 PolarHBondContact O-N 2.75Å
157	P	96.9	Very high	94.4	Very high	88 Å²	88	46 Å²	46	57%	0.571	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	155.8	-176.8	31	-35.2	0	0	0	112.3	P159 G179	P157-P159 WeakPolarHBondContact O-CD 3.48Å; P157-G179 WeakPolarHBondContact CA-O 3.14Å
158	I	98.2	Very high	94.4	Very high	10 Å²	10	46 Å²	46	5%	0.051	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-64.8	129.2	164.4	-62.3	174.1	0	0	0	107.8	L134 F162 L173 L178 P183 F185 L197 F202	L134-I158 HydrophobicContact CD1-CG1 4.17Å; I158-F162 HydrophobicContact CG2-CB 4.19Å; I158-F162 HydrophobicContact CG2-CD1 3.86Å; I158-F162 HydrophobicContact CG2-CG 4.19Å; I158-L173 HydrophobicContact CD1-CD1 3.88Å; I158-L173 HydrophobicContact CG1-CD1 4.14Å; I158-L178 HydrophobicContact CD1-CD1 4.34Å; I158-L178 HydrophobicContact CG1-CD1 4.06Å; I158-P183 HydrophobicContact CB-CG 4.03Å; I158-P183 HydrophobicContact CD1-CG 3.97Å; I158-P183 HydrophobicContact CG2-CG 4.15Å; I158-F185 HydrophobicContact CB-CZ 4.44Å; I158-F185 HydrophobicContact CG2-CE2 4.12Å; I158-F185 HydrophobicContact CG2-CZ 4.1Å; I158-F185 WeakPolarHBondContact O-CZ 3.25Å; I158-L197 HydrophobicContact CD1-CD1 4.21Å; I158-L197 HydrophobicContact CD1-CD2 3.97Å; I158-F202 HydrophobicContact CD1-CE1 4.13Å; I158-F202 HydrophobicContact CD1-CZ 4Å; I158-F202 HydrophobicContact CG1-CE1 4.44Å
159	P	97.4	Very high	94.4	Very high	16 Å²	16	45.7 Å²	45.7	10%	0.104	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-66.9	140.6	-177.8	-24.6	34.3	0	0	0	114.3	L134 D136 P157 S161 F162 F185	L134-P159 HydrophobicContact CB-CG 4.1Å; D136-P159 WeakPolarHBondContact OD1-CB 3.39Å; D136-P159 WeakPolarHBondContact OD1-CG 3.29Å; P157-P159 WeakPolarHBondContact O-CD 3.48Å; P159-S161 WeakPolarHBondContact CB-OG 3.49Å; P159-S161 PolarHBondContact O-N 3.41Å; P159-S161 VanDerWaalsContact O-N 3.09Å; P159-F162 HydrophobicContact CB-CD2 4.13Å; P159-F162 HydrophobicContact CB-CE2 4.49Å; P159-F162 HydrophobicContact CG-CD2 4.22Å; P159-F162 HydrophobicContact CG-CE2 4.14Å; P159-F162 VanDerWaalsContact O-CB 3.31Å; P159-F162 WeakPolarHBondContact O-CB 3.12Å; P159-F162 PolarHBondContact O-N 2.73Å; P159-F185 VanDerWaalsContact O-CE2 3.25Å; P159-F185 WeakPolarHBondContact O-CE2 3.34Å; P159-F185 VanDerWaalsContact O-CZ 3.28Å; P159-F185 WeakPolarHBondContact O-CZ 3.49Å
160	E	96.9	Very high	94.5	Very high	151 Å²	151	45.8 Å²	45.8	71%	0.706	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-57.5	-27.2	174.2	-67.7	-175.4	-178	0	0	113.1	F162 G163 F185	E160-F162 PolarHBondContact O-N 2.63Å; E160-G163 PolarHBondContact O-N 2.76Å; E160-F185 HydrophobicContact CB-CD1 4.41Å; E160-F185 HydrophobicContact CB-CE1 4.28Å; E160-F185 HydrophobicContact CG-CD1 4.1Å; E160-F185 HydrophobicContact CG-CE1 3.88Å
161	S	97	Very high	95.2	Very high	24 Å²	24	44.6 Å²	44.6	17%	0.168	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-57.4	-29.6	174.9	62.9	0	0	0	0	112.2	A139 P159 G163 R164	A139-S161 WeakPolarHBondContact CB-O 3.37Å; P159-S161 WeakPolarHBondContact CB-OG 3.49Å; P159-S161 PolarHBondContact O-N 3.41Å; P159-S161 VanDerWaalsContact O-N 3.09Å; S161-G163 PolarHBondContact O-N 2.79Å; S161-R164 VanDerWaalsContact O-CB 3.27Å; S161-R164 WeakPolarHBondContact O-CB 3.33Å; S161-R164 PolarHBondContact O-N 3.42Å
162	F	98.1	Very high	95.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-63.9	-22.2	177.8	-79.5	-147.8	0	0	0	112.3	L134 L138 A139 L147 I158 P159 E160 R164 F165 L171 F185 L186 V189	L134-F162 HydrophobicContact CB-CZ 4.03Å; L134-F162 HydrophobicContact CD1-CE1 4.14Å; L134-F162 HydrophobicContact CD1-CZ 4.43Å; L138-F162 HydrophobicContact CB-CE2 4.24Å; L138-F162 HydrophobicContact CB-CZ 4.36Å; L138-F162 HydrophobicContact CD1-CZ 4.05Å; A139-F162 HydrophobicContact CB-CD2 4.2Å; L147-F162 HydrophobicContact CD2-CE1 4.4Å; I158-F162 HydrophobicContact CG2-CB 4.19Å; I158-F162 HydrophobicContact CG2-CD1 3.86Å; I158-F162 HydrophobicContact CG2-CG 4.19Å; P159-F162 HydrophobicContact CB-CD2 4.13Å; P159-F162 HydrophobicContact CB-CE2 4.49Å; P159-F162 HydrophobicContact CG-CD2 4.22Å; P159-F162 HydrophobicContact CG-CE2 4.14Å; P159-F162 VanDerWaalsContact O-CB 3.31Å; P159-F162 WeakPolarHBondContact O-CB 3.12Å; P159-F162 PolarHBondContact O-N 2.73Å; E160-F162 PolarHBondContact O-N 2.63Å; F162-R164 PolarHBondContact O-N 2.98Å; F162-R164 VanDerWaalsContact O-N 3.08Å; F162-F165 HydrophobicContact CB-CD2 4.24Å; F162-F165 HydrophobicContact CB-CE2 3.76Å; F162-F165 AromaticContact CD1-CE2 3.77Å; F162-F165 HydrophobicContact CD1-CE2 3.77Å; F162-F165 HydrophobicContact CD1-CZ 4.37Å; F162-F165 HydrophobicContact CD2-CE2 4Å; F162-F165 HydrophobicContact CD2-CZ 4.23Å; F162-F165 HydrophobicContact CE1-CE2 4.32Å; F162-F165 HydrophobicContact CE2-CZ 4.38Å; F162-F165 AromaticContact CG-CE2 3.58Å; F162-F165 HydrophobicContact CG-CE2 3.58Å; F162-F165 HydrophobicContact CG-CZ 4.22Å; F162-F165 WeakPolarHBondContact O-CD2 3.4Å; F162-L171 HydrophobicContact CD1-CD2 4.47Å; F162-F185 HydrophobicContact CB-CE2 4.28Å; F162-L186 HydrophobicContact CB-CD2 4.07Å; F162-V189 VanDerWaalsContact O-CG2 3.29Å; F162-V189 WeakPolarHBondContact O-CG2 3.39Å
163	G	96.8	Very high	96.4	Very high	19 Å²	19	43.1 Å²	43.1	20%	0.196	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65.8	-5.7	169.8	0	0	0	0	0	114.4	E160 S161 F185	E160-G163 PolarHBondContact O-N 2.76Å; S161-G163 PolarHBondContact O-N 2.79Å; G163-F185 WeakPolarHBondContact CA-O 3.44Å
164	R	95.9	Very high	96.6	Very high	175 Å²	175	41.8 Å²	41.8	66%	0.66	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-107.8	2.6	-173.7	-54.9	-178.4	-178.2	168.8	2.9	114.7	S161 F162 K166	S161-R164 VanDerWaalsContact O-CB 3.27Å; S161-R164 WeakPolarHBondContact O-CB 3.33Å; S161-R164 PolarHBondContact O-N 3.42Å; F162-R164 PolarHBondContact O-N 2.98Å; F162-R164 VanDerWaalsContact O-N 3.08Å; R164-K166 PolarHBondContact O-N 3.33Å
165	F	97.6	Very high	96.2	Very high	11 Å²	11	45.4 Å²	45.4	5%	0.048	23%	0.23	C	C	.	.			trans	-52.2	134.2	174.9	-78.3	-68.1	0	0	0	111	L138 A139 L144 L147 F162 L168 V189	L138-F165 HydrophobicContact CB-CZ 4.27Å; L138-F165 VanDerWaalsContact O-CE1 3.27Å; L138-F165 WeakPolarHBondContact O-CE1 3.39Å; A139-F165 HydrophobicContact CB-CD1 4.34Å; A139-F165 HydrophobicContact CB-CE1 4.11Å; A139-F165 HydrophobicContact CB-CE2 4.3Å; A139-F165 HydrophobicContact CB-CZ 4.05Å; L144-F165 HydrophobicContact CD2-CD1 4.5Å; L144-F165 HydrophobicContact CD2-CE1 3.7Å; L144-F165 HydrophobicContact CD2-CZ 4.42Å; L147-F165 HydrophobicContact CD2-CZ 4.05Å; F162-F165 HydrophobicContact CB-CD2 4.24Å; F162-F165 HydrophobicContact CB-CE2 3.76Å; F162-F165 AromaticContact CD1-CE2 3.77Å; F162-F165 HydrophobicContact CD1-CE2 3.77Å; F162-F165 HydrophobicContact CD1-CZ 4.37Å; F162-F165 HydrophobicContact CD2-CE2 4Å; F162-F165 HydrophobicContact CD2-CZ 4.23Å; F162-F165 HydrophobicContact CE1-CE2 4.32Å; F162-F165 HydrophobicContact CE2-CZ 4.38Å; F162-F165 AromaticContact CG-CE2 3.58Å; F162-F165 HydrophobicContact CG-CE2 3.58Å; F162-F165 HydrophobicContact CG-CZ 4.22Å; F162-F165 WeakPolarHBondContact O-CD2 3.4Å; F165-L168 HydrophobicContact CB-CB 3.6Å; F165-L168 HydrophobicContact CB-CD2 4.38Å; F165-L168 HydrophobicContact CD1-CB 3.99Å; F165-L168 HydrophobicContact CD1-CD1 4.47Å; F165-L168 HydrophobicContact CD1-CD2 4.16Å; F165-L168 HydrophobicContact CD1-CG 4.46Å; F165-L168 HydrophobicContact CD2-CB 4.28Å; F165-L168 HydrophobicContact CD2-CD2 3.48Å; F165-L168 VanDerWaalsContact CD2-CD2 3.48Å; F165-L168 HydrophobicContact CD2-CG 4.46Å; F165-L168 HydrophobicContact CE1-CD1 4.5Å; F165-L168 HydrophobicContact CE1-CD2 4.3Å; F165-L168 HydrophobicContact CE2-CD2 3.69Å; F165-L168 HydrophobicContact CG-CB 3.73Å; F165-L168 HydrophobicContact CG-CD2 3.78Å; F165-L168 HydrophobicContact CG-CG 4.3Å; F165-L168 HydrophobicContact CZ-CD2 4.12Å; F165-V189 HydrophobicContact CB-CG1 3.76Å; F165-V189 HydrophobicContact CB-CG2 4.37Å
166	K	95.1	Very high	95.8	Very high	160 Å²	160	43.5 Å²	43.5	70%	0.696	22%	0.216	S	C	*	.	S	Bend	trans	-96.8	-27.8	-175.8	-60.8	-57.4	-178	-171.8	0	114.4	R164 T191	R164-K166 PolarHBondContact O-N 3.33Å; K166-T191 WeakPolarHBondContact O-CG2 3.19Å
167	K	98.2	Very high	95.6	Very high	84 Å²	84	43.6 Å²	43.6	37%	0.365	21%	0.209	S	C	.	.	S	Bend	trans	-131.8	2.4	-174	-67.1	-173.1	178.9	171.9	0	113.7	P142 E143 L144 V145 E169	P142-K167 WeakPolarHBondContact O-CD 3.45Å; E143-K167 IonicContact OE1-NZ 2.66Å; E143-K167 PolarHBondContact OE1-NZ 3.07Å; E143-K167 IonicContact OE2-NZ 2.9Å; E143-K167 PolarHBondContact OE2-NZ 3.12Å; L144-K167 CarbonylContact O-C 3.51Å; L144-K167 VanDerWaalsContact O-C 3.23Å; V145-K167 HydrophobicContact CG2-CB 4.38Å; K167-E169 PolarHBondContact O-N 2.03Å
168	L	98.6	Very high	95.4	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	18%	0.182	C	C	.	.			trans	-68.1	123.2	-173.6	-166.2	76.7	0	0	0	110	L144 V145 L147 F165 L171 V189 T191 L192	L144-L168 HydrophobicContact CD2-CD1 4.11Å; L144-L168 HydrophobicContact CG-CD1 4.07Å; L144-L168 WeakPolarHBondContact O-CA 3.36Å; L144-L168 PolarHBondContact O-N 3.02Å; V145-L168 WeakPolarHBondContact O-CD1 3.13Å; L147-L168 HydrophobicContact CB-CD1 3.9Å; F165-L168 HydrophobicContact CB-CB 3.6Å; F165-L168 HydrophobicContact CB-CD2 4.38Å; F165-L168 HydrophobicContact CD1-CB 3.99Å; F165-L168 HydrophobicContact CD1-CD1 4.47Å; F165-L168 HydrophobicContact CD1-CD2 4.16Å; F165-L168 HydrophobicContact CD1-CG 4.46Å; F165-L168 HydrophobicContact CD2-CB 4.28Å; F165-L168 HydrophobicContact CD2-CD2 3.48Å; F165-L168 VanDerWaalsContact CD2-CD2 3.48Å; F165-L168 HydrophobicContact CD2-CG 4.46Å; F165-L168 HydrophobicContact CE1-CD1 4.5Å; F165-L168 HydrophobicContact CE1-CD2 4.3Å; F165-L168 HydrophobicContact CE2-CD2 3.69Å; F165-L168 HydrophobicContact CG-CB 3.73Å; F165-L168 HydrophobicContact CG-CD2 3.78Å; F165-L168 HydrophobicContact CG-CG 4.3Å; F165-L168 HydrophobicContact CZ-CD2 4.12Å; L168-L171 HydrophobicContact CD2-CB 3.96Å; L168-L171 HydrophobicContact CD2-CD1 4.33Å; L168-L171 HydrophobicContact CD2-CD2 4.49Å; L168-L171 HydrophobicContact CD2-CG 4.49Å; L168-V189 HydrophobicContact CB-CG1 4.44Å; L168-T191 PolarHBondContact N-OG1 3.3Å; L168-T191 CarbonylContact O-C 3.49Å; L168-T191 WeakPolarHBondContact O-CB 3.16Å; L168-T191 PolarHBondContact O-OG1 2.92Å; L168-L192 HydrophobicContact CD2-CD2 4.16Å; L168-L192 HydrophobicContact CG-CD2 4.29Å; L168-L192 PolarHBondContact O-N 2.94Å
169	E	98.8	Very high	95.1	Very high	42 Å²	42	39.7 Å²	39.7	20%	0.196	19%	0.187	C	C	.	.			trans	-107.2	-30	178	-67.4	-175.5	169.9	0	0	111.7	V145 K167 R193 E194	V145-E169 HydrophobicContact CG1-CB 3.81Å; V145-E169 HydrophobicContact CG1-CG 3.73Å; V145-E169 PolarHBondContact O-N 3.09Å; K167-E169 PolarHBondContact O-N 2.03Å; E169-R193 HydrophobicContact CB-CG 4.38Å; E169-R193 WeakPolarHBondContact O-CA 3.34Å; E169-R193 PolarHBondContact O-N 2.94Å; E169-R193 IonicContact OE1-CZ 2.98Å; E169-R193 IonicContact OE1-NH1 2.73Å; E169-R193 PolarHBondContact OE1-NH1 3.23Å; E169-R193 IonicContact OE1-NH2 3.59Å; E169-R193 PolarHBondContact OE1-NH2 3.25Å; E169-R193 IonicContact OE2-CZ 2.79Å; E169-R193 IonicContact OE2-NH1 3.4Å; E169-R193 PolarHBondContact OE2-NH1 2.78Å; E169-R193 IonicContact OE2-NH2 3.8Å; E169-E194 PolarHBondContact O-N 3.39Å
170	S	98.8	Very high	94.9	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.007	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	123.1	-178.7	-174.8	0	0	0	0	111.4	V145 L147 K148 E194	V145-S170 PolarHBondContact O-N 3.27Å; L147-S170 PolarHBondContact N-O 3.17Å; K148-S170 WeakPolarHBondContact CE-OG 3.18Å; K148-S170 PolarHBondContact NZ-OG 3.1Å; S170-E194 WeakPolarHBondContact CA-O 3.28Å; S170-E194 WeakPolarHBondContact CB-OE2 3.02Å; S170-E194 PolarHBondContact OG-OE2 2.78Å
171	L	98.7	Very high	94.8	Very high	1 Å²	1	38 Å²	38	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118	175.2	-179	58.4	0	0	0	109.9	L147 F162 L168 L173 L186 L192 E194 L195 N196	L147-L171 HydrophobicContact CB-CD1 4.23Å; L147-L171 HydrophobicContact CD2-CD1 3.84Å; L147-L171 HydrophobicContact CG-CD1 4.12Å; F162-L171 HydrophobicContact CD1-CD2 4.47Å; L168-L171 HydrophobicContact CD2-CB 3.96Å; L168-L171 HydrophobicContact CD2-CD1 4.33Å; L168-L171 HydrophobicContact CD2-CD2 4.49Å; L168-L171 HydrophobicContact CD2-CG 4.49Å; L171-L173 HydrophobicContact CD1-CD1 4.25Å; L171-L173 HydrophobicContact CD1-CD2 3.99Å; L171-L173 HydrophobicContact CD1-CG 3.94Å; L171-L173 HydrophobicContact CD2-CD1 4.36Å; L171-L173 HydrophobicContact CG-CD1 4.36Å; L171-L173 HydrophobicContact CG-CG 4.17Å; L171-L186 HydrophobicContact CD2-CD1 4.46Å; L171-L186 HydrophobicContact CD2-CD2 4.21Å; L171-L192 HydrophobicContact CB-CD2 4.15Å; L171-E194 PolarHBondContact N-O 3.37Å; L171-L195 HydrophobicContact CB-CD1 4.25Å; L171-L195 HydrophobicContact CD2-CD1 3.97Å; L171-L195 HydrophobicContact CG-CD1 4.31Å; L171-N196 PolarHBondContact O-N 3.37Å
172	S	97.3	Very high	94.9	Very high	5 Å²	5	37.1 Å²	37.1	4%	0.035	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119.1	174.4	-177.3	0	0	0	0	110.4	L147 L149 D150	L147-S172 PolarHBondContact O-N 2.97Å; L149-S172 PolarHBondContact N-O 3.2Å; D150-S172 WeakPolarHBondContact CB-OG 3.35Å; D150-S172 WeakPolarHBondContact OD1-CB 3.47Å; D150-S172 PolarHBondContact OD1-OG 3.08Å
173	L	96.7	Very high	94.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.181	C	C	.	.			trans	-126.2	16.9	179.5	-59.1	-179.6	0	0	0	112.3	L134 L149 I158 L171 N176 L178 N196 L197 N200	L134-L173 HydrophobicContact CD1-CD1 3.87Å; L134-L173 HydrophobicContact CD1-CD2 4.33Å; L134-L173 HydrophobicContact CD2-CD2 4.1Å; L149-L173 HydrophobicContact CB-CD2 3.88Å; L149-L173 HydrophobicContact CD1-CD2 4.02Å; L149-L173 HydrophobicContact CG-CD2 4.33Å; I158-L173 HydrophobicContact CD1-CD1 3.88Å; I158-L173 HydrophobicContact CG1-CD1 4.14Å; L171-L173 HydrophobicContact CD1-CD1 4.25Å; L171-L173 HydrophobicContact CD1-CD2 3.99Å; L171-L173 HydrophobicContact CD1-CG 3.94Å; L171-L173 HydrophobicContact CD2-CD1 4.36Å; L171-L173 HydrophobicContact CG-CD1 4.36Å; L171-L173 HydrophobicContact CG-CG 4.17Å; L173-N176 PolarHBondContact O-ND2 3.15Å; L173-L178 HydrophobicContact CB-CD1 3.77Å; L173-L178 HydrophobicContact CD1-CD1 3.9Å; L173-L178 HydrophobicContact CG-CD1 4.39Å; L173-N196 PolarHBondContact N-O 3.42Å; L173-L197 HydrophobicContact CB-CD2 4.01Å; L173-L197 HydrophobicContact CD1-CD2 3.82Å; L173-L197 HydrophobicContact CG-CD2 4.14Å; L173-N200 PolarHBondContact O-ND2 3.17Å
174	V	90.8	Very high	94.9	Very high	16 Å²	16	39.3 Å²	39.3	10%	0.097	19%	0.19	C	C	.	.			trans	-55	148.4	-174.1	-169.2	0	0	0	0	112.2	D150 S151 N176 N196 S198 Y199	D150-V174 CarbonylContact C-O 3.11Å; D150-V174 WeakPolarHBondContact CA-O 3.46Å; D150-V174 HydrophobicContact CB-CB 3.85Å; D150-V174 HydrophobicContact CB-CG2 4.4Å; D150-V174 WeakPolarHBondContact CB-O 3.47Å; S151-V174 PolarHBondContact N-O 3.27Å; V174-N176 PolarHBondContact O-N 3.42Å; V174-N176 PolarHBondContact O-ND2 3.09Å; V174-N196 HydrophobicContact CG2-CB 4.03Å; V174-N196 WeakPolarHBondContact CG2-ND2 3.38Å; V174-N196 WeakPolarHBondContact CG2-OD1 3.38Å; V174-S198 VanDerWaalsContact CA-O 3.23Å; V174-S198 WeakPolarHBondContact CA-O 3.12Å; V174-S198 VanDerWaalsContact CG1-O 3.27Å; V174-S198 WeakPolarHBondContact CG1-O 3.25Å; V174-Y199 HydrophobicContact CG1-CD2 4.06Å
175	Y	86	Confident	94.9	Very high	77 Å²	77	33.8 Å²	33.8	30%	0.302	17%	0.171	S	C	.	.	S	Bend	trans	54.4	55.1	171.4	-80.3	-63	0	0	0	112.6	S151 N152 S198 Y199 I957	S151-Y175 WeakPolarHBondContact CA-O 3.47Å; S151-Y175 PolarHBondContact N-O 2.92Å; N152-Y175 PolarHBondContact N-O 3.3Å; N152-Y175 VanDerWaalsContact O-O 3.1Å; Y175-S198 PolarHBondContact N-O 3.01Å; Y175-S198 VanDerWaalsContact N-O 3.13Å; Y175-Y199 WeakPolarHBondContact CA-O 3.31Å; Y175-Y199 HydrophobicContact CD1-CG 4.36Å; Y175-Y199 HydrophobicContact CD2-CD2 4.23Å; Y175-Y199 HydrophobicContact CE1-CD1 4.38Å; Y175-Y199 HydrophobicContact CE1-CD2 4.27Å; Y175-Y199 AromaticContact CE1-CG 3.82Å; Y175-Y199 HydrophobicContact CE1-CG 3.82Å; Y175-Y199 AromaticContact CE2-CD2 3.62Å; Y175-Y199 HydrophobicContact CE2-CD2 3.62Å; Y175-Y199 HydrophobicContact CE2-CE2 4.26Å; Y175-Y199 HydrophobicContact CE2-CG 4.03Å; Y175-Y199 AromaticContact CZ-CD2 3.65Å; Y175-Y199 AromaticContact CZ-CG 3.62Å; Y175-Y199 PolarHBondContact N-O 3.43Å; Y175-I957 PolarHBondContact OH-O 3.01Å
176	N	84.6	Confident	95	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.011	17%	0.169	C	C	.	.	S	Bend	trans	-119.2	-164.4	170	-84.7	-76	0	0	0	110.1	L149 N152 N153 F154 L173 V174 L178 N200 P201	L149-N176 PolarHBondContact O-ND2 3.45Å; N152-N176 WeakPolarHBondContact CA-OD1 3.45Å; N152-N176 WeakPolarHBondContact CB-OD1 3.15Å; N152-N176 PolarHBondContact O-OD1 3.32Å; N153-N176 PolarHBondContact N-OD1 3.41Å; F154-N176 HydrophobicContact CB-CB 4.36Å; F154-N176 WeakPolarHBondContact CB-OD1 3.21Å; F154-N176 VanDerWaalsContact CD2-OD1 3.31Å; F154-N176 WeakPolarHBondContact CD2-OD1 3.14Å; F154-N176 PolarHBondContact N-OD1 3.18Å; L173-N176 PolarHBondContact O-ND2 3.15Å; V174-N176 PolarHBondContact O-N 3.42Å; V174-N176 PolarHBondContact O-ND2 3.09Å; N176-L178 HydrophobicContact CB-CD1 4.39Å; N176-L178 HydrophobicContact CB-CG 3.95Å; N176-N200 VanDerWaalsContact CA-OD1 3.25Å; N176-N200 WeakPolarHBondContact CA-OD1 3.43Å; N176-N200 WeakPolarHBondContact CB-OD1 3.19Å; N176-N200 PolarHBondContact N-OD1 3.06Å; N176-N200 PolarHBondContact O-OD1 3.32Å; N176-P201 WeakPolarHBondContact O-CD 3.37Å
177	L	89.6	Confident	95.1	Very high	32 Å²	32	26.1 Å²	26.1	17%	0.168	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	30.1	173.1	-75.4	-179.8	0	0	0	112	F154 S155 G179 P201	F154-L177 CarbonylContact O-C 3.22Å; F154-L177 WeakPolarHBondContact O-CA 3.32Å; F154-L177 VanDerWaalsContact O-CB 3.23Å; F154-L177 WeakPolarHBondContact O-CB 3.44Å; F154-L177 PolarHBondContact O-N 3.11Å; S155-L177 WeakPolarHBondContact CA-O 3.41Å; L177-G179 PolarHBondContact O-N 2.91Å; L177-P201 HydrophobicContact CD2-CG 4.16Å
178	L	92.3	Very high	95	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	130	-175.9	-58.4	174.9	0	0	0	110.5	L134 F154 G156 I158 L173 N176 N200 P201 F202	L134-L178 HydrophobicContact CD1-CD1 4.12Å; L134-L178 HydrophobicContact CD1-CD2 3.67Å; L134-L178 HydrophobicContact CG-CD2 3.95Å; F154-L178 HydrophobicContact CB-CD2 4.08Å; F154-L178 PolarHBondContact O-N 2.78Å; G156-L178 WeakPolarHBondContact O-CA 3.42Å; I158-L178 HydrophobicContact CD1-CD1 4.34Å; I158-L178 HydrophobicContact CG1-CD1 4.06Å; L173-L178 HydrophobicContact CB-CD1 3.77Å; L173-L178 HydrophobicContact CD1-CD1 3.9Å; L173-L178 HydrophobicContact CG-CD1 4.39Å; N176-L178 HydrophobicContact CB-CD1 4.39Å; N176-L178 HydrophobicContact CB-CG 3.95Å; L178-N200 HydrophobicContact CB-CB 4.15Å; L178-N200 WeakPolarHBondContact CB-OD1 3.37Å; L178-N200 WeakPolarHBondContact CG-OD1 3.25Å; L178-N200 PolarHBondContact N-OD1 3.46Å; L178-P201 CarbonylContact O-C 3.58Å; L178-P201 WeakPolarHBondContact O-CD 3.01Å; L178-F202 HydrophobicContact CB-CE1 3.87Å; L178-F202 HydrophobicContact CB-CZ 4.14Å; L178-F202 PolarHBondContact O-N 2.92Å
179	G	91.3	Very high	94.9	Very high	16 Å²	16	24.7 Å²	24.7	17%	0.165	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-164.4	176.7	0	0	0	0	0	111.6	G156 P157 L177 F202	G156-G179 PolarHBondContact O-N 2.75Å; P157-G179 WeakPolarHBondContact CA-O 3.14Å; L177-G179 PolarHBondContact O-N 2.91Å; G179-F202 WeakPolarHBondContact O-CD1 3.22Å
180	G	93.3	Very high	94.8	Very high	28 Å²	28	26.6 Å²	26.6	29%	0.289	17%	0.167	S	C	.	.	S	Bend	trans	69.7	-176.7	-169.8	0	0	0	0	0	111.7	F202 V203	G180-F202 CarbonylContact O-C 3.57Å; G180-F202 WeakPolarHBondContact O-CA 3.35Å; G180-F202 WeakPolarHBondContact O-CB 3.25Å; G180-F202 VanDerWaalsContact O-CD1 3.31Å; G180-F202 WeakPolarHBondContact O-CD1 3.4Å; G180-V203 PolarHBondContact O-N 2.94Å
181	E	95.8	Very high	94.8	Very high	105 Å²	105	28.5 Å²	28.5	49%	0.491	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-83.4	160	174.7	-67.2	-179.6	-166.9	0	0	110.5	P183 V203	E181-P183 WeakPolarHBondContact O-CD 3.25Å; E181-P183 VanDerWaalsContact O-N 3.16Å; E181-V203 HydrophobicContact CB-CG2 4.35Å; E181-V203 HydrophobicContact CG-CG2 3.42Å; E181-V203 VanDerWaalsContact CG-CG2 3.42Å
182	V	97.9	Very high	94.8	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.03	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-60.3	118.4	168.2	176.8	0	0	0	0	108.2	P184 L197 F202 P208 L222 C225 L227	V182-P184 WeakPolarHBondContact O-CD 2.88Å; V182-L197 HydrophobicContact CG1-CD1 3.92Å; V182-F202 HydrophobicContact CG2-CD2 3.77Å; V182-F202 HydrophobicContact CG2-CE2 3.94Å; V182-F202 HydrophobicContact CG2-CG 4.09Å; V182-F202 HydrophobicContact CG2-CZ 4.43Å; V182-P208 HydrophobicContact CB-CG 4.31Å; V182-P208 HydrophobicContact CG1-CG 3.99Å; V182-P208 WeakPolarHBondContact O-CG 3.42Å; V182-L222 HydrophobicContact CG1-CD2 4.29Å; V182-C225 HydrophobicContact CG2-CB 4.21Å; V182-L227 HydrophobicContact CB-CD2 4.28Å; V182-L227 HydrophobicContact CG2-CD2 3.83Å
183	P	96.7	Very high	94.9	Very high	7 Å²	7	32.4 Å²	32.4	5%	0.045	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-79.6	127.2	-161.6	27.5	-36.3	0	0	0	113.8	I158 E181 F185 L186	I158-P183 HydrophobicContact CB-CG 4.03Å; I158-P183 HydrophobicContact CD1-CG 3.97Å; I158-P183 HydrophobicContact CG2-CG 4.15Å; E181-P183 WeakPolarHBondContact O-CD 3.25Å; E181-P183 VanDerWaalsContact O-N 3.16Å; P183-F185 VanDerWaalsContact C-N 3.26Å; P183-F185 HydrophobicContact CB-CD1 3.69Å; P183-F185 HydrophobicContact CB-CD2 4.09Å; P183-F185 HydrophobicContact CB-CE1 3.19Å; P183-F185 HydrophobicContact CB-CE2 3.63Å; P183-F185 HydrophobicContact CB-CG 4.11Å; P183-F185 HydrophobicContact CB-CZ 3.15Å; P183-F185 HydrophobicContact CG-CE1 4.22Å; P183-F185 HydrophobicContact CG-CE2 3.87Å; P183-F185 HydrophobicContact CG-CZ 3.68Å; P183-F185 PolarHBondContact O-N 2.79Å; P183-L186 HydrophobicContact CG-CD1 3.62Å; P183-L186 HydrophobicContact CG-CG 3.81Å; P183-L186 PolarHBondContact O-N 3.4Å
184	P	98	Very high	95	Very high	57 Å²	57	36 Å²	36	37%	0.37	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-58.9	-31.9	174.3	-26.8	35.3	0	0	0	114.7	V182 L186 G187 P208 E210	V182-P184 WeakPolarHBondContact O-CD 2.88Å; P184-L186 PolarHBondContact O-N 3.49Å; P184-L186 VanDerWaalsContact O-N 3.12Å; P184-G187 PolarHBondContact O-N 2.81Å; P184-P208 HydrophobicContact CB-CB 4.14Å; P184-P208 HydrophobicContact CG-CB 4.11Å; P184-P208 HydrophobicContact CG-CG 4.41Å; P184-E210 HydrophobicContact CB-CB 4.48Å; P184-E210 HydrophobicContact CB-CG 4.18Å; P184-E210 WeakPolarHBondContact O-CB 3.44Å
185	F	97.8	Very high	95.3	Very high	60 Å²	60	35.2 Å²	35.2	26%	0.263	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-64.6	-18.1	-175.5	57.8	-110.4	0	0	0	114	I158 P159 E160 F162 G163 P183 G187 G188	I158-F185 HydrophobicContact CB-CZ 4.44Å; I158-F185 HydrophobicContact CG2-CE2 4.12Å; I158-F185 HydrophobicContact CG2-CZ 4.1Å; I158-F185 WeakPolarHBondContact O-CZ 3.25Å; P159-F185 VanDerWaalsContact O-CE2 3.25Å; P159-F185 WeakPolarHBondContact O-CE2 3.34Å; P159-F185 VanDerWaalsContact O-CZ 3.28Å; P159-F185 WeakPolarHBondContact O-CZ 3.49Å; E160-F185 HydrophobicContact CB-CD1 4.41Å; E160-F185 HydrophobicContact CB-CE1 4.28Å; E160-F185 HydrophobicContact CG-CD1 4.1Å; E160-F185 HydrophobicContact CG-CE1 3.88Å; F162-F185 HydrophobicContact CB-CE2 4.28Å; G163-F185 WeakPolarHBondContact CA-O 3.44Å; P183-F185 VanDerWaalsContact C-N 3.26Å; P183-F185 HydrophobicContact CB-CD1 3.69Å; P183-F185 HydrophobicContact CB-CD2 4.09Å; P183-F185 HydrophobicContact CB-CE1 3.19Å; P183-F185 HydrophobicContact CB-CE2 3.63Å; P183-F185 HydrophobicContact CB-CG 4.11Å; P183-F185 HydrophobicContact CB-CZ 3.15Å; P183-F185 HydrophobicContact CG-CE1 4.22Å; P183-F185 HydrophobicContact CG-CE2 3.87Å; P183-F185 HydrophobicContact CG-CZ 3.68Å; P183-F185 PolarHBondContact O-N 2.79Å; F185-G187 PolarHBondContact O-N 3.43Å; F185-G188 PolarHBondContact O-N 2.91Å
186	L	98.1	Very high	95.9	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-65.5	-24.9	172.6	-70.3	179.4	0	0	0	111.9	F162 L171 P183 P184 G188 V189 L195 L197 L211	F162-L186 HydrophobicContact CB-CD2 4.07Å; L171-L186 HydrophobicContact CD2-CD1 4.46Å; L171-L186 HydrophobicContact CD2-CD2 4.21Å; P183-L186 HydrophobicContact CG-CD1 3.62Å; P183-L186 HydrophobicContact CG-CG 3.81Å; P183-L186 PolarHBondContact O-N 3.4Å; P184-L186 PolarHBondContact O-N 3.49Å; P184-L186 VanDerWaalsContact O-N 3.12Å; L186-G188 PolarHBondContact O-N 2.87Å; L186-G188 VanDerWaalsContact O-N 3.11Å; L186-V189 PolarHBondContact O-N 3.13Å; L186-L195 HydrophobicContact CD1-CD1 4.07Å; L186-L195 HydrophobicContact CD1-CD2 4.43Å; L186-L197 HydrophobicContact CD1-CD1 4.08Å; L186-L211 HydrophobicContact CB-CD2 4.35Å
187	G	97.3	Very high	96.5	Very high	8 Å²	8	32.4 Å²	32.4	8%	0.082	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-62	-11.8	169.7	0	0	0	0	0	114.3	P184 F185 E210 L214	P184-G187 PolarHBondContact O-N 2.81Å; F185-G187 PolarHBondContact O-N 3.43Å; G187-E210 WeakPolarHBondContact CA-O 3.23Å; G187-L214 WeakPolarHBondContact O-CD2 3.41Å
188	G	96.4	Very high	96.6	Very high	55 Å²	55	31 Å²	31	57%	0.567	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-84.4	-12.5	173.2	0	0	0	0	0	114.9	F185 L186 S190	F185-G188 PolarHBondContact O-N 2.91Å; L186-G188 PolarHBondContact O-N 2.87Å; L186-G188 VanDerWaalsContact O-N 3.11Å; G188-S190 VanDerWaalsContact C-N 3.35Å; G188-S190 PolarHBondContact O-N 3.43Å; G188-S190 VanDerWaalsContact O-N 3.09Å
189	V	97.8	Very high	96.4	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	20%	0.196	C	C	.	.			trans	-87.6	74.4	-178.8	-169.6	0	0	0	0	109.7	F162 F165 L168 L186 T191 L192 L214	F162-V189 VanDerWaalsContact O-CG2 3.29Å; F162-V189 WeakPolarHBondContact O-CG2 3.39Å; F165-V189 HydrophobicContact CB-CG1 3.76Å; F165-V189 HydrophobicContact CB-CG2 4.37Å; L168-V189 HydrophobicContact CB-CG1 4.44Å; L186-V189 PolarHBondContact O-N 3.13Å; V189-T191 PolarHBondContact O-N 3.34Å; V189-L192 HydrophobicContact CB-CD1 3.8Å; V189-L192 HydrophobicContact CB-CG 3.93Å; V189-L192 HydrophobicContact CG1-CD1 4.17Å; V189-L192 HydrophobicContact CG1-CG 3.77Å; V189-L192 WeakPolarHBondContact O-CB 3.27Å; V189-L192 PolarHBondContact O-N 2.99Å; V189-L214 VanDerWaalsContact O-CD2 3.29Å; V189-L214 WeakPolarHBondContact O-CD2 3.38Å
190	S	96.5	Very high	95.9	Very high	81 Å²	81	32.6 Å²	32.6	57%	0.566	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-12.3	-172.4	64.3	0	0	0	0	115.5	G188	G188-S190 VanDerWaalsContact C-N 3.35Å; G188-S190 PolarHBondContact O-N 3.43Å; G188-S190 VanDerWaalsContact O-N 3.09Å
191	T	98.2	Very high	95.7	Very high	42 Å²	42	34.5 Å²	34.5	26%	0.258	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-13.5	176.1	52.7	0	0	0	0	113.9	K166 L168 V189 R193	K166-T191 WeakPolarHBondContact O-CG2 3.19Å; L168-T191 PolarHBondContact N-OG1 3.3Å; L168-T191 CarbonylContact O-C 3.49Å; L168-T191 WeakPolarHBondContact O-CB 3.16Å; L168-T191 PolarHBondContact O-OG1 2.92Å; V189-T191 PolarHBondContact O-N 3.34Å; T191-R193 PolarHBondContact O-N 2.89Å
192	L	98.6	Very high	95.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.175	C	C	.	.			trans	-60.7	132.8	-177.2	-79.9	174	0	0	0	112.2	L168 L171 V189 L214 A216 L217	L168-L192 HydrophobicContact CD2-CD2 4.16Å; L168-L192 HydrophobicContact CG-CD2 4.29Å; L168-L192 PolarHBondContact O-N 2.94Å; L171-L192 HydrophobicContact CB-CD2 4.15Å; V189-L192 HydrophobicContact CB-CD1 3.8Å; V189-L192 HydrophobicContact CB-CG 3.93Å; V189-L192 HydrophobicContact CG1-CD1 4.17Å; V189-L192 HydrophobicContact CG1-CG 3.77Å; V189-L192 WeakPolarHBondContact O-CB 3.27Å; V189-L192 PolarHBondContact O-N 2.99Å; L192-L214 HydrophobicContact CB-CD1 4.47Å; L192-L214 HydrophobicContact CD1-CD1 4.27Å; L192-A216 CarbonylContact O-C 3.57Å; L192-L217 HydrophobicContact CB-CD1 4.15Å; L192-L217 WeakPolarHBondContact O-CA 3.16Å; L192-L217 PolarHBondContact O-N 2.95Å
193	R	98.8	Very high	95.4	Very high	88 Å²	88	33.1 Å²	33.1	33%	0.332	20%	0.195	S	C	.	.	S	Bend	trans	-114.7	-31.4	171.9	-62.5	-167.5	-176.5	131.1	18	112	E169 T191 A216 R218 V219	E169-R193 HydrophobicContact CB-CG 4.38Å; E169-R193 WeakPolarHBondContact O-CA 3.34Å; E169-R193 PolarHBondContact O-N 2.94Å; E169-R193 IonicContact OE1-CZ 2.98Å; E169-R193 IonicContact OE1-NH1 2.73Å; E169-R193 PolarHBondContact OE1-NH1 3.23Å; E169-R193 IonicContact OE1-NH2 3.59Å; E169-R193 PolarHBondContact OE1-NH2 3.25Å; E169-R193 IonicContact OE2-CZ 2.79Å; E169-R193 IonicContact OE2-NH1 3.4Å; E169-R193 PolarHBondContact OE2-NH1 2.78Å; E169-R193 IonicContact OE2-NH2 3.8Å; T191-R193 PolarHBondContact O-N 2.89Å; R193-A216 HydrophobicContact CG-CB 4.47Å; R193-R218 WeakPolarHBondContact O-CA 3.25Å; R193-R218 WeakPolarHBondContact O-CB 3.47Å; R193-R218 PolarHBondContact O-N 3.32Å; R193-V219 PolarHBondContact O-N 3.43Å
194	E	98.8	Very high	95.4	Very high	74 Å²	74	35 Å²	35	35%	0.346	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	121.2	178.1	-62.8	169.5	-168.2	0	0	109.2	K148 E169 S170 L171 V219	K148-E194 IonicContact NZ-OE2 3.23Å; K148-E194 PolarHBondContact NZ-OE2 3.18Å; E169-E194 PolarHBondContact O-N 3.39Å; S170-E194 WeakPolarHBondContact CA-O 3.28Å; S170-E194 WeakPolarHBondContact CB-OE2 3.02Å; S170-E194 PolarHBondContact OG-OE2 2.78Å; L171-E194 PolarHBondContact N-O 3.37Å; E194-V219 HydrophobicContact CB-CB 4.34Å; E194-V219 HydrophobicContact CG-CB 4.08Å; E194-V219 HydrophobicContact CG-CG2 4.11Å
195	L	98.7	Very high	95.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	115.8	172.8	177.1	59.5	0	0	0	109	L171 L186 L197 L211 L217 V219 L220 W221	L171-L195 HydrophobicContact CB-CD1 4.25Å; L171-L195 HydrophobicContact CD2-CD1 3.97Å; L171-L195 HydrophobicContact CG-CD1 4.31Å; L186-L195 HydrophobicContact CD1-CD1 4.07Å; L186-L195 HydrophobicContact CD1-CD2 4.43Å; L195-L197 HydrophobicContact CD1-CD1 4.19Å; L195-L197 HydrophobicContact CD1-CD2 3.85Å; L195-L197 HydrophobicContact CD1-CG 3.86Å; L195-L197 HydrophobicContact CG-CD1 4.48Å; L195-L197 HydrophobicContact CG-CG 4.25Å; L195-L211 HydrophobicContact CD2-CD2 3.76Å; L195-L217 HydrophobicContact CB-CD1 4.13Å; L195-V219 PolarHBondContact N-O 2.94Å; L195-L220 HydrophobicContact CB-CD1 4.27Å; L195-L220 HydrophobicContact CD2-CD1 4.04Å; L195-L220 HydrophobicContact CG-CD1 4.27Å; L195-W221 PolarHBondContact O-N 2.84Å
196	N	97.8	Very high	95.4	Very high	21 Å²	21	33.1 Å²	33.1	11%	0.112	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	107.6	-177.5	-171.2	0.6	0	0	0	110.8	L171 L173 V174 S198 W221	L171-N196 PolarHBondContact O-N 3.37Å; L173-N196 PolarHBondContact N-O 3.42Å; V174-N196 HydrophobicContact CG2-CB 4.03Å; V174-N196 WeakPolarHBondContact CG2-ND2 3.38Å; V174-N196 WeakPolarHBondContact CG2-OD1 3.38Å; N196-S198 PolarHBondContact OD1-N 2.79Å; N196-S198 PolarHBondContact OD1-OG 3.17Å; N196-W221 HydrophobicContact CB-CB 4.28Å; N196-W221 HydrophobicContact CB-CE3 4.48Å; N196-W221 WeakPolarHBondContact ND2-CZ3 3.47Å; N196-W221 WeakPolarHBondContact OD1-CB 3.44Å
197	L	97.7	Very high	95.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	21%	0.207	C	C	.	.			trans	-116.6	5.2	-177.7	-54.1	-179.6	0	0	0	112.5	I158 L173 V182 L186 L195 N200 F202 W221 L222 C225	I158-L197 HydrophobicContact CD1-CD1 4.21Å; I158-L197 HydrophobicContact CD1-CD2 3.97Å; L173-L197 HydrophobicContact CB-CD2 4.01Å; L173-L197 HydrophobicContact CD1-CD2 3.82Å; L173-L197 HydrophobicContact CG-CD2 4.14Å; V182-L197 HydrophobicContact CG1-CD1 3.92Å; L186-L197 HydrophobicContact CD1-CD1 4.08Å; L195-L197 HydrophobicContact CD1-CD1 4.19Å; L195-L197 HydrophobicContact CD1-CD2 3.85Å; L195-L197 HydrophobicContact CD1-CG 3.86Å; L195-L197 HydrophobicContact CG-CD1 4.48Å; L195-L197 HydrophobicContact CG-CG 4.25Å; L197-N200 PolarHBondContact O-ND2 3.15Å; L197-F202 HydrophobicContact CB-CE2 4.13Å; L197-F202 HydrophobicContact CB-CZ 4.34Å; L197-W221 PolarHBondContact N-O 3.13Å; L197-L222 HydrophobicContact CB-CD2 3.84Å; L197-L222 HydrophobicContact CD1-CD2 3.86Å; L197-L222 HydrophobicContact CG-CD2 4.02Å; L197-C225 PolarHBondContact O-SG 2.89Å; L197-C225 VanDerWaalsContact O-SG 3.34Å
198	S	90.9	Very high	95.5	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.021	21%	0.205	C	C	.	.			trans	-54	151.6	-169.3	-58.2	0	0	0	0	114	V174 Y175 N196 N200 W221 A223	V174-S198 VanDerWaalsContact CA-O 3.23Å; V174-S198 WeakPolarHBondContact CA-O 3.12Å; V174-S198 VanDerWaalsContact CG1-O 3.27Å; V174-S198 WeakPolarHBondContact CG1-O 3.25Å; Y175-S198 PolarHBondContact N-O 3.01Å; Y175-S198 VanDerWaalsContact N-O 3.13Å; N196-S198 PolarHBondContact OD1-N 2.79Å; N196-S198 PolarHBondContact OD1-OG 3.17Å; S198-N200 PolarHBondContact O-N 3.46Å; S198-N200 PolarHBondContact O-ND2 3.17Å; S198-W221 VanDerWaalsContact OG-C 3.29Å; S198-W221 PolarHBondContact OG-O 3.44Å; S198-A223 CarbonylContact C-O 3.52Å; S198-A223 WeakPolarHBondContact CA-O 3.11Å; S198-A223 VanDerWaalsContact CB-O 3.25Å; S198-A223 WeakPolarHBondContact CB-O 3.47Å; S198-A223 PolarHBondContact OG-N 3.35Å
199	Y	88.1	Confident	95.6	Very high	45 Å²	45	32.8 Å²	32.8	18%	0.176	20%	0.196	C	C	.	.	S	Bend	trans	56.6	51.4	174.2	-51.8	-71.7	0	0	0	113.5	V174 Y175 A223	V174-Y199 HydrophobicContact CG1-CD2 4.06Å; Y175-Y199 WeakPolarHBondContact CA-O 3.31Å; Y175-Y199 HydrophobicContact CD1-CG 4.36Å; Y175-Y199 HydrophobicContact CD2-CD2 4.23Å; Y175-Y199 HydrophobicContact CE1-CD1 4.38Å; Y175-Y199 HydrophobicContact CE1-CD2 4.27Å; Y175-Y199 AromaticContact CE1-CG 3.82Å; Y175-Y199 HydrophobicContact CE1-CG 3.82Å; Y175-Y199 AromaticContact CE2-CD2 3.62Å; Y175-Y199 HydrophobicContact CE2-CD2 3.62Å; Y175-Y199 HydrophobicContact CE2-CE2 4.26Å; Y175-Y199 HydrophobicContact CE2-CG 4.03Å; Y175-Y199 AromaticContact CZ-CD2 3.65Å; Y175-Y199 AromaticContact CZ-CG 3.62Å; Y175-Y199 PolarHBondContact N-O 3.43Å; Y199-A223 HydrophobicContact CE2-CB 4.41Å; Y199-A223 PolarHBondContact N-O 3.23Å
200	N	81	Confident	95.6	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	22%	0.215	C	C	.	.			trans	-120.4	142.8	170.5	-84.9	-75.9	0	0	0	110.1	L173 N176 L178 L197 S198 F202	L173-N200 PolarHBondContact O-ND2 3.17Å; N176-N200 VanDerWaalsContact CA-OD1 3.25Å; N176-N200 WeakPolarHBondContact CA-OD1 3.43Å; N176-N200 WeakPolarHBondContact CB-OD1 3.19Å; N176-N200 PolarHBondContact N-OD1 3.06Å; N176-N200 PolarHBondContact O-OD1 3.32Å; L178-N200 HydrophobicContact CB-CB 4.15Å; L178-N200 WeakPolarHBondContact CB-OD1 3.37Å; L178-N200 WeakPolarHBondContact CG-OD1 3.25Å; L178-N200 PolarHBondContact N-OD1 3.46Å; L197-N200 PolarHBondContact O-ND2 3.15Å; S198-N200 PolarHBondContact O-N 3.46Å; S198-N200 PolarHBondContact O-ND2 3.17Å; N200-F202 HydrophobicContact CB-CD2 3.72Å; N200-F202 HydrophobicContact CB-CE2 3.43Å; N200-F202 VanDerWaalsContact CB-CE2 3.43Å; N200-F202 HydrophobicContact CB-CG 4.41Å; N200-F202 HydrophobicContact CB-CZ 3.89Å; N200-F202 PolarHBondContact O-N 3.38Å
201	P	88.8	Confident	95.7	Very high	68 Å²	68	33 Å²	33	44%	0.442	19%	0.188	S	C	.	.			trans	-77.7	54.6	-178.9	35.9	-38.3	0	0	0	112.4	N176 L177 L178	N176-P201 WeakPolarHBondContact O-CD 3.37Å; L177-P201 HydrophobicContact CD2-CG 4.16Å; L178-P201 CarbonylContact O-C 3.58Å; L178-P201 WeakPolarHBondContact O-CD 3.01Å
202	F	93.3	Very high	95.6	Very high	5 Å²	5	31.2 Å²	31.2	2%	0.022	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-60.1	153.1	174.4	-67.8	-65	0	0	0	111.1	I158 L178 G179 G180 V182 L197 N200 C225 N226	I158-F202 HydrophobicContact CD1-CE1 4.13Å; I158-F202 HydrophobicContact CD1-CZ 4Å; I158-F202 HydrophobicContact CG1-CE1 4.44Å; L178-F202 HydrophobicContact CB-CE1 3.87Å; L178-F202 HydrophobicContact CB-CZ 4.14Å; L178-F202 PolarHBondContact O-N 2.92Å; G179-F202 WeakPolarHBondContact O-CD1 3.22Å; G180-F202 CarbonylContact O-C 3.57Å; G180-F202 WeakPolarHBondContact O-CA 3.35Å; G180-F202 WeakPolarHBondContact O-CB 3.25Å; G180-F202 VanDerWaalsContact O-CD1 3.31Å; G180-F202 WeakPolarHBondContact O-CD1 3.4Å; V182-F202 HydrophobicContact CG2-CD2 3.77Å; V182-F202 HydrophobicContact CG2-CE2 3.94Å; V182-F202 HydrophobicContact CG2-CG 4.09Å; V182-F202 HydrophobicContact CG2-CZ 4.43Å; L197-F202 HydrophobicContact CB-CE2 4.13Å; L197-F202 HydrophobicContact CB-CZ 4.34Å; N200-F202 HydrophobicContact CB-CD2 3.72Å; N200-F202 HydrophobicContact CB-CE2 3.43Å; N200-F202 VanDerWaalsContact CB-CE2 3.43Å; N200-F202 HydrophobicContact CB-CG 4.41Å; N200-F202 HydrophobicContact CB-CZ 3.89Å; N200-F202 PolarHBondContact O-N 3.38Å; F202-C225 HydrophobicContact CD2-CB 3.92Å; F202-C225 HydrophobicContact CE2-CB 4.41Å; F202-N226 WeakPolarHBondContact O-CB 3.44Å; F202-N226 PolarHBondContact O-ND2 2.82Å
203	V	94.2	Very high	95.6	Very high	75 Å²	75	35.7 Å²	35.7	46%	0.455	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-70.7	152.7	167.6	-50.1	0	0	0	0	108.9	G180 E181 G205	G180-V203 PolarHBondContact O-N 2.94Å; E181-V203 HydrophobicContact CB-CG2 4.35Å; E181-V203 HydrophobicContact CG-CG2 3.42Å; E181-V203 VanDerWaalsContact CG-CG2 3.42Å; V203-G205 PolarHBondContact O-N 3.35Å
204	A	97	Very high	95.6	Very high	47 Å²	47	31.5 Å²	31.5	39%	0.388	19%	0.186	S	C	.	.	S	Bend	trans	-61.6	123.6	-177.2	0	0	0	0	0	110.5	N226 I228	A204-N226 WeakPolarHBondContact CA-O 3.3Å; A204-N226 PolarHBondContact N-ND2 3.15Å; A204-N226 VanDerWaalsContact N-ND2 3.19Å; A204-I228 HydrophobicContact CB-CD1 4.16Å; A204-I228 HydrophobicContact CB-CG1 4.45Å; A204-I228 HydrophobicContact CB-CG2 4.12Å
205	G	97.4	Very high	95.4	Very high	4 Å²	4	31.9 Å²	31.9	4%	0.041	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	164.3	-178.4	0	0	0	0	0	112	V203 L227 I228	V203-G205 PolarHBondContact O-N 3.35Å; G205-L227 CarbonylContact O-C 3.58Å; G205-L227 VanDerWaalsContact O-CA 3.31Å; G205-L227 WeakPolarHBondContact O-CA 3.41Å; G205-I228 PolarHBondContact O-N 2.92Å
206	P	98.1	Very high	95.4	Very high	73 Å²	73	33 Å²	33	47%	0.474	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	161.6	179.2	32.1	-35.3	0	0	0	112.2	P208 I228	P206-P208 VanDerWaalsContact O-CD 3.28Å; P206-P208 WeakPolarHBondContact O-CD 3.43Å; P206-I228 WeakPolarHBondContact CA-O 3.21Å
207	V	98.5	Very high	95.4	Very high	5 Å²	5	32 Å²	32	3%	0.03	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-63.9	121	161.8	177.8	0	0	0	0	107.8	A209 L222 L227 P232 L235 L251	V207-A209 PolarHBondContact O-N 3.26Å; V207-L222 HydrophobicContact CG1-CD1 4.41Å; V207-L227 HydrophobicContact CG2-CB 4.37Å; V207-L227 HydrophobicContact CG2-CD1 3.72Å; V207-L227 HydrophobicContact CG2-CD2 4.25Å; V207-L227 HydrophobicContact CG2-CG 4.34Å; V207-P232 HydrophobicContact CB-CG 4.06Å; V207-P232 HydrophobicContact CG1-CG 3.82Å; V207-L235 HydrophobicContact CG1-CD1 4.17Å; V207-L251 HydrophobicContact CG2-CD2 3.8Å
208	P	98.3	Very high	95.5	Very high	6 Å²	6	38.1 Å²	38.1	4%	0.039	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-65.8	125.9	-177.1	-21.8	33.1	0	0	0	111.9	V182 P184 P206 E210 L211	V182-P208 HydrophobicContact CB-CG 4.31Å; V182-P208 HydrophobicContact CG1-CG 3.99Å; V182-P208 WeakPolarHBondContact O-CG 3.42Å; P184-P208 HydrophobicContact CB-CB 4.14Å; P184-P208 HydrophobicContact CG-CB 4.11Å; P184-P208 HydrophobicContact CG-CG 4.41Å; P206-P208 VanDerWaalsContact O-CD 3.28Å; P206-P208 WeakPolarHBondContact O-CD 3.43Å; P208-E210 PolarHBondContact O-N 2.96Å; P208-L211 HydrophobicContact CB-CG 4.25Å; P208-L211 HydrophobicContact CG-CD1 4.43Å; P208-L211 WeakPolarHBondContact O-CB 3.39Å; P208-L211 PolarHBondContact O-N 3.42Å
209	A	98.3	Very high	95.9	Very high	47 Å²	47	39.2 Å²	39.2	39%	0.388	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-65	-25.9	-178.6	0	0	0	0	0	112.3	V207 L211 G212 P232 S234	V207-A209 PolarHBondContact O-N 3.26Å; A209-L211 PolarHBondContact O-N 2.91Å; A209-G212 PolarHBondContact O-N 2.94Å; A209-P232 HydrophobicContact CB-CB 4.05Å; A209-S234 WeakPolarHBondContact CA-OG 3.23Å; A209-S234 WeakPolarHBondContact O-CB 3.27Å; A209-S234 PolarHBondContact O-OG 2.98Å
210	E	98.3	Very high	96.4	Very high	84 Å²	84	37.1 Å²	37.1	39%	0.393	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-61.5	-25.4	177.2	-67.3	76.4	-173.8	0	0	112.7	P184 G187 P208 G212 N213	P184-E210 HydrophobicContact CB-CB 4.48Å; P184-E210 HydrophobicContact CB-CG 4.18Å; P184-E210 WeakPolarHBondContact O-CB 3.44Å; G187-E210 WeakPolarHBondContact CA-O 3.23Å; P208-E210 PolarHBondContact O-N 2.96Å; E210-G212 PolarHBondContact O-N 2.64Å; E210-N213 VanDerWaalsContact O-CB 3.26Å; E210-N213 WeakPolarHBondContact O-CB 3.46Å; E210-N213 PolarHBondContact O-N 2.62Å
211	L	98.4	Very high	97.2	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-61.6	-26.2	173.8	-64.2	178.9	0	0	0	111.8	L186 L195 P208 A209 N213 L214 L220 L222 L235	L186-L211 HydrophobicContact CB-CD2 4.35Å; L195-L211 HydrophobicContact CD2-CD2 3.76Å; P208-L211 HydrophobicContact CB-CG 4.25Å; P208-L211 HydrophobicContact CG-CD1 4.43Å; P208-L211 WeakPolarHBondContact O-CB 3.39Å; P208-L211 PolarHBondContact O-N 3.42Å; A209-L211 PolarHBondContact O-N 2.91Å; L211-N213 PolarHBondContact O-N 3.39Å; L211-N213 VanDerWaalsContact O-N 3.14Å; L211-L214 HydrophobicContact CD2-CD1 3.98Å; L211-L214 WeakPolarHBondContact O-CB 3.38Å; L211-L214 WeakPolarHBondContact O-CG 3.42Å; L211-L214 PolarHBondContact O-N 3.19Å; L211-L214 VanDerWaalsContact O-N 3.17Å; L211-L220 HydrophobicContact CD1-CD1 4.29Å; L211-L222 HydrophobicContact CD1-CD1 3.98Å; L211-L235 HydrophobicContact CB-CD2 4.22Å
212	G	97.8	Very high	97.6	Very high	5 Å²	5	38 Å²	38	5%	0.052	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-65.5	-7.4	172.1	0	0	0	0	0	114.8	A209 E210 S234	A209-G212 PolarHBondContact O-N 2.94Å; E210-G212 PolarHBondContact O-N 2.64Å; G212-S234 WeakPolarHBondContact CA-O 3.46Å
213	N	97.6	Very high	97.4	Very high	94 Å²	94	37.8 Å²	37.8	50%	0.503	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-85.6	-9.7	174.3	-62.9	-25.6	0	0	0	113.2	E210 L211 S215	E210-N213 VanDerWaalsContact O-CB 3.26Å; E210-N213 WeakPolarHBondContact O-CB 3.46Å; E210-N213 PolarHBondContact O-N 2.62Å; L211-N213 PolarHBondContact O-N 3.39Å; L211-N213 VanDerWaalsContact O-N 3.14Å; N213-S215 VanDerWaalsContact C-N 3.32Å; N213-S215 PolarHBondContact O-N 3.24Å
214	L	98.1	Very high	97.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.204	C	C	.	.			trans	-80.5	71.1	-175.1	-60	178.7	0	0	0	111.7	G187 V189 L192 L211 A216 L217 L238	G187-L214 WeakPolarHBondContact O-CD2 3.41Å; V189-L214 VanDerWaalsContact O-CD2 3.29Å; V189-L214 WeakPolarHBondContact O-CD2 3.38Å; L192-L214 HydrophobicContact CB-CD1 4.47Å; L192-L214 HydrophobicContact CD1-CD1 4.27Å; L211-L214 HydrophobicContact CD2-CD1 3.98Å; L211-L214 WeakPolarHBondContact O-CB 3.38Å; L211-L214 WeakPolarHBondContact O-CG 3.42Å; L211-L214 PolarHBondContact O-N 3.19Å; L211-L214 VanDerWaalsContact O-N 3.17Å; L214-A216 PolarHBondContact O-N 3.48Å; L214-L217 HydrophobicContact CB-CB 3.86Å; L214-L217 HydrophobicContact CB-CD2 4.28Å; L214-L217 HydrophobicContact CB-CG 4.49Å; L214-L217 HydrophobicContact CD1-CD1 4.22Å; L214-L217 HydrophobicContact CD1-CD2 4.15Å; L214-L217 WeakPolarHBondContact O-CB 3.19Å; L214-L217 PolarHBondContact O-N 3.15Å; L214-L238 HydrophobicContact CB-CD2 4.32Å; L214-L238 WeakPolarHBondContact O-CD2 3.12Å
215	S	96	Very high	96.8	Very high	82 Å²	82	32.9 Å²	32.9	57%	0.573	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-17.8	-173.8	62.6	0	0	0	0	115.7	N213 N240	N213-S215 VanDerWaalsContact C-N 3.32Å; N213-S215 PolarHBondContact O-N 3.24Å; S215-N240 PolarHBondContact O-ND2 3.27Å
216	A	97.9	Very high	96.5	Very high	25 Å²	25	36.4 Å²	36.4	21%	0.207	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-6.8	175.6	0	0	0	0	0	113.7	L192 R193 L214	L192-A216 CarbonylContact O-C 3.57Å; R193-A216 HydrophobicContact CG-CB 4.47Å; L214-A216 PolarHBondContact O-N 3.48Å
217	L	98.7	Very high	96.5	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.			trans	-65.2	132.9	-173.7	-158.8	70.6	0	0	0	111.2	L192 L195 L214 L220 L238 N240 L241	L192-L217 HydrophobicContact CB-CD1 4.15Å; L192-L217 WeakPolarHBondContact O-CA 3.16Å; L192-L217 PolarHBondContact O-N 2.95Å; L195-L217 HydrophobicContact CB-CD1 4.13Å; L214-L217 HydrophobicContact CB-CB 3.86Å; L214-L217 HydrophobicContact CB-CD2 4.28Å; L214-L217 HydrophobicContact CB-CG 4.49Å; L214-L217 HydrophobicContact CD1-CD1 4.22Å; L214-L217 HydrophobicContact CD1-CD2 4.15Å; L214-L217 WeakPolarHBondContact O-CB 3.19Å; L214-L217 PolarHBondContact O-N 3.15Å; L217-L220 HydrophobicContact CD2-CB 3.85Å; L217-L220 HydrophobicContact CD2-CD1 4.28Å; L217-L220 HydrophobicContact CD2-CD2 4.25Å; L217-L220 HydrophobicContact CD2-CG 4.35Å; L217-L238 HydrophobicContact CB-CD2 4.43Å; L217-L238 HydrophobicContact CD2-CD1 4.14Å; L217-N240 CarbonylContact O-C 3.02Å; L217-L241 HydrophobicContact CB-CD1 4.35Å; L217-L241 HydrophobicContact CD2-CD1 4.05Å; L217-L241 HydrophobicContact CG-CD1 4.02Å; L217-L241 WeakPolarHBondContact O-CA 3.25Å; L217-L241 PolarHBondContact O-N 3.19Å
218	R	98.7	Very high	96.5	Very high	128 Å²	128	36.1 Å²	36.1	48%	0.483	20%	0.197	S	C	.	.			trans	-114.2	-41.2	178.4	-62.6	-176	178.2	-173	-3.6	111.5	R193 N240 L241 T242 D243	R193-R218 WeakPolarHBondContact O-CA 3.25Å; R193-R218 WeakPolarHBondContact O-CB 3.47Å; R193-R218 PolarHBondContact O-N 3.32Å; R218-N240 WeakPolarHBondContact CA-O 3.11Å; R218-L241 WeakPolarHBondContact O-CD1 3.31Å; R218-T242 PolarHBondContact O-N 3.42Å; R218-T242 PolarHBondContact O-OG1 2.91Å; R218-D243 PolarHBondContact O-N 2.88Å
219	V	98.7	Very high	96.5	Very high	26 Å²	26	37.2 Å²	37.2	16%	0.158	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	123.8	-178.4	-177.4	0	0	0	0	109.2	R193 E194 L195 W221 D243	R193-V219 PolarHBondContact O-N 3.43Å; E194-V219 HydrophobicContact CB-CB 4.34Å; E194-V219 HydrophobicContact CG-CB 4.08Å; E194-V219 HydrophobicContact CG-CG2 4.11Å; L195-V219 PolarHBondContact N-O 2.94Å; V219-W221 HydrophobicContact CG1-CD2 3.85Å; V219-W221 VanDerWaalsContact CG1-CE2 3.44Å; V219-W221 HydrophobicContact CG1-CG 3.89Å; V219-W221 HydrophobicContact CG1-CZ2 3.97Å; V219-D243 WeakPolarHBondContact CA-O 3.47Å; V219-D243 HydrophobicContact CG1-CB 4.38Å; V219-D243 HydrophobicContact CG2-CB 4.32Å
220	L	98.8	Very high	96.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	104.3	173.2	179.1	56.3	0	0	0	109.8	L195 L211 L217 L222 L235 L241 D243 L244 D245	L195-L220 HydrophobicContact CB-CD1 4.27Å; L195-L220 HydrophobicContact CD2-CD1 4.04Å; L195-L220 HydrophobicContact CG-CD1 4.27Å; L211-L220 HydrophobicContact CD1-CD1 4.29Å; L217-L220 HydrophobicContact CD2-CB 3.85Å; L217-L220 HydrophobicContact CD2-CD1 4.28Å; L217-L220 HydrophobicContact CD2-CD2 4.25Å; L217-L220 HydrophobicContact CD2-CG 4.35Å; L220-L222 HydrophobicContact CD1-CD1 4.01Å; L220-L222 HydrophobicContact CD1-CD2 4.23Å; L220-L222 HydrophobicContact CD1-CG 3.88Å; L220-L222 HydrophobicContact CG-CD1 4.39Å; L220-L222 HydrophobicContact CG-CG 4.35Å; L220-L235 HydrophobicContact CD2-CD2 4.01Å; L220-L241 HydrophobicContact CB-CD1 3.97Å; L220-D243 PolarHBondContact N-O 3.33Å; L220-L244 HydrophobicContact CB-CD1 4.25Å; L220-L244 HydrophobicContact CD2-CD1 3.99Å; L220-L244 HydrophobicContact CG-CD1 4.24Å; L220-D245 PolarHBondContact O-N 2.83Å
221	W	98	Very high	96.6	Very high	91 Å²	91	34.1 Å²	34.1	35%	0.345	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	114.3	179.5	-65.4	-9.1	0	0	0	110.8	L195 N196 L197 S198 V219 D243 D245	L195-W221 PolarHBondContact O-N 2.84Å; N196-W221 HydrophobicContact CB-CB 4.28Å; N196-W221 HydrophobicContact CB-CE3 4.48Å; N196-W221 WeakPolarHBondContact ND2-CZ3 3.47Å; N196-W221 WeakPolarHBondContact OD1-CB 3.44Å; L197-W221 PolarHBondContact N-O 3.13Å; S198-W221 VanDerWaalsContact OG-C 3.29Å; S198-W221 PolarHBondContact OG-O 3.44Å; V219-W221 HydrophobicContact CG1-CD2 3.85Å; V219-W221 VanDerWaalsContact CG1-CE2 3.44Å; V219-W221 HydrophobicContact CG1-CG 3.89Å; V219-W221 HydrophobicContact CG1-CZ2 3.97Å; W221-D243 WeakPolarHBondContact CZ2-OD2 3.17Å; W221-D243 PolarHBondContact NE1-OD1 2.81Å; W221-D243 PolarHBondContact NE1-OD2 3.3Å; W221-D245 HydrophobicContact CB-CB 4.42Å; W221-D245 HydrophobicContact CG-CB 4.12Å
222	L	98.1	Very high	96.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.203	C	C	.	.			trans	-131.3	31.6	179.1	-55	176.3	0	0	0	111.1	V182 L197 V207 L211 L220 C225 L227 D245 L246 N249	V182-L222 HydrophobicContact CG1-CD2 4.29Å; L197-L222 HydrophobicContact CB-CD2 3.84Å; L197-L222 HydrophobicContact CD1-CD2 3.86Å; L197-L222 HydrophobicContact CG-CD2 4.02Å; V207-L222 HydrophobicContact CG1-CD1 4.41Å; L211-L222 HydrophobicContact CD1-CD1 3.98Å; L220-L222 HydrophobicContact CD1-CD1 4.01Å; L220-L222 HydrophobicContact CD1-CD2 4.23Å; L220-L222 HydrophobicContact CD1-CG 3.88Å; L220-L222 HydrophobicContact CG-CD1 4.39Å; L220-L222 HydrophobicContact CG-CG 4.35Å; L222-C225 VanDerWaalsContact C-SG 3.59Å; L222-C225 WeakPolarHBondContact O-CB 3.45Å; L222-C225 PolarHBondContact O-SG 2.91Å; L222-L227 HydrophobicContact CB-CD1 3.74Å; L222-L227 HydrophobicContact CD1-CD1 4.24Å; L222-D245 PolarHBondContact N-O 3.26Å; L222-L246 HydrophobicContact CB-CD2 3.94Å; L222-L246 HydrophobicContact CD1-CD2 3.9Å; L222-L246 HydrophobicContact CG-CD2 4.24Å; L222-N249 PolarHBondContact O-ND2 3.33Å
223	A	88.7	Confident	96.6	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	138	178.4	0	0	0	0	0	111.3	S198 Y199 C225 D245 S247	S198-A223 CarbonylContact C-O 3.52Å; S198-A223 WeakPolarHBondContact CA-O 3.11Å; S198-A223 VanDerWaalsContact CB-O 3.25Å; S198-A223 WeakPolarHBondContact CB-O 3.47Å; S198-A223 PolarHBondContact OG-N 3.35Å; Y199-A223 HydrophobicContact CE2-CB 4.41Å; Y199-A223 PolarHBondContact N-O 3.23Å; A223-C225 VanDerWaalsContact C-N 3.33Å; A223-C225 PolarHBondContact O-N 3.26Å; A223-D245 WeakPolarHBondContact CB-OD2 2.97Å; A223-S247 WeakPolarHBondContact CA-O 3.36Å
224	G	87.2	Confident	96.6	Very high	19 Å²	19	33.3 Å²	33.3	20%	0.196	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	38.3	176.7	0	0	0	0	0	113.8	S247 T248	G224-S247 PolarHBondContact N-O 3.49Å; G224-T248 WeakPolarHBondContact CA-O 3.48Å; G224-T248 PolarHBondContact N-O 3.1Å; G224-T248 VanDerWaalsContact N-O 3.15Å
225	C	90.6	Very high	96.6	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.007	20%	0.201	C	C	.	.	S	Bend	trans	-106.4	15.1	-177.8	-75.1	0	0	0	0	113.2	V182 L197 F202 L222 A223 L227 N249	V182-C225 HydrophobicContact CG2-CB 4.21Å; L197-C225 PolarHBondContact O-SG 2.89Å; L197-C225 VanDerWaalsContact O-SG 3.34Å; F202-C225 HydrophobicContact CD2-CB 3.92Å; F202-C225 HydrophobicContact CE2-CB 4.41Å; L222-C225 VanDerWaalsContact C-SG 3.59Å; L222-C225 WeakPolarHBondContact O-CB 3.45Å; L222-C225 PolarHBondContact O-SG 2.91Å; A223-C225 VanDerWaalsContact C-N 3.33Å; A223-C225 PolarHBondContact O-N 3.26Å; C225-L227 HydrophobicContact CB-CD1 4.11Å; C225-L227 HydrophobicContact CB-CD2 4.42Å; C225-L227 HydrophobicContact CB-CG 3.84Å; C225-L227 PolarHBondContact O-N 3.08Å; C225-N249 PolarHBondContact N-OD1 3.17Å
226	N	92.4	Very high	96.7	Very high	78 Å²	78	30 Å²	30	42%	0.417	18%	0.178	S	C	.	.			trans	56.5	31.9	-177.8	-161.2	21.8	0	0	0	113.3	F202 A204 N249	F202-N226 WeakPolarHBondContact O-CB 3.44Å; F202-N226 PolarHBondContact O-ND2 2.82Å; A204-N226 WeakPolarHBondContact CA-O 3.3Å; A204-N226 PolarHBondContact N-ND2 3.15Å; A204-N226 VanDerWaalsContact N-ND2 3.19Å; N226-N249 PolarHBondContact N-OD1 3.17Å; N226-N249 VanDerWaalsContact N-OD1 3.07Å
227	L	98.3	Very high	96.7	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	138.2	-176.6	-62.8	167.6	0	0	0	111.2	V182 G205 V207 L222 C225 N249 A250 L251	V182-L227 HydrophobicContact CB-CD2 4.28Å; V182-L227 HydrophobicContact CG2-CD2 3.83Å; G205-L227 CarbonylContact O-C 3.58Å; G205-L227 VanDerWaalsContact O-CA 3.31Å; G205-L227 WeakPolarHBondContact O-CA 3.41Å; V207-L227 HydrophobicContact CG2-CB 4.37Å; V207-L227 HydrophobicContact CG2-CD1 3.72Å; V207-L227 HydrophobicContact CG2-CD2 4.25Å; V207-L227 HydrophobicContact CG2-CG 4.34Å; L222-L227 HydrophobicContact CB-CD1 3.74Å; L222-L227 HydrophobicContact CD1-CD1 4.24Å; C225-L227 HydrophobicContact CB-CD1 4.11Å; C225-L227 HydrophobicContact CB-CD2 4.42Å; C225-L227 HydrophobicContact CB-CG 3.84Å; C225-L227 PolarHBondContact O-N 3.08Å; L227-N249 HydrophobicContact CB-CB 3.99Å; L227-N249 PolarHBondContact N-OD1 3.35Å; L227-A250 CarbonylContact O-C 3.57Å; L227-A250 VanDerWaalsContact O-CA 3.31Å; L227-A250 WeakPolarHBondContact O-CA 3.2Å; L227-A250 PolarHBondContact O-N 2.87Å; L227-L251 HydrophobicContact CB-CD2 3.84Å; L227-L251 HydrophobicContact CB-CG 4.32Å; L227-L251 PolarHBondContact O-N 2.91Å
228	I	98.4	Very high	96.7	Very high	70 Å²	70	37.2 Å²	37.2	36%	0.359	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	173.7	178.7	60.3	166	0	0	0	111.4	A204 G205 P206 A250	A204-I228 HydrophobicContact CB-CD1 4.16Å; A204-I228 HydrophobicContact CB-CG1 4.45Å; A204-I228 HydrophobicContact CB-CG2 4.12Å; G205-I228 PolarHBondContact O-N 2.92Å; P206-I228 WeakPolarHBondContact CA-O 3.21Å; I228-A250 HydrophobicContact CG2-CB 3.98Å
229	G	98.3	Very high	96.6	Very high	28 Å²	28	32.4 Å²	32.4	29%	0.289	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	74.8	-165	178.3	0	0	0	0	0	113	L251 T252	G229-L251 CarbonylContact O-C 3.59Å; G229-L251 WeakPolarHBondContact O-CA 3.24Å; G229-T252 WeakPolarHBondContact CA-OG1 3.2Å; G229-T252 PolarHBondContact O-N 3.42Å; G229-T252 PolarHBondContact O-OG1 3.34Å
230	A	98.4	Very high	96.5	Very high	59 Å²	59	35.1 Å²	35.1	49%	0.488	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	151.9	-174.9	0	0	0	0	0	113.1	P232 T252	A230-P232 WeakPolarHBondContact O-CD 3.49Å; A230-T252 VanDerWaalsContact CA-O 3.32Å; A230-T252 WeakPolarHBondContact CA-O 3.43Å
231	I	98.7	Very high	96.5	Very high	7 Å²	7	35.1 Å²	35.1	4%	0.036	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-66.9	121.7	167.6	-58.9	171.8	0	0	0	108.1	A233 L235 L246 L251 P256 L270 L275	I231-A233 PolarHBondContact O-N 2.98Å; I231-L235 HydrophobicContact CG2-CD1 3.98Å; I231-L246 HydrophobicContact CD1-CD1 4.26Å; I231-L246 HydrophobicContact CG1-CD1 4.15Å; I231-L246 HydrophobicContact CG2-CD1 4.06Å; I231-L251 HydrophobicContact CD1-CD1 4.49Å; I231-L251 HydrophobicContact CG1-CD1 4.05Å; I231-P256 HydrophobicContact CB-CG 4.14Å; I231-P256 HydrophobicContact CG2-CG 3.86Å; I231-L270 HydrophobicContact CD1-CD1 4.02Å; I231-L270 HydrophobicContact CD1-CD2 3.97Å; I231-L275 HydrophobicContact CD1-CD1 3.98Å; I231-L275 HydrophobicContact CD1-CD2 3.75Å; I231-L275 HydrophobicContact CG1-CD2 4.09Å
232	P	98.4	Very high	96.6	Very high	22 Å²	22	33 Å²	33	14%	0.143	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-72.4	132.5	-175.6	25.4	-31.1	0	0	0	111.5	V207 A209 A230 S234 L235	V207-P232 HydrophobicContact CB-CG 4.06Å; V207-P232 HydrophobicContact CG1-CG 3.82Å; A209-P232 HydrophobicContact CB-CB 4.05Å; A230-P232 WeakPolarHBondContact O-CD 3.49Å; P232-S234 PolarHBondContact O-N 2.81Å; P232-L235 HydrophobicContact CG-CD1 4.35Å; P232-L235 HydrophobicContact CG-CG 4.11Å; P232-L235 PolarHBondContact O-N 3.05Å; P232-L235 VanDerWaalsContact O-N 3.09Å
233	A	98.4	Very high	96.6	Very high	45 Å²	45	34.7 Å²	34.7	37%	0.372	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-59.4	-20.1	178.8	0	0	0	0	0	113.8	I231 L235 G236 P256 E258	I231-A233 PolarHBondContact O-N 2.98Å; A233-L235 PolarHBondContact O-N 3.48Å; A233-G236 PolarHBondContact O-N 3.06Å; A233-P256 HydrophobicContact CB-CB 4.24Å; A233-E258 HydrophobicContact CB-CG 4.17Å; A233-E258 WeakPolarHBondContact O-CB 3.45Å
234	S	98.3	Very high	97	Very high	16 Å²	16	34.8 Å²	34.8	11%	0.112	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-61.9	-25.9	175.5	57.9	0	0	0	0	113.2	A209 G212 P232 G236 R237	A209-S234 WeakPolarHBondContact CA-OG 3.23Å; A209-S234 WeakPolarHBondContact O-CB 3.27Å; A209-S234 PolarHBondContact O-OG 2.98Å; G212-S234 WeakPolarHBondContact CA-O 3.46Å; P232-S234 PolarHBondContact O-N 2.81Å; S234-G236 PolarHBondContact O-N 3.04Å; S234-R237 VanDerWaalsContact O-CB 3.28Å; S234-R237 WeakPolarHBondContact O-CB 3.28Å; S234-R237 WeakPolarHBondContact O-CG 3.29Å; S234-R237 PolarHBondContact O-N 2.78Å
235	L	98.4	Very high	97.6	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.026	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-61.2	-31.3	176.3	-66.6	-175.8	0	0	0	112.3	V207 L211 L220 I231 P232 A233 R237 L238 L246 L262	V207-L235 HydrophobicContact CG1-CD1 4.17Å; L211-L235 HydrophobicContact CB-CD2 4.22Å; L220-L235 HydrophobicContact CD2-CD2 4.01Å; I231-L235 HydrophobicContact CG2-CD1 3.98Å; P232-L235 HydrophobicContact CG-CD1 4.35Å; P232-L235 HydrophobicContact CG-CG 4.11Å; P232-L235 PolarHBondContact O-N 3.05Å; P232-L235 VanDerWaalsContact O-N 3.09Å; A233-L235 PolarHBondContact O-N 3.48Å; L235-R237 PolarHBondContact O-N 3.44Å; L235-L238 HydrophobicContact CB-CD1 4.5Å; L235-L238 HydrophobicContact CD2-CD1 3.91Å; L235-L238 WeakPolarHBondContact O-CB 3.33Å; L235-L238 VanDerWaalsContact O-CG 3.23Å; L235-L238 WeakPolarHBondContact O-CG 3.1Å; L235-L238 PolarHBondContact O-N 2.78Å; L235-L246 HydrophobicContact CD1-CD1 4.18Å; L235-L262 WeakPolarHBondContact O-CD2 3.16Å
236	G	97.6	Very high	97.9	Very high	8 Å²	8	34.9 Å²	34.9	8%	0.082	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-65.2	-2.8	175.6	0	0	0	0	0	114.9	A233 S234 E258 R261	A233-G236 PolarHBondContact O-N 3.06Å; S234-G236 PolarHBondContact O-N 3.04Å; G236-E258 VanDerWaalsContact CA-O 3.24Å; G236-E258 WeakPolarHBondContact CA-O 3.35Å; G236-R261 WeakPolarHBondContact O-CB 3.39Å
237	R	97.6	Very high	98	Very high	177 Å²	177	31.1 Å²	31.1	67%	0.668	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-83.2	-11.6	171.8	-60.6	176.1	-176.8	166.1	1.3	113.2	S234 L235 G239	S234-R237 VanDerWaalsContact O-CB 3.28Å; S234-R237 WeakPolarHBondContact O-CB 3.28Å; S234-R237 WeakPolarHBondContact O-CG 3.29Å; S234-R237 PolarHBondContact O-N 2.78Å; L235-R237 PolarHBondContact O-N 3.44Å; R237-G239 VanDerWaalsContact C-N 3.26Å; R237-G239 PolarHBondContact O-N 3.31Å
238	L	98.2	Very high	97.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.195	C	C	.	.			trans	-78.8	70.1	-173.9	-58.5	174.5	0	0	0	111.3	L214 L217 L235 N240 L241 L262	L214-L238 HydrophobicContact CB-CD2 4.32Å; L214-L238 WeakPolarHBondContact O-CD2 3.12Å; L217-L238 HydrophobicContact CB-CD2 4.43Å; L217-L238 HydrophobicContact CD2-CD1 4.14Å; L235-L238 HydrophobicContact CB-CD1 4.5Å; L235-L238 HydrophobicContact CD2-CD1 3.91Å; L235-L238 WeakPolarHBondContact O-CB 3.33Å; L235-L238 VanDerWaalsContact O-CG 3.23Å; L235-L238 WeakPolarHBondContact O-CG 3.1Å; L235-L238 PolarHBondContact O-N 2.78Å; L238-N240 PolarHBondContact O-N 3.08Å; L238-L241 HydrophobicContact CB-CB 3.86Å; L238-L241 HydrophobicContact CB-CD2 4.33Å; L238-L241 HydrophobicContact CD1-CD1 4.3Å; L238-L241 HydrophobicContact CD1-CD2 4.09Å; L238-L241 WeakPolarHBondContact O-CB 3.5Å; L238-L241 PolarHBondContact O-N 2.91Å; L238-L262 HydrophobicContact CB-CD2 3.97Å; L238-L262 VanDerWaalsContact O-CD2 3.3Å; L238-L262 WeakPolarHBondContact O-CD2 3.43Å
239	G	96.3	Very high	97.2	Very high	26 Å²	26	30.3 Å²	30.3	27%	0.268	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.9	-174.2	0	0	0	0	0	115.7	R237 T263 S264	R237-G239 VanDerWaalsContact C-N 3.26Å; R237-G239 PolarHBondContact O-N 3.31Å; G239-T263 PolarHBondContact O-OG1 3.36Å; G239-S264 VanDerWaalsContact O-CB 3.3Å; G239-S264 WeakPolarHBondContact O-CB 3.37Å; G239-S264 PolarHBondContact O-N 3.32Å; G239-S264 PolarHBondContact O-OG 3.18Å; G239-S264 VanDerWaalsContact O-OG 3.07Å
240	N	98.4	Very high	97.1	Very high	84 Å²	84	30.9 Å²	30.9	45%	0.449	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-1.8	176.3	-73.9	-34.7	0	0	0	113.9	S215 L217 R218 L238 T242	S215-N240 PolarHBondContact O-ND2 3.27Å; L217-N240 CarbonylContact O-C 3.02Å; R218-N240 WeakPolarHBondContact CA-O 3.11Å; L238-N240 PolarHBondContact O-N 3.08Å; N240-T242 PolarHBondContact O-N 3.42Å
241	L	98.7	Very high	97.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.162	C	C	.	.			trans	-68.2	123.4	-176.7	-160	72.5	0	0	0	109.3	L217 R218 L220 L238 L244 L262 S264 V265	L217-L241 HydrophobicContact CB-CD1 4.35Å; L217-L241 HydrophobicContact CD2-CD1 4.05Å; L217-L241 HydrophobicContact CG-CD1 4.02Å; L217-L241 WeakPolarHBondContact O-CA 3.25Å; L217-L241 PolarHBondContact O-N 3.19Å; R218-L241 WeakPolarHBondContact O-CD1 3.31Å; L220-L241 HydrophobicContact CB-CD1 3.97Å; L238-L241 HydrophobicContact CB-CB 3.86Å; L238-L241 HydrophobicContact CB-CD2 4.33Å; L238-L241 HydrophobicContact CD1-CD1 4.3Å; L238-L241 HydrophobicContact CD1-CD2 4.09Å; L238-L241 WeakPolarHBondContact O-CB 3.5Å; L238-L241 PolarHBondContact O-N 2.91Å; L241-L244 HydrophobicContact CD2-CB 3.82Å; L241-L244 HydrophobicContact CD2-CD1 4.16Å; L241-L244 HydrophobicContact CD2-CD2 4.43Å; L241-L244 HydrophobicContact CD2-CG 4.35Å; L241-L262 HydrophobicContact CB-CD2 4.25Å; L241-L262 HydrophobicContact CD2-CD1 4.17Å; L241-L262 HydrophobicContact CD2-CD2 4.28Å; L241-S264 CarbonylContact O-C 3.55Å; L241-V265 WeakPolarHBondContact O-CA 3.14Å; L241-V265 PolarHBondContact O-N 2.66Å
242	T	98.7	Very high	97.1	Very high	46 Å²	46	30.8 Å²	30.8	28%	0.282	18%	0.179	S	C	.	.			trans	-101.1	-31.6	177.1	56.8	0	0	0	0	111.7	R218 N240 S264 V266 Q267	R218-T242 PolarHBondContact O-N 3.42Å; R218-T242 PolarHBondContact O-OG1 2.91Å; N240-T242 PolarHBondContact O-N 3.42Å; T242-S264 WeakPolarHBondContact CA-O 3.13Å; T242-V266 WeakPolarHBondContact O-CA 3.33Å; T242-V266 WeakPolarHBondContact O-CB 3.5Å; T242-V266 PolarHBondContact O-N 3.16Å; T242-Q267 PolarHBondContact O-N 2.96Å
243	D	98	Very high	97.1	Very high	36 Å²	36	31 Å²	31	19%	0.193	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	119.4	-172.9	-169.2	-27	0	0	0	109.8	R218 V219 L220 W221	R218-D243 PolarHBondContact O-N 2.88Å; V219-D243 WeakPolarHBondContact CA-O 3.47Å; V219-D243 HydrophobicContact CG1-CB 4.38Å; V219-D243 HydrophobicContact CG2-CB 4.32Å; L220-D243 PolarHBondContact N-O 3.33Å; W221-D243 WeakPolarHBondContact CZ2-OD2 3.17Å; W221-D243 PolarHBondContact NE1-OD1 2.81Å; W221-D243 PolarHBondContact NE1-OD2 3.3Å
244	L	98.8	Very high	97.1	Very high	1 Å²	1	32 Å²	32	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	114.5	178.8	175.5	61.3	0	0	0	109.4	L220 L241 L246 I259 L262 Q267 E269	L220-L244 HydrophobicContact CB-CD1 4.25Å; L220-L244 HydrophobicContact CD2-CD1 3.99Å; L220-L244 HydrophobicContact CG-CD1 4.24Å; L241-L244 HydrophobicContact CD2-CB 3.82Å; L241-L244 HydrophobicContact CD2-CD1 4.16Å; L241-L244 HydrophobicContact CD2-CD2 4.43Å; L241-L244 HydrophobicContact CD2-CG 4.35Å; L244-L246 HydrophobicContact CD1-CD1 4.22Å; L244-L246 HydrophobicContact CD1-CD2 4.15Å; L244-L246 HydrophobicContact CD1-CG 3.9Å; L244-L246 HydrophobicContact CG-CG 4.38Å; L244-I259 HydrophobicContact CD2-CD1 3.92Å; L244-I259 HydrophobicContact CD2-CG1 4.41Å; L244-L262 HydrophobicContact CD2-CD1 4.26Å; L244-Q267 PolarHBondContact N-O 2.92Å; L244-Q267 VanDerWaalsContact N-O 3.13Å; L244-E269 PolarHBondContact O-N 3.22Å
245	D	98.1	Very high	97.2	Very high	22 Å²	22	31.3 Å²	31.3	12%	0.118	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	109.7	176.1	-175.9	3.4	0	0	0	111.4	L220 W221 L222 A223 S247 E269	L220-D245 PolarHBondContact O-N 2.83Å; W221-D245 HydrophobicContact CB-CB 4.42Å; W221-D245 HydrophobicContact CG-CB 4.12Å; L222-D245 PolarHBondContact N-O 3.26Å; A223-D245 WeakPolarHBondContact CB-OD2 2.97Å; D245-S247 WeakPolarHBondContact OD1-CB 3.44Å; D245-S247 PolarHBondContact OD1-N 3.24Å; D245-S247 PolarHBondContact OD1-OG 3.21Å; D245-E269 HydrophobicContact CB-CB 4.03Å; D245-E269 HydrophobicContact CB-CG 4.45Å
246	L	98.6	Very high	97.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.187	C	C	.	.			trans	-119.2	18.4	173	-53.8	179.4	0	0	0	111.4	L222 I231 L235 L244 N249 L251 E269 L270 N273	L222-L246 HydrophobicContact CB-CD2 3.94Å; L222-L246 HydrophobicContact CD1-CD2 3.9Å; L222-L246 HydrophobicContact CG-CD2 4.24Å; I231-L246 HydrophobicContact CD1-CD1 4.26Å; I231-L246 HydrophobicContact CG1-CD1 4.15Å; I231-L246 HydrophobicContact CG2-CD1 4.06Å; L235-L246 HydrophobicContact CD1-CD1 4.18Å; L244-L246 HydrophobicContact CD1-CD1 4.22Å; L244-L246 HydrophobicContact CD1-CD2 4.15Å; L244-L246 HydrophobicContact CD1-CG 3.9Å; L244-L246 HydrophobicContact CG-CG 4.38Å; L246-N249 PolarHBondContact O-ND2 3.23Å; L246-L251 HydrophobicContact CB-CD1 3.82Å; L246-L251 HydrophobicContact CD1-CD1 4.32Å; L246-E269 PolarHBondContact N-O 3.19Å; L246-L270 HydrophobicContact CB-CD2 3.81Å; L246-L270 HydrophobicContact CD1-CD2 3.93Å; L246-L270 HydrophobicContact CG-CD2 4.07Å; L246-N273 PolarHBondContact O-ND2 2.85Å
247	S	93	Very high	97.2	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.208	C	C	.	.			trans	-66.5	162.4	-174.1	67	0	0	0	0	113.4	A223 G224 D245 N249 E269 Y271	A223-S247 WeakPolarHBondContact CA-O 3.36Å; G224-S247 PolarHBondContact N-O 3.49Å; D245-S247 WeakPolarHBondContact OD1-CB 3.44Å; D245-S247 PolarHBondContact OD1-N 3.24Å; D245-S247 PolarHBondContact OD1-OG 3.21Å; S247-N249 PolarHBondContact O-N 3.25Å; S247-N249 PolarHBondContact O-ND2 3.03Å; S247-E269 PolarHBondContact N-O 2.89Å; S247-Y271 CarbonylContact C-O 3.57Å; S247-Y271 WeakPolarHBondContact CA-O 3.39Å; S247-Y271 VanDerWaalsContact CB-CD1 3.45Å; S247-Y271 VanDerWaalsContact CB-CZ 3.44Å; S247-Y271 WeakPolarHBondContact CB-O 3.45Å; S247-Y271 WeakPolarHBondContact OG-CE1 3.49Å; S247-Y271 PolarHBondContact OG-OH 3.07Å
248	T	89.8	Confident	97.2	Very high	34 Å²	34	29.1 Å²	29.1	21%	0.209	19%	0.188	C	C	.	.	S	Bend	trans	55.4	54.9	174.7	-56.5	0	0	0	0	112.1	G224 Y271 N272	G224-T248 WeakPolarHBondContact CA-O 3.48Å; G224-T248 PolarHBondContact N-O 3.1Å; G224-T248 VanDerWaalsContact N-O 3.15Å; T248-Y271 PolarHBondContact N-O 2.73Å; T248-N272 VanDerWaalsContact CA-O 3.25Å; T248-N272 WeakPolarHBondContact CA-O 3.41Å; T248-N272 PolarHBondContact N-O 2.73Å; T248-N272 PolarHBondContact OG1-ND2 3.45Å
249	N	91	Very high	97.2	Very high	20 Å²	20	29.5 Å²	29.5	11%	0.107	19%	0.189	C	C	.	.	S	Bend	trans	-134.9	-170.2	176.3	-77.7	-69.7	0	0	0	109.6	L222 C225 N226 L227 L246 S247 L251 N272 N273	L222-N249 PolarHBondContact O-ND2 3.33Å; C225-N249 PolarHBondContact N-OD1 3.17Å; N226-N249 PolarHBondContact N-OD1 3.17Å; N226-N249 VanDerWaalsContact N-OD1 3.07Å; L227-N249 HydrophobicContact CB-CB 3.99Å; L227-N249 PolarHBondContact N-OD1 3.35Å; L246-N249 PolarHBondContact O-ND2 3.23Å; S247-N249 PolarHBondContact O-N 3.25Å; S247-N249 PolarHBondContact O-ND2 3.03Å; N249-L251 HydrophobicContact CB-CD1 4.41Å; N249-L251 HydrophobicContact CB-CG 4.12Å; N249-N272 PolarHBondContact N-O 3.45Å; N249-N273 WeakPolarHBondContact CA-OD1 3.3Å; N249-N273 WeakPolarHBondContact CB-OD1 3.19Å; N249-N273 PolarHBondContact N-OD1 2.96Å; N249-N273 PolarHBondContact O-OD1 3.21Å
250	A	96.3	Very high	97.3	Very high	41 Å²	41	29.5 Å²	29.5	34%	0.339	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	36.1	175.5	0	0	0	0	0	111.5	L227 I228	L227-A250 CarbonylContact O-C 3.57Å; L227-A250 VanDerWaalsContact O-CA 3.31Å; L227-A250 WeakPolarHBondContact O-CA 3.2Å; L227-A250 PolarHBondContact O-N 2.87Å; I228-A250 HydrophobicContact CG2-CB 3.98Å
251	L	98.7	Very high	97.2	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	144.6	178.7	-62.3	168.8	0	0	0	110.9	V207 L227 G229 I231 L246 N249 N273 S274 L275	V207-L251 HydrophobicContact CG2-CD2 3.8Å; L227-L251 HydrophobicContact CB-CD2 3.84Å; L227-L251 HydrophobicContact CB-CG 4.32Å; L227-L251 PolarHBondContact O-N 2.91Å; G229-L251 CarbonylContact O-C 3.59Å; G229-L251 WeakPolarHBondContact O-CA 3.24Å; I231-L251 HydrophobicContact CD1-CD1 4.49Å; I231-L251 HydrophobicContact CG1-CD1 4.05Å; L246-L251 HydrophobicContact CB-CD1 3.82Å; L246-L251 HydrophobicContact CD1-CD1 4.32Å; N249-L251 HydrophobicContact CB-CD1 4.41Å; N249-L251 HydrophobicContact CB-CG 4.12Å; L251-N273 HydrophobicContact CB-CB 4.33Å; L251-N273 VanDerWaalsContact CB-OD1 3.27Å; L251-N273 WeakPolarHBondContact CB-OD1 3.43Å; L251-N273 WeakPolarHBondContact CG-OD1 3.46Å; L251-N273 PolarHBondContact N-OD1 2.72Å; L251-S274 CarbonylContact O-C 3.21Å; L251-S274 WeakPolarHBondContact O-CA 3.3Å; L251-S274 VanDerWaalsContact O-CB 3.27Å; L251-S274 WeakPolarHBondContact O-CB 3.16Å; L251-S274 PolarHBondContact O-N 3.15Å; L251-L275 HydrophobicContact CB-CD2 3.98Å; L251-L275 PolarHBondContact O-N 3.04Å
252	T	98.6	Very high	97.2	Very high	64 Å²	64	33 Å²	33	39%	0.393	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	178.6	-174.4	55.3	0	0	0	0	110.7	G229 A230	G229-T252 WeakPolarHBondContact CA-OG1 3.2Å; G229-T252 PolarHBondContact O-N 3.42Å; G229-T252 PolarHBondContact O-OG1 3.34Å; A230-T252 VanDerWaalsContact CA-O 3.32Å; A230-T252 WeakPolarHBondContact CA-O 3.43Å
253	G	98.5	Very high	97.1	Very high	26 Å²	26	35.1 Å²	35.1	27%	0.268	20%	0.204	S	C	.	.	S	Bend	trans	74.6	-171.2	-178.2	0	0	0	0	0	112.6	L275 T276	G253-L275 CarbonylContact O-C 3.47Å; G253-L275 WeakPolarHBondContact O-CA 3.33Å; G253-T276 VanDerWaalsContact C-OG1 3.28Å; G253-T276 PolarHBondContact O-N 3.04Å; G253-T276 PolarHBondContact O-OG1 3.25Å; G253-T276 VanDerWaalsContact O-OG1 3.1Å
254	S	98.5	Very high	97.1	Very high	65 Å²	65	35.3 Å²	35.3	46%	0.455	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-86.1	152.9	-178.3	-54	0	0	0	0	112.5	P256 T276	S254-P256 WeakPolarHBondContact O-CD 3.46Å; S254-T276 VanDerWaalsContact CA-O 3.27Å; S254-T276 WeakPolarHBondContact CA-O 3.46Å
255	I	98.7	Very high	97.1	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-62.3	122.2	165.1	-59	171.5	0	0	0	107.5	I259 L270 L275 P280 L294 L299	I255-I259 HydrophobicContact CG2-CD1 4.23Å; I255-I259 HydrophobicContact CG2-CG2 3.85Å; I255-L270 HydrophobicContact CD1-CD1 4.21Å; I255-L270 HydrophobicContact CG1-CD1 4.25Å; I255-L270 HydrophobicContact CG2-CD1 4.25Å; I255-L275 HydrophobicContact CG1-CD1 4.11Å; I255-P280 HydrophobicContact CB-CG 4Å; I255-P280 HydrophobicContact CG2-CG 3.94Å; I255-P280 VanDerWaalsContact O-CG 3.27Å; I255-P280 WeakPolarHBondContact O-CG 3.27Å; I255-L294 HydrophobicContact CD1-CD1 3.94Å; I255-L294 HydrophobicContact CD1-CD2 3.99Å; I255-L294 HydrophobicContact CD1-CG 4.49Å; I255-L299 HydrophobicContact CD1-CD1 4.02Å; I255-L299 HydrophobicContact CD1-CD2 3.85Å; I255-L299 HydrophobicContact CG1-CD2 4.18Å
256	P	98.3	Very high	97.1	Very high	14 Å²	14	36.1 Å²	36.1	9%	0.091	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-67.2	130.8	-176.9	25.5	-33.7	0	0	0	110.5	I231 A233 S254 E258 I259	I231-P256 HydrophobicContact CB-CG 4.14Å; I231-P256 HydrophobicContact CG2-CG 3.86Å; A233-P256 HydrophobicContact CB-CB 4.24Å; S254-P256 WeakPolarHBondContact O-CD 3.46Å; P256-E258 PolarHBondContact O-N 2.95Å; P256-I259 WeakPolarHBondContact O-CB 3.26Å; P256-I259 VanDerWaalsContact O-CG2 3.28Å; P256-I259 WeakPolarHBondContact O-CG2 3.44Å; P256-I259 PolarHBondContact O-N 2.98Å
257	P	98.3	Very high	97.1	Very high	78 Å²	78	38.3 Å²	38.3	51%	0.506	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-57.2	-24.5	178.4	-25.8	34.8	0	0	0	114.2	I259 T260 P280	P257-I259 PolarHBondContact O-N 3.49Å; P257-I259 VanDerWaalsContact O-N 3.11Å; P257-T260 PolarHBondContact O-N 3.36Å; P257-T260 VanDerWaalsContact O-N 3.12Å; P257-T260 PolarHBondContact O-OG1 3.32Å; P257-T260 VanDerWaalsContact O-OG1 3.05Å; P257-P280 HydrophobicContact CB-CB 4.3Å
258	E	98.2	Very high	97.3	Very high	53 Å²	53	38.3 Å²	38.3	25%	0.248	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-57.9	-21.1	174	-70.3	73.8	-165.4	0	0	113.5	A233 G236 P256 T260 R261	A233-E258 HydrophobicContact CB-CG 4.17Å; A233-E258 WeakPolarHBondContact O-CB 3.45Å; G236-E258 VanDerWaalsContact CA-O 3.24Å; G236-E258 WeakPolarHBondContact CA-O 3.35Å; P256-E258 PolarHBondContact O-N 2.95Å; E258-T260 PolarHBondContact O-N 3.2Å; E258-R261 VanDerWaalsContact O-CB 3.25Å; E258-R261 WeakPolarHBondContact O-CB 3.28Å; E258-R261 PolarHBondContact O-N 3.44Å
259	I	98	Very high	97.7	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.036	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-59.2	-28	175.8	-154.2	166.2	0	0	0	112.1	L244 I255 P256 P257 R261 L262 I268 L270 F283	L244-I259 HydrophobicContact CD2-CD1 3.92Å; L244-I259 HydrophobicContact CD2-CG1 4.41Å; I255-I259 HydrophobicContact CG2-CD1 4.23Å; I255-I259 HydrophobicContact CG2-CG2 3.85Å; P256-I259 WeakPolarHBondContact O-CB 3.26Å; P256-I259 VanDerWaalsContact O-CG2 3.28Å; P256-I259 WeakPolarHBondContact O-CG2 3.44Å; P256-I259 PolarHBondContact O-N 2.98Å; P257-I259 PolarHBondContact O-N 3.49Å; P257-I259 VanDerWaalsContact O-N 3.11Å; I259-R261 PolarHBondContact O-N 2.91Å; I259-R261 VanDerWaalsContact O-N 3.11Å; I259-L262 HydrophobicContact CG1-CD1 3.72Å; I259-L262 VanDerWaalsContact O-CG 3.29Å; I259-L262 WeakPolarHBondContact O-CG 3.5Å; I259-L262 PolarHBondContact O-N 2.9Å; I259-I268 HydrophobicContact CD1-CD1 4.49Å; I259-I268 HydrophobicContact CD1-CG2 4.26Å; I259-I268 HydrophobicContact CG1-CD1 4.38Å; I259-L270 HydrophobicContact CD1-CD1 4.02Å; I259-F283 HydrophobicContact CG2-CE2 4.49Å; I259-F283 HydrophobicContact CG2-CZ 4.3Å
260	T	97.5	Very high	98.1	Very high	26 Å²	26	37.7 Å²	37.7	16%	0.16	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-76	7	176.4	77.8	0	0	0	0	113	P257 E258 P280 F283	P257-T260 PolarHBondContact O-N 3.36Å; P257-T260 VanDerWaalsContact O-N 3.12Å; P257-T260 PolarHBondContact O-OG1 3.32Å; P257-T260 VanDerWaalsContact O-OG1 3.05Å; E258-T260 PolarHBondContact O-N 3.2Å; T260-P280 HydrophobicContact CG2-CB 4.23Å; T260-F283 HydrophobicContact CG2-CD2 4.03Å; T260-F283 HydrophobicContact CG2-CE2 4.2Å
261	R	97.3	Very high	98	Very high	157 Å²	157	36.7 Å²	36.7	59%	0.592	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-100.5	-0.7	173.1	-58.4	179.8	-177.8	161.1	6.2	113	G236 E258 I259 T263	G236-R261 WeakPolarHBondContact O-CB 3.39Å; E258-R261 VanDerWaalsContact O-CB 3.25Å; E258-R261 WeakPolarHBondContact O-CB 3.28Å; E258-R261 PolarHBondContact O-N 3.44Å; I259-R261 PolarHBondContact O-N 2.91Å; I259-R261 VanDerWaalsContact O-N 3.11Å; R261-T263 VanDerWaalsContact C-N 3.25Å; R261-T263 PolarHBondContact O-N 3.33Å
262	L	98.1	Very high	97.7	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.22	C	C	.	.			trans	-74.7	73.6	177.2	-60.6	175.7	0	0	0	110.9	L235 L238 L241 L244 I259 S264 V265 L286	L235-L262 WeakPolarHBondContact O-CD2 3.16Å; L238-L262 HydrophobicContact CB-CD2 3.97Å; L238-L262 VanDerWaalsContact O-CD2 3.3Å; L238-L262 WeakPolarHBondContact O-CD2 3.43Å; L241-L262 HydrophobicContact CB-CD2 4.25Å; L241-L262 HydrophobicContact CD2-CD1 4.17Å; L241-L262 HydrophobicContact CD2-CD2 4.28Å; L244-L262 HydrophobicContact CD2-CD1 4.26Å; I259-L262 HydrophobicContact CG1-CD1 3.72Å; I259-L262 VanDerWaalsContact O-CG 3.29Å; I259-L262 WeakPolarHBondContact O-CG 3.5Å; I259-L262 PolarHBondContact O-N 2.9Å; L262-S264 PolarHBondContact O-N 3.25Å; L262-V265 HydrophobicContact CB-CB 3.79Å; L262-V265 HydrophobicContact CB-CG1 3.97Å; L262-V265 HydrophobicContact CD1-CG2 4.45Å; L262-V265 WeakPolarHBondContact O-CB 3.42Å; L262-V265 WeakPolarHBondContact O-CG1 3.48Å; L262-V265 PolarHBondContact O-N 3.44Å; L262-L286 WeakPolarHBondContact O-CD2 3.28Å
263	T	96	Very high	97.6	Very high	91 Å²	91	36.8 Å²	36.8	56%	0.558	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-21.9	-169	48.6	0	0	0	0	115.7	G239 R261	G239-T263 PolarHBondContact O-OG1 3.36Å; R261-T263 VanDerWaalsContact C-N 3.25Å; R261-T263 PolarHBondContact O-N 3.33Å
264	S	98.5	Very high	97.5	Very high	40 Å²	40	37 Å²	37	28%	0.28	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	4.2	177.9	-64.5	0	0	0	0	114	G239 L241 T242 L262 V266	G239-S264 VanDerWaalsContact O-CB 3.3Å; G239-S264 WeakPolarHBondContact O-CB 3.37Å; G239-S264 PolarHBondContact O-N 3.32Å; G239-S264 PolarHBondContact O-OG 3.18Å; G239-S264 VanDerWaalsContact O-OG 3.07Å; L241-S264 CarbonylContact O-C 3.55Å; T242-S264 WeakPolarHBondContact CA-O 3.13Å; L262-S264 PolarHBondContact O-N 3.25Å; S264-V266 PolarHBondContact O-N 3.35Å
265	V	98.8	Very high	97.5	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	18%	0.18	C	C	.	.			trans	-69.1	133.6	-174.1	76.6	0	0	0	0	111.2	L241 L262 Q267 I268 L286 E288 L289	L241-V265 WeakPolarHBondContact O-CA 3.14Å; L241-V265 PolarHBondContact O-N 2.66Å; L262-V265 HydrophobicContact CB-CB 3.79Å; L262-V265 HydrophobicContact CB-CG1 3.97Å; L262-V265 HydrophobicContact CD1-CG2 4.45Å; L262-V265 WeakPolarHBondContact O-CB 3.42Å; L262-V265 WeakPolarHBondContact O-CG1 3.48Å; L262-V265 PolarHBondContact O-N 3.44Å; V265-Q267 WeakPolarHBondContact CG2-O 3.45Å; V265-I268 HydrophobicContact CG1-CD1 4.09Å; V265-I268 HydrophobicContact CG1-CG1 4.43Å; V265-I268 HydrophobicContact CG2-CD1 4.08Å; V265-I268 HydrophobicContact CG2-CG1 3.56Å; V265-L286 HydrophobicContact CG1-CB 4.4Å; V265-L286 HydrophobicContact CG1-CD1 3.78Å; V265-L286 HydrophobicContact CG1-CD2 4.22Å; V265-L286 HydrophobicContact CG1-CG 4.36Å; V265-E288 CarbonylContact O-C 3.38Å; V265-L289 HydrophobicContact CG1-CD1 4.07Å; V265-L289 VanDerWaalsContact O-CA 3.28Å; V265-L289 WeakPolarHBondContact O-CA 3.34Å; V265-L289 PolarHBondContact O-N 3.17Å; V265-L289 VanDerWaalsContact O-N 3.08Å
266	V	98.7	Very high	97.5	Very high	38 Å²	38	36.1 Å²	36.1	23%	0.23	19%	0.194	C	C	.	.			trans	-108.1	-43.3	177.8	178.9	0	0	0	0	109.7	T242 S264 E288 Q290 G291	T242-V266 WeakPolarHBondContact O-CA 3.33Å; T242-V266 WeakPolarHBondContact O-CB 3.5Å; T242-V266 PolarHBondContact O-N 3.16Å; S264-V266 PolarHBondContact O-N 3.35Å; V266-E288 WeakPolarHBondContact CA-O 3.38Å; V266-E288 HydrophobicContact CG2-CB 4.29Å; V266-Q290 HydrophobicContact CG1-CB 3.96Å; V266-Q290 HydrophobicContact CG1-CG 3.98Å; V266-Q290 PolarHBondContact O-N 3.35Å; V266-G291 PolarHBondContact O-N 3.4Å
267	Q	97.8	Very high	97.6	Very high	47 Å²	47	36 Å²	36	22%	0.22	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	134.1	-176.9	-167.6	66.4	30.6	0	0	111.3	T242 L244 V265 E269 G291	T242-Q267 PolarHBondContact O-N 2.96Å; L244-Q267 PolarHBondContact N-O 2.92Å; L244-Q267 VanDerWaalsContact N-O 3.13Å; V265-Q267 WeakPolarHBondContact CG2-O 3.45Å; Q267-E269 HydrophobicContact CG-CG 3.99Å; Q267-E269 PolarHBondContact NE2-OE1 3.39Å; Q267-G291 WeakPolarHBondContact CA-O 3.39Å
268	I	98.8	Very high	97.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	115.3	171.8	-63.3	174.4	0	0	0	109.1	I259 V265 L270 F283 L286 L289 G291 D293	I259-I268 HydrophobicContact CD1-CD1 4.49Å; I259-I268 HydrophobicContact CD1-CG2 4.26Å; I259-I268 HydrophobicContact CG1-CD1 4.38Å; V265-I268 HydrophobicContact CG1-CD1 4.09Å; V265-I268 HydrophobicContact CG1-CG1 4.43Å; V265-I268 HydrophobicContact CG2-CD1 4.08Å; V265-I268 HydrophobicContact CG2-CG1 3.56Å; I268-L270 HydrophobicContact CG2-CD1 4.02Å; I268-L270 HydrophobicContact CG2-CG 3.81Å; I268-F283 HydrophobicContact CD1-CE1 4.01Å; I268-L286 HydrophobicContact CD1-CD1 4.49Å; I268-L289 HydrophobicContact CD1-CD1 4.21Å; I268-L289 HydrophobicContact CG1-CD1 4.33Å; I268-G291 PolarHBondContact N-O 3.09Å; I268-D293 PolarHBondContact O-N 3.32Å
269	E	97.5	Very high	97.6	Very high	40 Å²	40	33.4 Å²	33.4	19%	0.187	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	102	179.5	-59.2	-71.5	170.1	0	0	110	L244 D245 L246 S247 Q267 Y271 D293	L244-E269 PolarHBondContact O-N 3.22Å; D245-E269 HydrophobicContact CB-CB 4.03Å; D245-E269 HydrophobicContact CB-CG 4.45Å; L246-E269 PolarHBondContact N-O 3.19Å; S247-E269 PolarHBondContact N-O 2.89Å; Q267-E269 HydrophobicContact CG-CG 3.99Å; Q267-E269 PolarHBondContact NE2-OE1 3.39Å; E269-Y271 HydrophobicContact CB-CD1 4.31Å; E269-Y271 HydrophobicContact CB-CE1 4.24Å; E269-Y271 VanDerWaalsContact OE2-CD1 3.24Å; E269-Y271 WeakPolarHBondContact OE2-CD1 3.38Å; E269-Y271 VanDerWaalsContact OE2-CE1 3.25Å; E269-Y271 WeakPolarHBondContact OE2-CE1 3.43Å; E269-D293 WeakPolarHBondContact OE2-CB 3.33Å
270	L	98.7	Very high	97.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.			trans	-121.2	11.5	178.3	-57.5	-178.7	0	0	0	112.6	I231 L246 I255 I259 I268 N273 L275 D293 L294 N297	I231-L270 HydrophobicContact CD1-CD1 4.02Å; I231-L270 HydrophobicContact CD1-CD2 3.97Å; L246-L270 HydrophobicContact CB-CD2 3.81Å; L246-L270 HydrophobicContact CD1-CD2 3.93Å; L246-L270 HydrophobicContact CG-CD2 4.07Å; I255-L270 HydrophobicContact CD1-CD1 4.21Å; I255-L270 HydrophobicContact CG1-CD1 4.25Å; I255-L270 HydrophobicContact CG2-CD1 4.25Å; I259-L270 HydrophobicContact CD1-CD1 4.02Å; I268-L270 HydrophobicContact CG2-CD1 4.02Å; I268-L270 HydrophobicContact CG2-CG 3.81Å; L270-N273 PolarHBondContact O-ND2 3.41Å; L270-N273 VanDerWaalsContact O-ND2 3.17Å; L270-L275 HydrophobicContact CB-CD1 3.93Å; L270-L275 HydrophobicContact CD1-CD1 4.38Å; L270-D293 PolarHBondContact N-O 3.47Å; L270-L294 HydrophobicContact CB-CD2 3.85Å; L270-L294 HydrophobicContact CD1-CD2 3.81Å; L270-L294 HydrophobicContact CG-CD2 4.08Å; L270-N297 PolarHBondContact O-ND2 3.03Å
271	Y	95.6	Very high	97.6	Very high	20 Å²	20	37.6 Å²	37.6	8%	0.078	21%	0.208	C	C	.	.			trans	-67.1	161.4	-174.1	71	-90.9	0	0	0	113.6	S247 T248 E269 N273 D293 A295 L955	S247-Y271 CarbonylContact C-O 3.57Å; S247-Y271 WeakPolarHBondContact CA-O 3.39Å; S247-Y271 VanDerWaalsContact CB-CD1 3.45Å; S247-Y271 VanDerWaalsContact CB-CZ 3.44Å; S247-Y271 WeakPolarHBondContact CB-O 3.45Å; S247-Y271 WeakPolarHBondContact OG-CE1 3.49Å; S247-Y271 PolarHBondContact OG-OH 3.07Å; T248-Y271 PolarHBondContact N-O 2.73Å; E269-Y271 HydrophobicContact CB-CD1 4.31Å; E269-Y271 HydrophobicContact CB-CE1 4.24Å; E269-Y271 VanDerWaalsContact OE2-CD1 3.24Å; E269-Y271 WeakPolarHBondContact OE2-CD1 3.38Å; E269-Y271 VanDerWaalsContact OE2-CE1 3.25Å; E269-Y271 WeakPolarHBondContact OE2-CE1 3.43Å; Y271-N273 PolarHBondContact O-ND2 3.04Å; Y271-D293 WeakPolarHBondContact CB-OD1 3.44Å; Y271-D293 HydrophobicContact CD1-CB 4.04Å; Y271-D293 PolarHBondContact N-O 3.41Å; Y271-A295 CarbonylContact C-O 3.22Å; Y271-A295 WeakPolarHBondContact CA-O 3.42Å; Y271-A295 WeakPolarHBondContact CB-O 3.31Å; Y271-L955 HydrophobicContact CE2-CD1 4.16Å
272	N	91.9	Very high	97.6	Very high	55 Å²	55	30.1 Å²	30.1	29%	0.294	18%	0.18	S	C	.	.	S	Bend	trans	55.5	61.7	177.2	-171.7	32.5	0	0	0	112.1	T248 N249 A295 M296	T248-N272 VanDerWaalsContact CA-O 3.25Å; T248-N272 WeakPolarHBondContact CA-O 3.41Å; T248-N272 PolarHBondContact N-O 2.73Å; T248-N272 PolarHBondContact OG1-ND2 3.45Å; N249-N272 PolarHBondContact N-O 3.45Å; N272-A295 PolarHBondContact N-O 2.88Å; N272-M296 VanDerWaalsContact CA-O 3.3Å; N272-M296 WeakPolarHBondContact CA-O 3.4Å; N272-M296 HydrophobicContact CB-CB 4.34Å; N272-M296 HydrophobicContact CB-CE 4.41Å; N272-M296 HydrophobicContact CB-SD 4.5Å; N272-M296 PolarHBondContact N-O 3.41Å
273	N	95.2	Very high	97.6	Very high	12 Å²	12	30.1 Å²	30.1	6%	0.064	18%	0.18	C	C	.	.	S	Bend	trans	-139.4	-170	178.3	-87.5	-73.1	0	0	0	109.6	L246 N249 L251 L270 Y271 L275 M296 N297	L246-N273 PolarHBondContact O-ND2 2.85Å; N249-N273 WeakPolarHBondContact CA-OD1 3.3Å; N249-N273 WeakPolarHBondContact CB-OD1 3.19Å; N249-N273 PolarHBondContact N-OD1 2.96Å; N249-N273 PolarHBondContact O-OD1 3.21Å; L251-N273 HydrophobicContact CB-CB 4.33Å; L251-N273 VanDerWaalsContact CB-OD1 3.27Å; L251-N273 WeakPolarHBondContact CB-OD1 3.43Å; L251-N273 WeakPolarHBondContact CG-OD1 3.46Å; L251-N273 PolarHBondContact N-OD1 2.72Å; L270-N273 PolarHBondContact O-ND2 3.41Å; L270-N273 VanDerWaalsContact O-ND2 3.17Å; Y271-N273 PolarHBondContact O-ND2 3.04Å; N273-L275 HydrophobicContact CB-CD1 4.34Å; N273-L275 HydrophobicContact CB-CG 4.06Å; N273-M296 PolarHBondContact N-O 3.2Å; N273-M296 VanDerWaalsContact N-O 3.15Å; N273-N297 WeakPolarHBondContact CA-OD1 3.41Å; N273-N297 WeakPolarHBondContact CB-OD1 3.27Å; N273-N297 PolarHBondContact O-OD1 3.44Å
274	S	98	Very high	97.7	Very high	30 Å²	30	26.4 Å²	26.4	21%	0.21	16%	0.159	C	C	.	.			trans	-115.5	32.4	172.9	-68.4	0	0	0	0	112.2	L251 N297	L251-S274 CarbonylContact O-C 3.21Å; L251-S274 WeakPolarHBondContact O-CA 3.3Å; L251-S274 VanDerWaalsContact O-CB 3.27Å; L251-S274 WeakPolarHBondContact O-CB 3.16Å; L251-S274 PolarHBondContact O-N 3.15Å; S274-N297 PolarHBondContact N-OD1 3.33Å
275	L	98.8	Very high	97.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.181	C	C	.	.			trans	-64.7	144	179.1	-60.5	168.2	0	0	0	110.5	I231 L251 G253 I255 L270 N273 N297 R298 L299	I231-L275 HydrophobicContact CD1-CD1 3.98Å; I231-L275 HydrophobicContact CD1-CD2 3.75Å; I231-L275 HydrophobicContact CG1-CD2 4.09Å; L251-L275 HydrophobicContact CB-CD2 3.98Å; L251-L275 PolarHBondContact O-N 3.04Å; G253-L275 CarbonylContact O-C 3.47Å; G253-L275 WeakPolarHBondContact O-CA 3.33Å; I255-L275 HydrophobicContact CG1-CD1 4.11Å; L270-L275 HydrophobicContact CB-CD1 3.93Å; L270-L275 HydrophobicContact CD1-CD1 4.38Å; N273-L275 HydrophobicContact CB-CD1 4.34Å; N273-L275 HydrophobicContact CB-CG 4.06Å; L275-N297 HydrophobicContact CB-CB 4.36Å; L275-N297 VanDerWaalsContact CB-OD1 3.25Å; L275-N297 WeakPolarHBondContact CB-OD1 3.34Å; L275-N297 WeakPolarHBondContact CG-OD1 3.37Å; L275-N297 PolarHBondContact N-OD1 3.27Å; L275-R298 CarbonylContact O-C 3.51Å; L275-R298 WeakPolarHBondContact O-CA 3.15Å; L275-R298 WeakPolarHBondContact O-CB 3.47Å; L275-R298 PolarHBondContact O-N 3.4Å; L275-L299 HydrophobicContact CB-CD2 4.08Å; L275-L299 PolarHBondContact O-N 3.32Å
276	T	98.7	Very high	97.5	Very high	49 Å²	49	32.7 Å²	32.7	30%	0.301	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	176.2	-172.2	54	0	0	0	0	111	G253 S254 R298	G253-T276 VanDerWaalsContact C-OG1 3.28Å; G253-T276 PolarHBondContact O-N 3.04Å; G253-T276 PolarHBondContact O-OG1 3.25Å; G253-T276 VanDerWaalsContact O-OG1 3.1Å; S254-T276 VanDerWaalsContact CA-O 3.27Å; S254-T276 WeakPolarHBondContact CA-O 3.46Å; T276-R298 HydrophobicContact CG2-CB 3.94Å
277	G	98.6	Very high	97.5	Very high	10 Å²	10	33.2 Å²	33.2	10%	0.103	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.6	-177.3	176.6	0	0	0	0	0	113.6	L299 N300	G277-L299 WeakPolarHBondContact O-CA 3.29Å; G277-N300 VanDerWaalsContact CA-OD1 3.28Å; G277-N300 WeakPolarHBondContact CA-OD1 3.15Å; G277-N300 PolarHBondContact O-N 2.86Å; G277-N300 PolarHBondContact O-OD1 2.89Å
278	P	98.4	Very high	97.5	Very high	73 Å²	73	34.5 Å²	34.5	47%	0.474	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	151.6	-178.1	31.5	-35	0	0	0	112.7	P280 N300	P278-P280 WeakPolarHBondContact O-CD 3.46Å; P278-N300 VanDerWaalsContact CA-O 3.27Å; P278-N300 WeakPolarHBondContact CA-O 3.13Å
279	I	98.7	Very high	97.5	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.026	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-62.4	126.7	164.8	-60.7	172.3	0	0	0	107.6	F283 L294 L299 P304 F307 L318 L323	I279-F283 HydrophobicContact CG2-CD2 4.21Å; I279-F283 HydrophobicContact CG2-CE2 3.9Å; I279-L294 HydrophobicContact CD1-CD1 4.15Å; I279-L294 HydrophobicContact CG1-CD1 4.09Å; I279-L294 HydrophobicContact CG2-CD1 4.28Å; I279-L299 HydrophobicContact CG1-CD1 4.23Å; I279-P304 HydrophobicContact CB-CG 4.11Å; I279-P304 HydrophobicContact CG2-CG 4.01Å; I279-P304 VanDerWaalsContact O-CG 3.24Å; I279-P304 WeakPolarHBondContact O-CG 3.44Å; I279-F307 HydrophobicContact CG2-CD2 3.87Å; I279-F307 HydrophobicContact CG2-CE2 3.69Å; I279-L318 HydrophobicContact CD1-CD1 4.11Å; I279-L318 HydrophobicContact CD1-CD2 4.04Å; I279-L323 HydrophobicContact CD1-CD1 4.08Å; I279-L323 HydrophobicContact CD1-CD2 3.82Å; I279-L323 HydrophobicContact CG1-CD2 4.14Å
280	P	98.2	Very high	97.5	Very high	11 Å²	11	35.8 Å²	35.8	7%	0.071	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-61.9	145	-179.7	-25.5	34.2	0	0	0	113.7	I255 P257 T260 P278 F283	I255-P280 HydrophobicContact CB-CG 4Å; I255-P280 HydrophobicContact CG2-CG 3.94Å; I255-P280 VanDerWaalsContact O-CG 3.27Å; I255-P280 WeakPolarHBondContact O-CG 3.27Å; P257-P280 HydrophobicContact CB-CB 4.3Å; T260-P280 HydrophobicContact CG2-CB 4.23Å; P278-P280 WeakPolarHBondContact O-CD 3.46Å; P280-F283 WeakPolarHBondContact O-CD2 3.38Å
281	V	98.2	Very high	97.5	Very high	109 Å²	109	35.8 Å²	35.8	66%	0.661	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	135.9	170.2	178.5	0	0	0	0	109.4	P304 D306	V281-P304 HydrophobicContact CG2-CB 4.25Å; V281-D306 WeakPolarHBondContact CG1-OD1 3.47Å
282	G	97.7	Very high	97.6	Very high	1 Å²	1	35 Å²	35	1%	0.01	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	129.2	-5.5	175.6	0	0	0	0	0	115.5	G284 K285 D306	G282-G284 PolarHBondContact O-N 2.77Å; G282-K285 WeakPolarHBondContact O-CB 3.24Å; G282-K285 PolarHBondContact O-N 3.38Å; G282-K285 VanDerWaalsContact O-N 3.09Å; G282-D306 WeakPolarHBondContact CA-OD2 3.09Å; G282-D306 PolarHBondContact N-OD1 3.28Å; G282-D306 PolarHBondContact N-OD2 2.78Å
283	F	97.9	Very high	97.9	Very high	1 Å²	1	33 Å²	33	0%	0.004	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-57.5	-32.8	176.3	-83.4	-98.5	0	0	0	112	I259 T260 I268 I279 P280 K285 L286 L289 V292 D306 F307	I259-F283 HydrophobicContact CG2-CE2 4.49Å; I259-F283 HydrophobicContact CG2-CZ 4.3Å; T260-F283 HydrophobicContact CG2-CD2 4.03Å; T260-F283 HydrophobicContact CG2-CE2 4.2Å; I268-F283 HydrophobicContact CD1-CE1 4.01Å; I279-F283 HydrophobicContact CG2-CD2 4.21Å; I279-F283 HydrophobicContact CG2-CE2 3.9Å; P280-F283 WeakPolarHBondContact O-CD2 3.38Å; F283-K285 PolarHBondContact O-N 3.03Å; F283-L286 HydrophobicContact CD1-CD1 4.19Å; F283-L286 WeakPolarHBondContact O-CB 3.17Å; F283-L286 PolarHBondContact O-N 3.39Å; F283-L286 VanDerWaalsContact O-N 3.1Å; F283-L289 HydrophobicContact CD1-CD2 3.94Å; F283-V292 HydrophobicContact CD1-CG2 4.1Å; F283-V292 HydrophobicContact CE1-CG1 4.18Å; F283-V292 HydrophobicContact CE1-CG2 4.03Å; F283-D306 PolarHBondContact N-OD2 2.93Å; F283-F307 HydrophobicContact CB-CD2 3.86Å; F283-F307 HydrophobicContact CB-CE2 4.18Å; F283-F307 HydrophobicContact CB-CG 4.47Å; F283-F307 HydrophobicContact CD1-CD2 4.46Å; F283-F307 AromaticContact CD1-CE2 3.93Å; F283-F307 HydrophobicContact CD1-CE2 3.93Å; F283-F307 HydrophobicContact CD2-CD2 4.02Å; F283-F307 AromaticContact CD2-CE2 3.96Å; F283-F307 HydrophobicContact CD2-CE2 3.96Å; F283-F307 HydrophobicContact CE1-CE2 4.28Å; F283-F307 HydrophobicContact CE2-CE2 4.31Å; F283-F307 AromaticContact CG-CD2 3.86Å; F283-F307 HydrophobicContact CG-CD2 3.86Å; F283-F307 AromaticContact CG-CE2 3.75Å; F283-F307 HydrophobicContact CG-CE2 3.75Å; F283-F307 HydrophobicContact CZ-CE2 4.47Å
284	G	96.8	Very high	98.1	Very high	12 Å²	12	32.4 Å²	32.4	12%	0.124	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-61.3	-17.8	177.9	0	0	0	0	0	114.7	G282 D306	G282-G284 PolarHBondContact O-N 2.77Å; G284-D306 WeakPolarHBondContact CA-O 3.49Å; G284-D306 PolarHBondContact N-O 2.78Å; G284-D306 PolarHBondContact N-OD2 2.61Å; G284-D306 VanDerWaalsContact N-OD2 3.09Å
285	K	96	Very high	98	Very high	172 Å²	172	31 Å²	31	75%	0.748	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-86.2	-8.9	-179.7	-59.4	177	-177.1	172	0	113.5	G282 F283 A287	G282-K285 WeakPolarHBondContact O-CB 3.24Å; G282-K285 PolarHBondContact O-N 3.38Å; G282-K285 VanDerWaalsContact O-N 3.09Å; F283-K285 PolarHBondContact O-N 3.03Å; K285-A287 PolarHBondContact O-N 2.95Å
286	L	98.1	Very high	97.8	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	19%	0.193	C	C	.	.			trans	-83.2	94.1	-175.7	-59.5	176.8	0	0	0	109.8	L262 V265 I268 F283 E288 L289	L262-L286 WeakPolarHBondContact O-CD2 3.28Å; V265-L286 HydrophobicContact CG1-CB 4.4Å; V265-L286 HydrophobicContact CG1-CD1 3.78Å; V265-L286 HydrophobicContact CG1-CD2 4.22Å; V265-L286 HydrophobicContact CG1-CG 4.36Å; I268-L286 HydrophobicContact CD1-CD1 4.49Å; F283-L286 HydrophobicContact CD1-CD1 4.19Å; F283-L286 WeakPolarHBondContact O-CB 3.17Å; F283-L286 PolarHBondContact O-N 3.39Å; F283-L286 VanDerWaalsContact O-N 3.1Å; L286-E288 VanDerWaalsContact C-N 3.26Å; L286-E288 PolarHBondContact O-N 3.01Å; L286-L289 HydrophobicContact CB-CB 3.68Å; L286-L289 HydrophobicContact CB-CD2 4.19Å; L286-L289 HydrophobicContact CD1-CD2 4.02Å; L286-L289 WeakPolarHBondContact O-CB 3.36Å; L286-L289 PolarHBondContact O-N 3.4Å
287	A	97.6	Very high	97.8	Very high	49 Å²	49	32.9 Å²	32.9	41%	0.405	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.2	-170.9	0	0	0	0	0	114.8	K285	K285-A287 PolarHBondContact O-N 2.95Å
288	E	98.6	Very high	97.7	Very high	74 Å²	74	39.9 Å²	39.9	35%	0.346	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-5.4	-178.1	-63.6	-57.9	129.9	0	0	113.6	V265 V266 L286 Q290 K312	V265-E288 CarbonylContact O-C 3.38Å; V266-E288 WeakPolarHBondContact CA-O 3.38Å; V266-E288 HydrophobicContact CG2-CB 4.29Å; L286-E288 VanDerWaalsContact C-N 3.26Å; L286-E288 PolarHBondContact O-N 3.01Å; E288-Q290 PolarHBondContact O-N 3.11Å; E288-K312 IonicContact OE1-NZ 3.18Å; E288-K312 PolarHBondContact OE1-NZ 2.88Å; E288-K312 IonicContact OE2-NZ 3.8Å; E288-K312 PolarHBondContact OE2-NZ 2.97Å
289	L	98.7	Very high	97.8	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.183	C	C	.	.			trans	-66.8	122.9	-173.5	-177.7	73	0	0	0	111.1	V265 I268 F283 L286 V292 A310 K312 L313	V265-L289 HydrophobicContact CG1-CD1 4.07Å; V265-L289 VanDerWaalsContact O-CA 3.28Å; V265-L289 WeakPolarHBondContact O-CA 3.34Å; V265-L289 PolarHBondContact O-N 3.17Å; V265-L289 VanDerWaalsContact O-N 3.08Å; I268-L289 HydrophobicContact CD1-CD1 4.21Å; I268-L289 HydrophobicContact CG1-CD1 4.33Å; F283-L289 HydrophobicContact CD1-CD2 3.94Å; L286-L289 HydrophobicContact CB-CB 3.68Å; L286-L289 HydrophobicContact CB-CD2 4.19Å; L286-L289 HydrophobicContact CD1-CD2 4.02Å; L286-L289 WeakPolarHBondContact O-CB 3.36Å; L286-L289 PolarHBondContact O-N 3.4Å; L289-V292 HydrophobicContact CD1-CG2 3.71Å; L289-V292 HydrophobicContact CD2-CG2 3.65Å; L289-V292 HydrophobicContact CG-CG2 3.98Å; L289-A310 HydrophobicContact CD2-CB 4.26Å; L289-K312 CarbonylContact O-C 3.21Å; L289-L313 HydrophobicContact CD2-CD1 4.04Å; L289-L313 HydrophobicContact CG-CD1 4.13Å; L289-L313 WeakPolarHBondContact O-CA 3.34Å; L289-L313 PolarHBondContact O-N 3.44Å
290	Q	98.3	Very high	97.8	Very high	66 Å²	66	39.6 Å²	39.6	31%	0.308	20%	0.2	S	C	.	.			trans	-111.8	-40.9	178.4	-70.9	169.5	30.4	0	0	111.8	V266 E288 K312 E314 S315	V266-Q290 HydrophobicContact CG1-CB 3.96Å; V266-Q290 HydrophobicContact CG1-CG 3.98Å; V266-Q290 PolarHBondContact O-N 3.35Å; E288-Q290 PolarHBondContact O-N 3.11Å; Q290-K312 WeakPolarHBondContact CA-O 3.42Å; Q290-K312 HydrophobicContact CG-CB 4.11Å; Q290-E314 WeakPolarHBondContact O-CA 3.44Å; Q290-E314 PolarHBondContact O-N 3.2Å; Q290-S315 PolarHBondContact O-N 2.99Å
291	G	97.5	Very high	97.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	140.1	-176.8	0	0	0	0	0	114	V266 Q267 I268 S315	V266-G291 PolarHBondContact O-N 3.4Å; Q267-G291 WeakPolarHBondContact CA-O 3.39Å; I268-G291 PolarHBondContact N-O 3.09Å; G291-S315 WeakPolarHBondContact CA-O 3.07Å
292	V	98.7	Very high	97.8	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	119.4	174.1	177.5	0	0	0	0	109.3	F283 L289 L294 F307 L313 S315 H317	F283-V292 HydrophobicContact CD1-CG2 4.1Å; F283-V292 HydrophobicContact CE1-CG1 4.18Å; F283-V292 HydrophobicContact CE1-CG2 4.03Å; L289-V292 HydrophobicContact CD1-CG2 3.71Å; L289-V292 HydrophobicContact CD2-CG2 3.65Å; L289-V292 HydrophobicContact CG-CG2 3.98Å; V292-L294 HydrophobicContact CG1-CD1 4.04Å; V292-L294 HydrophobicContact CG1-CD2 3.96Å; V292-L294 HydrophobicContact CG1-CG 3.63Å; V292-F307 HydrophobicContact CB-CZ 4.34Å; V292-F307 HydrophobicContact CG1-CZ 3.97Å; V292-L313 HydrophobicContact CG2-CD1 4.36Å; V292-S315 PolarHBondContact N-O 3.34Å; V292-H317 PolarHBondContact O-N 3.05Å
293	D	98.1	Very high	97.8	Very high	14 Å²	14	37.7 Å²	37.7	8%	0.075	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	109	169.6	-163.8	-15.3	0	0	0	110.8	I268 E269 L270 Y271 A295 H317	I268-D293 PolarHBondContact O-N 3.32Å; E269-D293 WeakPolarHBondContact OE2-CB 3.33Å; L270-D293 PolarHBondContact N-O 3.47Å; Y271-D293 WeakPolarHBondContact CB-OD1 3.44Å; Y271-D293 HydrophobicContact CD1-CB 4.04Å; Y271-D293 PolarHBondContact N-O 3.41Å; D293-A295 WeakPolarHBondContact OD1-CB 3.35Å; D293-A295 PolarHBondContact OD1-N 3.5Å; D293-H317 WeakPolarHBondContact CA-O 3.36Å; D293-H317 HydrophobicContact CB-CB 4.08Å; D293-H317 WeakPolarHBondContact OD1-CB 3.38Å; D293-H317 IonicContact OD2-ND1 2.89Å
294	L	98.8	Very high	97.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.			trans	-114.9	14.9	174.8	-49.1	-180	0	0	0	111.4	I255 L270 I279 V292 N297 L299 H317 L318 N321	I255-L294 HydrophobicContact CD1-CD1 3.94Å; I255-L294 HydrophobicContact CD1-CD2 3.99Å; I255-L294 HydrophobicContact CD1-CG 4.49Å; L270-L294 HydrophobicContact CB-CD2 3.85Å; L270-L294 HydrophobicContact CD1-CD2 3.81Å; L270-L294 HydrophobicContact CG-CD2 4.08Å; I279-L294 HydrophobicContact CD1-CD1 4.15Å; I279-L294 HydrophobicContact CG1-CD1 4.09Å; I279-L294 HydrophobicContact CG2-CD1 4.28Å; V292-L294 HydrophobicContact CG1-CD1 4.04Å; V292-L294 HydrophobicContact CG1-CD2 3.96Å; V292-L294 HydrophobicContact CG1-CG 3.63Å; L294-N297 PolarHBondContact O-ND2 3.13Å; L294-L299 HydrophobicContact CB-CD1 3.71Å; L294-L299 HydrophobicContact CD1-CD1 4.16Å; L294-H317 PolarHBondContact N-O 2.98Å; L294-L318 HydrophobicContact CB-CD2 3.79Å; L294-L318 HydrophobicContact CD1-CD2 3.78Å; L294-L318 HydrophobicContact CG-CD2 3.9Å; L294-N321 PolarHBondContact O-ND2 3.02Å
295	A	94.8	Very high	97.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.229	C	C	.	.			trans	-65.8	163.9	-172.5	0	0	0	0	0	113.1	Y271 N272 D293 N297 H317 Y319	Y271-A295 CarbonylContact C-O 3.22Å; Y271-A295 WeakPolarHBondContact CA-O 3.42Å; Y271-A295 WeakPolarHBondContact CB-O 3.31Å; N272-A295 PolarHBondContact N-O 2.88Å; D293-A295 WeakPolarHBondContact OD1-CB 3.35Å; D293-A295 PolarHBondContact OD1-N 3.5Å; A295-N297 PolarHBondContact O-N 2.85Å; A295-N297 PolarHBondContact O-ND2 2.83Å; A295-N297 VanDerWaalsContact O-ND2 3.11Å; A295-H317 PolarHBondContact N-O 3.32Å; A295-Y319 CarbonylContact C-O 3.24Å; A295-Y319 WeakPolarHBondContact CA-O 3.14Å; A295-Y319 HydrophobicContact CB-CD1 3.5Å; A295-Y319 HydrophobicContact CB-CD2 3.75Å; A295-Y319 HydrophobicContact CB-CE1 3.3Å; A295-Y319 HydrophobicContact CB-CE2 3.59Å; A295-Y319 HydrophobicContact CB-CG 3.7Å; A295-Y319 WeakPolarHBondContact CB-O 3.1Å
296	M	95.7	Very high	98	Very high	75 Å²	75	36.7 Å²	36.7	37%	0.369	20%	0.199	S	C	.	.	S	Bend	trans	54.9	54.5	175.1	-56.6	176.7	61.3	0	0	112.2	N272 N273 Y319 A320	N272-M296 VanDerWaalsContact CA-O 3.3Å; N272-M296 WeakPolarHBondContact CA-O 3.4Å; N272-M296 HydrophobicContact CB-CB 4.34Å; N272-M296 HydrophobicContact CB-CE 4.41Å; N272-M296 HydrophobicContact CB-SD 4.5Å; N272-M296 PolarHBondContact N-O 3.41Å; N273-M296 PolarHBondContact N-O 3.2Å; N273-M296 VanDerWaalsContact N-O 3.15Å; M296-Y319 HydrophobicContact CG-CD2 4.42Å; M296-Y319 HydrophobicContact CG-CE2 3.85Å; M296-Y319 PolarHBondContact N-O 3.38Å; M296-Y319 HydrophobicContact SD-CE2 4.3Å; M296-A320 VanDerWaalsContact CA-O 3.29Å; M296-A320 WeakPolarHBondContact CA-O 3.18Å; M296-A320 HydrophobicContact CG-CB 4.07Å; M296-A320 PolarHBondContact N-O 3Å
297	N	97.6	Very high	98	Very high	13 Å²	13	36.6 Å²	36.6	7%	0.07	20%	0.199	C	C	.	.	S	Bend	trans	-134.2	-168.4	177.7	-87.6	-73.3	0	0	0	109.4	L270 N273 S274 L275 L294 A295 L299 A320 N321	L270-N297 PolarHBondContact O-ND2 3.03Å; N273-N297 WeakPolarHBondContact CA-OD1 3.41Å; N273-N297 WeakPolarHBondContact CB-OD1 3.27Å; N273-N297 PolarHBondContact O-OD1 3.44Å; S274-N297 PolarHBondContact N-OD1 3.33Å; L275-N297 HydrophobicContact CB-CB 4.36Å; L275-N297 VanDerWaalsContact CB-OD1 3.25Å; L275-N297 WeakPolarHBondContact CB-OD1 3.34Å; L275-N297 WeakPolarHBondContact CG-OD1 3.37Å; L275-N297 PolarHBondContact N-OD1 3.27Å; L294-N297 PolarHBondContact O-ND2 3.13Å; A295-N297 PolarHBondContact O-N 2.85Å; A295-N297 PolarHBondContact O-ND2 2.83Å; A295-N297 VanDerWaalsContact O-ND2 3.11Å; N297-L299 HydrophobicContact CB-CD1 4.41Å; N297-L299 HydrophobicContact CB-CG 4.04Å; N297-A320 PolarHBondContact N-O 3.41Å; N297-N321 WeakPolarHBondContact CA-OD1 3.45Å; N297-N321 WeakPolarHBondContact CB-OD1 3.24Å; N297-N321 PolarHBondContact N-OD1 3.43Å; N297-N321 PolarHBondContact O-OD1 3.32Å
298	R	98.4	Very high	98	Very high	157 Å²	157	34.4 Å²	34.4	59%	0.592	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	29.7	175.6	-55.7	177.7	-173.8	172.2	2.6	111.1	L275 T276 N321	L275-R298 CarbonylContact O-C 3.51Å; L275-R298 WeakPolarHBondContact O-CA 3.15Å; L275-R298 WeakPolarHBondContact O-CB 3.47Å; L275-R298 PolarHBondContact O-N 3.4Å; T276-R298 HydrophobicContact CG2-CB 3.94Å; R298-N321 PolarHBondContact N-OD1 2.91Å
299	L	98.8	Very high	97.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	143.9	179.6	-60.5	172.2	0	0	0	110.1	I255 L275 G277 I279 L294 N297 N321 S322 L323	I255-L299 HydrophobicContact CD1-CD1 4.02Å; I255-L299 HydrophobicContact CD1-CD2 3.85Å; I255-L299 HydrophobicContact CG1-CD2 4.18Å; L275-L299 HydrophobicContact CB-CD2 4.08Å; L275-L299 PolarHBondContact O-N 3.32Å; G277-L299 WeakPolarHBondContact O-CA 3.29Å; I279-L299 HydrophobicContact CG1-CD1 4.23Å; L294-L299 HydrophobicContact CB-CD1 3.71Å; L294-L299 HydrophobicContact CD1-CD1 4.16Å; N297-L299 HydrophobicContact CB-CD1 4.41Å; N297-L299 HydrophobicContact CB-CG 4.04Å; L299-N321 HydrophobicContact CB-CB 4.4Å; L299-N321 VanDerWaalsContact CB-OD1 3.28Å; L299-N321 WeakPolarHBondContact CB-OD1 3.24Å; L299-N321 WeakPolarHBondContact CG-OD1 3.35Å; L299-N321 PolarHBondContact N-OD1 3.16Å; L299-S322 CarbonylContact O-C 3.35Å; L299-S322 WeakPolarHBondContact O-CA 3.17Å; L299-S322 WeakPolarHBondContact O-CB 3.05Å; L299-S322 PolarHBondContact O-N 3.05Å; L299-L323 HydrophobicContact CB-CD2 4.11Å; L299-L323 PolarHBondContact O-N 3.04Å
300	N	98.5	Very high	97.9	Very high	73 Å²	73	36.7 Å²	36.7	39%	0.39	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	-177.7	-176.2	66	29.1	0	0	0	111.5	G277 P278	G277-N300 VanDerWaalsContact CA-OD1 3.28Å; G277-N300 WeakPolarHBondContact CA-OD1 3.15Å; G277-N300 PolarHBondContact O-N 2.86Å; G277-N300 PolarHBondContact O-OD1 2.89Å; P278-N300 VanDerWaalsContact CA-O 3.27Å; P278-N300 WeakPolarHBondContact CA-O 3.13Å
301	G	98.5	Very high	97.8	Very high	25 Å²	25	37.5 Å²	37.5	26%	0.258	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75.9	-170.4	-176.8	0	0	0	0	0	112.8	L323 T324	G301-L323 CarbonylContact O-C 3.34Å; G301-L323 WeakPolarHBondContact O-CA 3.02Å; G301-T324 VanDerWaalsContact C-OG1 3.23Å; G301-T324 WeakPolarHBondContact CA-OG1 3.2Å; G301-T324 PolarHBondContact O-N 2.75Å; G301-T324 PolarHBondContact O-OG1 2.87Å; G301-T324 VanDerWaalsContact O-OG1 3.06Å
302	A	98.5	Very high	97.9	Very high	53 Å²	53	41 Å²	41	44%	0.438	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	152.7	-178.6	0	0	0	0	0	112.1	P304 T324	A302-P304 WeakPolarHBondContact O-CD 3.48Å; A302-T324 VanDerWaalsContact CA-O 3.28Å; A302-T324 WeakPolarHBondContact CA-O 3.34Å
303	I	98.7	Very high	97.8	Very high	3 Å²	3	41 Å²	41	2%	0.015	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-65.6	126.4	164.7	-56.5	171.4	0	0	0	106.8	F307 F308 L318 L323 P328 L342 L347	I303-F307 HydrophobicContact CG2-CB 3.93Å; I303-F307 HydrophobicContact CG2-CD1 4.23Å; I303-F307 HydrophobicContact CG2-CG 3.99Å; I303-F308 HydrophobicContact CG2-CE2 4.03Å; I303-L318 HydrophobicContact CD1-CD1 3.94Å; I303-L318 HydrophobicContact CG1-CD1 4.16Å; I303-L318 HydrophobicContact CG2-CD1 4.43Å; I303-L323 HydrophobicContact CG1-CD1 4.23Å; I303-P328 HydrophobicContact CB-CG 3.93Å; I303-P328 HydrophobicContact CG2-CG 3.89Å; I303-P328 WeakPolarHBondContact O-CG 3.46Å; I303-L342 HydrophobicContact CD1-CD1 4.41Å; I303-L342 HydrophobicContact CD1-CD2 4.3Å; I303-L347 HydrophobicContact CD1-CD1 4.38Å; I303-L347 HydrophobicContact CD1-CD2 4.03Å; I303-L347 HydrophobicContact CG1-CD2 4.37Å
304	P	98.2	Very high	97.8	Very high	12 Å²	12	44.5 Å²	44.5	8%	0.078	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-58.1	142.9	-178.9	-27.7	35.6	0	0	0	113.2	I279 V281 A302 D306 F307	I279-P304 HydrophobicContact CB-CG 4.11Å; I279-P304 HydrophobicContact CG2-CG 4.01Å; I279-P304 VanDerWaalsContact O-CG 3.24Å; I279-P304 WeakPolarHBondContact O-CG 3.44Å; V281-P304 HydrophobicContact CG2-CB 4.25Å; A302-P304 WeakPolarHBondContact O-CD 3.48Å; P304-D306 WeakPolarHBondContact CB-OD1 3.23Å; P304-D306 PolarHBondContact O-N 3.34Å; P304-F307 HydrophobicContact CB-CB 4.39Å; P304-F307 WeakPolarHBondContact O-CB 3.42Å; P304-F307 PolarHBondContact O-N 3.4Å
305	D	97.5	Very high	97.8	Very high	127 Å²	127	45.9 Å²	45.9	68%	0.679	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-31	-178.4	-70	-27.9	0	0	0	113	F307 S330	D305-F307 VanDerWaalsContact C-N 3.32Å; D305-S330 VanDerWaalsContact O-CB 3.25Å; D305-S330 WeakPolarHBondContact O-CB 3.25Å; D305-S330 PolarHBondContact O-OG 3.2Å
306	D	97.5	Very high	97.9	Very high	24 Å²	24	45.9 Å²	45.9	13%	0.128	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-6.3	178.8	75.3	-61.2	0	0	0	113.4	V281 G282 F283 G284 P304 F308 E309	V281-D306 WeakPolarHBondContact CG1-OD1 3.47Å; G282-D306 WeakPolarHBondContact CA-OD2 3.09Å; G282-D306 PolarHBondContact N-OD1 3.28Å; G282-D306 PolarHBondContact N-OD2 2.78Å; F283-D306 PolarHBondContact N-OD2 2.93Å; G284-D306 WeakPolarHBondContact CA-O 3.49Å; G284-D306 PolarHBondContact N-O 2.78Å; G284-D306 PolarHBondContact N-OD2 2.61Å; G284-D306 VanDerWaalsContact N-OD2 3.09Å; P304-D306 WeakPolarHBondContact CB-OD1 3.23Å; P304-D306 PolarHBondContact O-N 3.34Å; D306-F308 VanDerWaalsContact C-N 3.28Å; D306-F308 PolarHBondContact O-N 2.85Å; D306-E309 WeakPolarHBondContact O-CB 3.27Å; D306-E309 PolarHBondContact O-N 2.91Å
307	F	98.3	Very high	98	Very high	1 Å²	1	43.3 Å²	43.3	0%	0.004	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-57.2	-39.8	-169.3	-167.8	-89.3	0	0	0	113.2	I279 F283 V292 I303 P304 D305 V316 L318	I279-F307 HydrophobicContact CG2-CD2 3.87Å; I279-F307 HydrophobicContact CG2-CE2 3.69Å; F283-F307 HydrophobicContact CB-CD2 3.86Å; F283-F307 HydrophobicContact CB-CE2 4.18Å; F283-F307 HydrophobicContact CB-CG 4.47Å; F283-F307 HydrophobicContact CD1-CD2 4.46Å; F283-F307 AromaticContact CD1-CE2 3.93Å; F283-F307 HydrophobicContact CD1-CE2 3.93Å; F283-F307 HydrophobicContact CD2-CD2 4.02Å; F283-F307 AromaticContact CD2-CE2 3.96Å; F283-F307 HydrophobicContact CD2-CE2 3.96Å; F283-F307 HydrophobicContact CE1-CE2 4.28Å; F283-F307 HydrophobicContact CE2-CE2 4.31Å; F283-F307 AromaticContact CG-CD2 3.86Å; F283-F307 HydrophobicContact CG-CD2 3.86Å; F283-F307 AromaticContact CG-CE2 3.75Å; F283-F307 HydrophobicContact CG-CE2 3.75Å; F283-F307 HydrophobicContact CZ-CE2 4.47Å; V292-F307 HydrophobicContact CB-CZ 4.34Å; V292-F307 HydrophobicContact CG1-CZ 3.97Å; I303-F307 HydrophobicContact CG2-CB 3.93Å; I303-F307 HydrophobicContact CG2-CD1 4.23Å; I303-F307 HydrophobicContact CG2-CG 3.99Å; P304-F307 HydrophobicContact CB-CB 4.39Å; P304-F307 WeakPolarHBondContact O-CB 3.42Å; P304-F307 PolarHBondContact O-N 3.4Å; D305-F307 VanDerWaalsContact C-N 3.32Å; F307-V316 HydrophobicContact CE1-CG1 3.76Å; F307-V316 HydrophobicContact CE1-CG2 4.13Å; F307-L318 HydrophobicContact CE1-CD1 4.31Å; F307-L318 HydrophobicContact CZ-CD1 4.39Å; F307-L318 HydrophobicContact CZ-CD2 4.24Å
308	F	98.1	Very high	98	Very high	3 Å²	3	42.7 Å²	42.7	1%	0.013	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-92	8.9	179.6	-61.4	-82.6	0	0	0	114	I303 D306 A310 L313 V316 P328 V331 A334 L337 L340	I303-F308 HydrophobicContact CG2-CE2 4.03Å; D306-F308 VanDerWaalsContact C-N 3.28Å; D306-F308 PolarHBondContact O-N 2.85Å; F308-A310 VanDerWaalsContact C-N 3.31Å; F308-L313 HydrophobicContact CD1-CD2 4.04Å; F308-V316 HydrophobicContact CE1-CB 4.4Å; F308-V316 HydrophobicContact CE1-CG1 4.21Å; F308-V316 HydrophobicContact CE1-CG2 4.04Å; F308-V316 HydrophobicContact CZ-CG1 4.42Å; F308-P328 HydrophobicContact CD2-CB 4.28Å; F308-P328 HydrophobicContact CD2-CG 4.37Å; F308-P328 HydrophobicContact CE2-CG 4.25Å; F308-V331 HydrophobicContact CB-CB 4.44Å; F308-V331 HydrophobicContact CD1-CB 4.16Å; F308-V331 HydrophobicContact CD1-CG2 3.8Å; F308-V331 HydrophobicContact CD2-CB 3.88Å; F308-V331 HydrophobicContact CD2-CG2 4.3Å; F308-V331 HydrophobicContact CE1-CB 4.38Å; F308-V331 HydrophobicContact CE1-CG2 3.75Å; F308-V331 HydrophobicContact CE2-CB 4.12Å; F308-V331 HydrophobicContact CE2-CG2 4.26Å; F308-V331 HydrophobicContact CG-CB 3.9Å; F308-V331 HydrophobicContact CG-CG2 4.08Å; F308-V331 HydrophobicContact CZ-CB 4.37Å; F308-V331 HydrophobicContact CZ-CG2 3.99Å; F308-A334 HydrophobicContact CB-CB 4.3Å; F308-L337 HydrophobicContact CD1-CD2 4.38Å; F308-L337 HydrophobicContact CE1-CD2 4.4Å; F308-L340 HydrophobicContact CE1-CD1 3.84Å; F308-L340 HydrophobicContact CZ-CD1 4.02Å
309	E	97.5	Very high	97.9	Very high	120 Å²	120	36.5 Å²	36.5	56%	0.561	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-83.9	-6.6	176.3	-61.9	-171.2	171.7	0	0	113.2	D306	D306-E309 WeakPolarHBondContact O-CB 3.27Å; D306-E309 PolarHBondContact O-N 2.91Å
310	A	97.7	Very high	97.7	Very high	3 Å²	3	38.2 Å²	38.2	3%	0.025	22%	0.218	C	C	.	.			trans	-64.2	121.6	175.7	0	0	0	0	0	110.1	L289 F308 K312 L313	L289-A310 HydrophobicContact CD2-CB 4.26Å; F308-A310 VanDerWaalsContact C-N 3.31Å; A310-K312 VanDerWaalsContact C-N 3.28Å; A310-K312 PolarHBondContact O-N 2.89Å; A310-L313 HydrophobicContact CB-CB 4.07Å; A310-L313 WeakPolarHBondContact O-CB 3.17Å; A310-L313 PolarHBondContact O-N 2.83Å
311	P	96.7	Very high	97.7	Very high	82 Å²	82	35.4 Å²	35.4	53%	0.532	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-19.3	-163.3	26.7	-36	0	0	0	114.7	S336	P311-S336 PolarHBondContact O-OG 2.93Å
312	K	98.4	Very high	97.7	Very high	75 Å²	75	35.9 Å²	35.9	33%	0.326	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	10.4	-179.9	-62.2	-172.1	-170	175.7	0	113.3	E288 L289 Q290 A310 E314	E288-K312 IonicContact OE1-NZ 3.18Å; E288-K312 PolarHBondContact OE1-NZ 2.88Å; E288-K312 IonicContact OE2-NZ 3.8Å; E288-K312 PolarHBondContact OE2-NZ 2.97Å; L289-K312 CarbonylContact O-C 3.21Å; Q290-K312 WeakPolarHBondContact CA-O 3.42Å; Q290-K312 HydrophobicContact CG-CB 4.11Å; A310-K312 VanDerWaalsContact C-N 3.28Å; A310-K312 PolarHBondContact O-N 2.89Å; K312-E314 PolarHBondContact O-N 2.82Å
313	L	98.6	Very high	97.7	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	18%	0.181	C	C	.	.			trans	-66.5	115.8	-174	-169.6	66.6	0	0	0	111.3	L289 V292 F308 A310 V316 S336 L337	L289-L313 HydrophobicContact CD2-CD1 4.04Å; L289-L313 HydrophobicContact CG-CD1 4.13Å; L289-L313 WeakPolarHBondContact O-CA 3.34Å; L289-L313 PolarHBondContact O-N 3.44Å; V292-L313 HydrophobicContact CG2-CD1 4.36Å; F308-L313 HydrophobicContact CD1-CD2 4.04Å; A310-L313 HydrophobicContact CB-CB 4.07Å; A310-L313 WeakPolarHBondContact O-CB 3.17Å; A310-L313 PolarHBondContact O-N 2.83Å; L313-V316 HydrophobicContact CD1-CG2 3.95Å; L313-V316 HydrophobicContact CD2-CG2 3.62Å; L313-V316 HydrophobicContact CG-CG2 3.77Å; L313-S336 CarbonylContact O-C 3.17Å; L313-S336 WeakPolarHBondContact O-CB 3.34Å; L313-L337 WeakPolarHBondContact O-CA 3.39Å; L313-L337 PolarHBondContact O-N 3.3Å
314	E	98	Very high	97.7	Very high	86 Å²	86	35.6 Å²	35.6	40%	0.402	20%	0.195	S	C	.	.			trans	-110.1	-40.2	-175.7	-74.9	177.4	-165.8	0	0	112.5	Q290 K312 S336 V338 E339	Q290-E314 WeakPolarHBondContact O-CA 3.44Å; Q290-E314 PolarHBondContact O-N 3.2Å; K312-E314 PolarHBondContact O-N 2.82Å; E314-S336 WeakPolarHBondContact CA-O 3.25Å; E314-S336 WeakPolarHBondContact CG-O 3.24Å; E314-V338 WeakPolarHBondContact O-CA 3.48Å; E314-V338 PolarHBondContact O-N 3.35Å; E314-E339 PolarHBondContact O-N 3.27Å
315	S	97	Very high	97.7	Very high	29 Å²	29	35.7 Å²	35.7	20%	0.203	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	124.5	-173.8	-173	0	0	0	0	112.6	Q290 G291 V292 H317	Q290-S315 PolarHBondContact O-N 2.99Å; G291-S315 WeakPolarHBondContact CA-O 3.07Å; V292-S315 PolarHBondContact N-O 3.34Å; S315-H317 PolarHBondContact OG-NE2 3.26Å
316	V	98.7	Very high	97.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	111.3	-179.3	175.2	0	0	0	0	110.4	F307 F308 L313 L318 L337 E339 L340 R341 L342	F307-V316 HydrophobicContact CE1-CG1 3.76Å; F307-V316 HydrophobicContact CE1-CG2 4.13Å; F308-V316 HydrophobicContact CE1-CB 4.4Å; F308-V316 HydrophobicContact CE1-CG1 4.21Å; F308-V316 HydrophobicContact CE1-CG2 4.04Å; F308-V316 HydrophobicContact CZ-CG1 4.42Å; L313-V316 HydrophobicContact CD1-CG2 3.95Å; L313-V316 HydrophobicContact CD2-CG2 3.62Å; L313-V316 HydrophobicContact CG-CG2 3.77Å; V316-L318 HydrophobicContact CG1-CD1 3.91Å; V316-L318 HydrophobicContact CG1-CG 3.78Å; V316-L337 HydrophobicContact CG2-CD1 4.01Å; V316-E339 PolarHBondContact N-O 3.02Å; V316-L340 HydrophobicContact CB-CD1 4Å; V316-L340 HydrophobicContact CG1-CD1 4.03Å; V316-R341 PolarHBondContact O-N 3.2Å; V316-L342 HydrophobicContact CG1-CD2 4.44Å
317	H	96.9	Very high	97.8	Very high	22 Å²	22	32.2 Å²	32.2	10%	0.102	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	108.2	178.2	-69.7	-168.8	0	0	0	109.3	V292 D293 L294 A295 S315 Y319 E339 R341	V292-H317 PolarHBondContact O-N 3.05Å; D293-H317 WeakPolarHBondContact CA-O 3.36Å; D293-H317 HydrophobicContact CB-CB 4.08Å; D293-H317 WeakPolarHBondContact OD1-CB 3.38Å; D293-H317 IonicContact OD2-ND1 2.89Å; L294-H317 PolarHBondContact N-O 2.98Å; A295-H317 PolarHBondContact N-O 3.32Å; S315-H317 PolarHBondContact OG-NE2 3.26Å; H317-Y319 HydrophobicContact CB-CD1 4.1Å; H317-Y319 HydrophobicContact CB-CE1 3.87Å; H317-Y319 AromaticContact ND1-CE1 4Å; H317-E339 IonicContact CE1-OE2 3.71Å; H317-E339 IonicContact NE2-OE2 3.6Å; H317-E339 PolarHBondContact NE2-OE2 3.27Å; H317-R341 PolarHBondContact CE1-NH1 2.91Å
318	L	98.6	Very high	97.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.184	C	C	.	.			trans	-125.3	11.8	-178.2	-58	-179.7	0	0	0	112.3	I279 L294 I303 F307 V316 N321 L323 R341 L342 N345	I279-L318 HydrophobicContact CD1-CD1 4.11Å; I279-L318 HydrophobicContact CD1-CD2 4.04Å; L294-L318 HydrophobicContact CB-CD2 3.79Å; L294-L318 HydrophobicContact CD1-CD2 3.78Å; L294-L318 HydrophobicContact CG-CD2 3.9Å; I303-L318 HydrophobicContact CD1-CD1 3.94Å; I303-L318 HydrophobicContact CG1-CD1 4.16Å; I303-L318 HydrophobicContact CG2-CD1 4.43Å; F307-L318 HydrophobicContact CE1-CD1 4.31Å; F307-L318 HydrophobicContact CZ-CD1 4.39Å; F307-L318 HydrophobicContact CZ-CD2 4.24Å; V316-L318 HydrophobicContact CG1-CD1 3.91Å; V316-L318 HydrophobicContact CG1-CG 3.78Å; L318-N321 PolarHBondContact O-ND2 3.21Å; L318-L323 HydrophobicContact CB-CD1 3.82Å; L318-L323 HydrophobicContact CD1-CD1 4.23Å; L318-R341 PolarHBondContact N-O 3.39Å; L318-L342 HydrophobicContact CB-CD2 3.85Å; L318-L342 HydrophobicContact CD1-CD2 3.81Å; L318-L342 HydrophobicContact CG-CD2 4.06Å; L318-N345 PolarHBondContact O-ND2 2.56Å
319	Y	96.2	Very high	97.7	Very high	26 Å²	26	38.2 Å²	38.2	10%	0.102	21%	0.212	C	C	.	.			trans	-68.5	163	-172	63	-92.9	0	0	0	113.4	A295 M296 H317 N321 R341 F343	A295-Y319 CarbonylContact C-O 3.24Å; A295-Y319 WeakPolarHBondContact CA-O 3.14Å; A295-Y319 HydrophobicContact CB-CD1 3.5Å; A295-Y319 HydrophobicContact CB-CD2 3.75Å; A295-Y319 HydrophobicContact CB-CE1 3.3Å; A295-Y319 HydrophobicContact CB-CE2 3.59Å; A295-Y319 HydrophobicContact CB-CG 3.7Å; A295-Y319 WeakPolarHBondContact CB-O 3.1Å; M296-Y319 HydrophobicContact CG-CD2 4.42Å; M296-Y319 HydrophobicContact CG-CE2 3.85Å; M296-Y319 PolarHBondContact N-O 3.38Å; M296-Y319 HydrophobicContact SD-CE2 4.3Å; H317-Y319 HydrophobicContact CB-CD1 4.1Å; H317-Y319 HydrophobicContact CB-CE1 3.87Å; H317-Y319 AromaticContact ND1-CE1 4Å; Y319-N321 PolarHBondContact O-ND2 2.69Å; Y319-R341 HydrophobicContact CD1-CB 3.94Å; Y319-R341 PolarHBondContact N-O 2.83Å; Y319-F343 CarbonylContact C-O 3.12Å; Y319-F343 WeakPolarHBondContact CA-O 3.38Å; Y319-F343 VanDerWaalsContact CB-CD1 3.45Å; Y319-F343 WeakPolarHBondContact CB-O 3.31Å; Y319-F343 HydrophobicContact CD1-CD1 4.37Å; Y319-F343 AromaticContact CD1-CE1 3.61Å; Y319-F343 HydrophobicContact CD1-CE1 3.61Å; Y319-F343 AromaticContact CD1-CZ 3.88Å; Y319-F343 HydrophobicContact CD1-CZ 3.88Å; Y319-F343 HydrophobicContact CD2-CD2 4.43Å; Y319-F343 AromaticContact CD2-CE1 3.75Å; Y319-F343 HydrophobicContact CD2-CE1 3.75Å; Y319-F343 AromaticContact CD2-CE2 3.53Å; Y319-F343 HydrophobicContact CD2-CE2 3.53Å; Y319-F343 AromaticContact CD2-CZ 3.12Å; Y319-F343 HydrophobicContact CD2-CZ 3.12Å; Y319-F343 HydrophobicContact CE1-CE1 4.33Å; Y319-F343 HydrophobicContact CE1-CZ 4.4Å; Y319-F343 HydrophobicContact CE2-CE1 4.43Å; Y319-F343 HydrophobicContact CE2-CE2 4.37Å; Y319-F343 AromaticContact CE2-CZ 3.73Å; Y319-F343 HydrophobicContact CE2-CZ 3.73Å; Y319-F343 AromaticContact CG-CD1 3.93Å; Y319-F343 HydrophobicContact CG-CD1 3.93Å; Y319-F343 HydrophobicContact CG-CD2 4.38Å; Y319-F343 AromaticContact CG-CE1 3.29Å; Y319-F343 HydrophobicContact CG-CE1 3.29Å; Y319-F343 AromaticContact CG-CE2 3.8Å; Y319-F343 HydrophobicContact CG-CE2 3.8Å; Y319-F343 HydrophobicContact CG-CG 4.44Å; Y319-F343 AromaticContact CG-CZ 3.21Å; Y319-F343 HydrophobicContact CG-CZ 3.21Å
320	A	94.3	Very high	97.7	Very high	37 Å²	37	32.9 Å²	32.9	31%	0.306	19%	0.188	S	C	.	.	S	Bend	trans	53.2	58.6	180	0	0	0	0	0	112.5	M296 N297 F343 A344	M296-A320 VanDerWaalsContact CA-O 3.29Å; M296-A320 WeakPolarHBondContact CA-O 3.18Å; M296-A320 HydrophobicContact CG-CB 4.07Å; M296-A320 PolarHBondContact N-O 3Å; N297-A320 PolarHBondContact N-O 3.41Å; A320-F343 PolarHBondContact N-O 3.15Å; A320-A344 VanDerWaalsContact CA-O 3.24Å; A320-A344 WeakPolarHBondContact CA-O 3.39Å; A320-A344 HydrophobicContact CB-CB 4.46Å; A320-A344 PolarHBondContact N-O 3.24Å
321	N	98	Very high	97.7	Very high	13 Å²	13	32.8 Å²	32.8	7%	0.07	19%	0.187	C	C	.	.	S	Bend	trans	-135.7	-167.4	176.5	-87.7	-72.6	0	0	0	109.7	L294 N297 R298 L299 L318 Y319 L323 A344 N345	L294-N321 PolarHBondContact O-ND2 3.02Å; N297-N321 WeakPolarHBondContact CA-OD1 3.45Å; N297-N321 WeakPolarHBondContact CB-OD1 3.24Å; N297-N321 PolarHBondContact N-OD1 3.43Å; N297-N321 PolarHBondContact O-OD1 3.32Å; R298-N321 PolarHBondContact N-OD1 2.91Å; L299-N321 HydrophobicContact CB-CB 4.4Å; L299-N321 VanDerWaalsContact CB-OD1 3.28Å; L299-N321 WeakPolarHBondContact CB-OD1 3.24Å; L299-N321 WeakPolarHBondContact CG-OD1 3.35Å; L299-N321 PolarHBondContact N-OD1 3.16Å; L318-N321 PolarHBondContact O-ND2 3.21Å; Y319-N321 PolarHBondContact O-ND2 2.69Å; N321-L323 HydrophobicContact CB-CD1 4.38Å; N321-L323 HydrophobicContact CB-CG 4.07Å; N321-A344 PolarHBondContact N-O 3.38Å; N321-A344 VanDerWaalsContact N-O 3.15Å; N321-N345 WeakPolarHBondContact CA-OD1 3.32Å; N321-N345 WeakPolarHBondContact CB-OD1 3.5Å; N321-N345 PolarHBondContact O-OD1 2.83Å
322	S	98.4	Very high	97.7	Very high	35 Å²	35	29.2 Å²	29.2	25%	0.245	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	32.3	172.8	-65.8	0	0	0	0	112.2	L299 N345	L299-S322 CarbonylContact O-C 3.35Å; L299-S322 WeakPolarHBondContact O-CA 3.17Å; L299-S322 WeakPolarHBondContact O-CB 3.05Å; L299-S322 PolarHBondContact O-N 3.05Å; S322-N345 PolarHBondContact N-OD1 2.8Å
323	L	98.8	Very high	97.6	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	145.3	179.7	-60.7	170.2	0	0	0	110.8	I279 L299 G301 I303 L318 N321 N345 R346 L347	I279-L323 HydrophobicContact CD1-CD1 4.08Å; I279-L323 HydrophobicContact CD1-CD2 3.82Å; I279-L323 HydrophobicContact CG1-CD2 4.14Å; L299-L323 HydrophobicContact CB-CD2 4.11Å; L299-L323 PolarHBondContact O-N 3.04Å; G301-L323 CarbonylContact O-C 3.34Å; G301-L323 WeakPolarHBondContact O-CA 3.02Å; I303-L323 HydrophobicContact CG1-CD1 4.23Å; L318-L323 HydrophobicContact CB-CD1 3.82Å; L318-L323 HydrophobicContact CD1-CD1 4.23Å; N321-L323 HydrophobicContact CB-CD1 4.38Å; N321-L323 HydrophobicContact CB-CG 4.07Å; L323-N345 HydrophobicContact CB-CB 4.44Å; L323-N345 VanDerWaalsContact CB-OD1 3.31Å; L323-N345 WeakPolarHBondContact CB-OD1 3.43Å; L323-N345 WeakPolarHBondContact CG-OD1 3.32Å; L323-N345 PolarHBondContact N-OD1 3.12Å; L323-R346 CarbonylContact O-C 3.04Å; L323-R346 WeakPolarHBondContact O-CA 3.45Å; L323-R346 VanDerWaalsContact O-CB 3.3Å; L323-R346 WeakPolarHBondContact O-CB 3.4Å; L323-R346 PolarHBondContact O-N 3.01Å; L323-L347 HydrophobicContact CB-CD2 4.03Å; L323-L347 PolarHBondContact O-N 3.08Å
324	T	98.6	Very high	97.5	Very high	51 Å²	51	33.2 Å²	33.2	31%	0.313	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	172.8	-171.9	54.6	0	0	0	0	110.9	G301 A302 R346	G301-T324 VanDerWaalsContact C-OG1 3.23Å; G301-T324 WeakPolarHBondContact CA-OG1 3.2Å; G301-T324 PolarHBondContact O-N 2.75Å; G301-T324 PolarHBondContact O-OG1 2.87Å; G301-T324 VanDerWaalsContact O-OG1 3.06Å; A302-T324 VanDerWaalsContact CA-O 3.28Å; A302-T324 WeakPolarHBondContact CA-O 3.34Å; T324-R346 HydrophobicContact CG2-CB 3.94Å
325	G	98.4	Very high	97.4	Very high	13 Å²	13	32 Å²	32	13%	0.134	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80	-179.1	177.4	0	0	0	0	0	113.6	L347 N348	G325-L347 WeakPolarHBondContact O-CA 3.45Å; G325-N348 WeakPolarHBondContact CA-OD1 3.18Å; G325-N348 PolarHBondContact O-N 2.85Å; G325-N348 PolarHBondContact O-OD1 3.24Å
326	P	98.2	Very high	97.5	Very high	74 Å²	74	32.6 Å²	32.6	48%	0.481	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-73.1	155.1	179.4	31.5	-34.9	0	0	0	112.5	P328 N348	P326-P328 WeakPolarHBondContact O-CD 3.48Å; P326-N348 VanDerWaalsContact CA-O 3.26Å; P326-N348 WeakPolarHBondContact CA-O 3.43Å
327	V	98.4	Very high	97.5	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.024	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-66.5	124	163.9	-178.2	0	0	0	0	107.5	V331 L342 L347 L351	V327-V331 HydrophobicContact CG1-CB 4.27Å; V327-V331 HydrophobicContact CG1-CG1 3.92Å; V327-L342 HydrophobicContact CG1-CD1 4.26Å; V327-L342 HydrophobicContact CG2-CD1 3.92Å; V327-L347 HydrophobicContact CG2-CD1 4.35Å; V327-L351 HydrophobicContact CB-CD2 4.06Å; V327-L351 HydrophobicContact CG2-CD2 3.74Å
328	P	98	Very high	97.5	Very high	4 Å²	4	33.5 Å²	33.5	3%	0.026	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-56.2	141	-176	-28.9	35.2	0	0	0	114.1	I303 F308 P326 S330 V331	I303-P328 HydrophobicContact CB-CG 3.93Å; I303-P328 HydrophobicContact CG2-CG 3.89Å; I303-P328 WeakPolarHBondContact O-CG 3.46Å; F308-P328 HydrophobicContact CD2-CB 4.28Å; F308-P328 HydrophobicContact CD2-CG 4.37Å; F308-P328 HydrophobicContact CE2-CG 4.25Å; P326-P328 WeakPolarHBondContact O-CD 3.48Å; P328-S330 WeakPolarHBondContact CB-OG 3.48Å; P328-S330 PolarHBondContact O-N 2.98Å; P328-S330 VanDerWaalsContact O-N 3.1Å; P328-V331 WeakPolarHBondContact O-CB 3.45Å; P328-V331 WeakPolarHBondContact O-CG1 3.4Å; P328-V331 PolarHBondContact O-N 3.33Å
329	E	97.3	Very high	97.3	Very high	127 Å²	127	36.2 Å²	36.2	59%	0.593	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-57.7	-24.7	175.7	-77	-71.3	160.1	0	0	113.5	V331 A332 P352	E329-V331 PolarHBondContact O-N 2.79Å; E329-A332 PolarHBondContact O-N 2.94Å; E329-P352 WeakPolarHBondContact OE2-CB 3.39Å
330	S	96.8	Very high	97.5	Very high	8 Å²	8	35 Å²	35	6%	0.056	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-61	-23.8	176.2	52.6	0	0	0	0	113.2	D305 P328 A332 K333 A334	D305-S330 VanDerWaalsContact O-CB 3.25Å; D305-S330 WeakPolarHBondContact O-CB 3.25Å; D305-S330 PolarHBondContact O-OG 3.2Å; P328-S330 WeakPolarHBondContact CB-OG 3.48Å; P328-S330 PolarHBondContact O-N 2.98Å; P328-S330 VanDerWaalsContact O-N 3.1Å; S330-A332 PolarHBondContact O-N 2.76Å; S330-K333 WeakPolarHBondContact O-CB 3.37Å; S330-K333 PolarHBondContact O-N 3.18Å; S330-A334 PolarHBondContact O-N 2.79Å
331	V	98	Very high	97.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-58.1	-33	176.7	75.9	0	0	0	0	112.5	F308 V327 P328 E329 K333 A334 L337 L340 P352 L355	F308-V331 HydrophobicContact CB-CB 4.44Å; F308-V331 HydrophobicContact CD1-CB 4.16Å; F308-V331 HydrophobicContact CD1-CG2 3.8Å; F308-V331 HydrophobicContact CD2-CB 3.88Å; F308-V331 HydrophobicContact CD2-CG2 4.3Å; F308-V331 HydrophobicContact CE1-CB 4.38Å; F308-V331 HydrophobicContact CE1-CG2 3.75Å; F308-V331 HydrophobicContact CE2-CB 4.12Å; F308-V331 HydrophobicContact CE2-CG2 4.26Å; F308-V331 HydrophobicContact CG-CB 3.9Å; F308-V331 HydrophobicContact CG-CG2 4.08Å; F308-V331 HydrophobicContact CZ-CB 4.37Å; F308-V331 HydrophobicContact CZ-CG2 3.99Å; V327-V331 HydrophobicContact CG1-CB 4.27Å; V327-V331 HydrophobicContact CG1-CG1 3.92Å; P328-V331 WeakPolarHBondContact O-CB 3.45Å; P328-V331 WeakPolarHBondContact O-CG1 3.4Å; P328-V331 PolarHBondContact O-N 3.33Å; E329-V331 PolarHBondContact O-N 2.79Å; V331-K333 PolarHBondContact O-N 3.42Å; V331-A334 PolarHBondContact O-N 2.9Å; V331-L337 HydrophobicContact CG2-CD2 3.84Å; V331-L340 HydrophobicContact CG2-CD2 3.81Å; V331-P352 HydrophobicContact CG1-CB 4.44Å; V331-P352 HydrophobicContact CG1-CG 3.84Å; V331-L355 HydrophobicContact CG1-CD1 3.98Å; V331-L355 HydrophobicContact CG2-CD1 3.83Å
332	A	96.8	Very high	97.6	Very high	8 Å²	8	35.9 Å²	35.9	7%	0.066	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-72.2	-14.2	178.7	0	0	0	0	0	113.2	E329 S330 P352 D354 N358	E329-A332 PolarHBondContact O-N 2.94Å; S330-A332 PolarHBondContact O-N 2.76Å; A332-P352 HydrophobicContact CB-CB 4.04Å; A332-D354 HydrophobicContact CB-CB 4.07Å; A332-N358 PolarHBondContact O-ND2 3.22Å
333	K	95.3	Very high	97.5	Very high	154 Å²	154	36.7 Å²	36.7	67%	0.67	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-98.5	-9.4	178.8	-59.2	176.6	-175.2	168.6	0	113	S330 V331 A335	S330-K333 WeakPolarHBondContact O-CB 3.37Å; S330-K333 PolarHBondContact O-N 3.18Å; V331-K333 PolarHBondContact O-N 3.42Å; K333-A335 PolarHBondContact O-N 3.29Å
334	A	96.7	Very high	97.3	Very high	6 Å²	6	38 Å²	38	5%	0.05	21%	0.211	C	C	.	.			trans	-72.3	87.9	-177	0	0	0	0	0	111.6	F308 S330 V331 S336 L337 S359	F308-A334 HydrophobicContact CB-CB 4.3Å; S330-A334 PolarHBondContact O-N 2.79Å; V331-A334 PolarHBondContact O-N 2.9Å; A334-S336 VanDerWaalsContact C-N 3.25Å; A334-S336 PolarHBondContact O-N 3.34Å; A334-L337 HydrophobicContact CB-CB 3.89Å; A334-L337 HydrophobicContact CB-CD2 4.29Å; A334-L337 WeakPolarHBondContact O-CB 3.4Å; A334-L337 PolarHBondContact O-N 3.22Å; A334-S359 WeakPolarHBondContact O-CB 3.22Å; A334-S359 PolarHBondContact O-OG 3.35Å
335	A	96.5	Very high	97.3	Very high	62 Å²	62	36.1 Å²	36.1	51%	0.512	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.1	-170.6	0	0	0	0	0	114.8	K333 P360	K333-A335 PolarHBondContact O-N 3.29Å; A335-P360 WeakPolarHBondContact O-CD 3.33Å
336	S	98.1	Very high	97.3	Very high	40 Å²	40	43.1 Å²	43.1	28%	0.28	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-3.4	179.2	-59.2	0	0	0	0	113.7	P311 L313 E314 A334 V338	P311-S336 PolarHBondContact O-OG 2.93Å; L313-S336 CarbonylContact O-C 3.17Å; L313-S336 WeakPolarHBondContact O-CB 3.34Å; E314-S336 WeakPolarHBondContact CA-O 3.25Å; E314-S336 WeakPolarHBondContact CG-O 3.24Å; A334-S336 VanDerWaalsContact C-N 3.25Å; A334-S336 PolarHBondContact O-N 3.34Å; S336-V338 WeakPolarHBondContact O-CG2 3.47Å; S336-V338 PolarHBondContact O-N 3.25Å
337	L	98.6	Very high	97.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.			trans	-67	122	-170.9	-169.2	65.7	0	0	0	111.9	F308 L313 V316 V331 A334 L340 P360 L361	F308-L337 HydrophobicContact CD1-CD2 4.38Å; F308-L337 HydrophobicContact CE1-CD2 4.4Å; L313-L337 WeakPolarHBondContact O-CA 3.39Å; L313-L337 PolarHBondContact O-N 3.3Å; V316-L337 HydrophobicContact CG2-CD1 4.01Å; V331-L337 HydrophobicContact CG2-CD2 3.84Å; A334-L337 HydrophobicContact CB-CB 3.89Å; A334-L337 HydrophobicContact CB-CD2 4.29Å; A334-L337 WeakPolarHBondContact O-CB 3.4Å; A334-L337 PolarHBondContact O-N 3.22Å; L337-L340 HydrophobicContact CD2-CB 4.37Å; L337-L340 HydrophobicContact CD2-CD2 4.15Å; L337-P360 CarbonylContact O-C 3.54Å; L337-L361 HydrophobicContact CB-CD2 4.36Å; L337-L361 HydrophobicContact CD2-CD2 4.06Å; L337-L361 HydrophobicContact CG-CD2 3.93Å; L337-L361 PolarHBondContact O-N 2.62Å
338	V	98	Very high	97.3	Very high	41 Å²	41	42.9 Å²	42.9	25%	0.248	22%	0.216	C	C	.	.			trans	-111.1	-47	-178.4	177.9	0	0	0	0	111	E314 S336 P360 V362 C363	E314-V338 WeakPolarHBondContact O-CA 3.48Å; E314-V338 PolarHBondContact O-N 3.35Å; S336-V338 WeakPolarHBondContact O-CG2 3.47Å; S336-V338 PolarHBondContact O-N 3.25Å; V338-P360 HydrophobicContact CG2-CG 4.29Å; V338-V362 HydrophobicContact CG1-CB 3.78Å; V338-V362 HydrophobicContact CG1-CG2 3.66Å; V338-V362 PolarHBondContact O-N 3.23Å; V338-C363 PolarHBondContact O-N 2.9Å
339	E	94.8	Very high	97.3	Very high	58 Å²	58	44 Å²	44	27%	0.271	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.5	-178	-63	-167.9	176.5	0	0	111.6	E314 V316 H317 R341 C363	E314-E339 PolarHBondContact O-N 3.27Å; V316-E339 PolarHBondContact N-O 3.02Å; H317-E339 IonicContact CE1-OE2 3.71Å; H317-E339 IonicContact NE2-OE2 3.6Å; H317-E339 PolarHBondContact NE2-OE2 3.27Å; E339-R341 IonicContact OE2-NH2 2.65Å; E339-C363 HydrophobicContact CG-CB 4.31Å
340	L	98.5	Very high	97.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	105.4	177.8	-177	58.3	0	0	0	110.5	F308 V316 V331 L337 L342 C363 V364 D365 M366	F308-L340 HydrophobicContact CE1-CD1 3.84Å; F308-L340 HydrophobicContact CZ-CD1 4.02Å; V316-L340 HydrophobicContact CB-CD1 4Å; V316-L340 HydrophobicContact CG1-CD1 4.03Å; V331-L340 HydrophobicContact CG2-CD2 3.81Å; L337-L340 HydrophobicContact CD2-CB 4.37Å; L337-L340 HydrophobicContact CD2-CD2 4.15Å; L340-L342 HydrophobicContact CD1-CD1 4Å; L340-L342 HydrophobicContact CD1-CD2 3.8Å; L340-L342 HydrophobicContact CD1-CG 3.81Å; L340-L342 HydrophobicContact CD2-CD1 4.45Å; L340-L342 HydrophobicContact CG-CD1 4.21Å; L340-L342 HydrophobicContact CG-CG 4.08Å; L340-C363 PolarHBondContact N-O 2.99Å; L340-V364 WeakPolarHBondContact O-CA 3.35Å; L340-D365 PolarHBondContact O-N 3.49Å; L340-M366 HydrophobicContact CD2-CE 3.26Å; L340-M366 HydrophobicContact CG-CE 3.93Å
341	R	97.3	Very high	97.4	Very high	69 Å²	69	42.1 Å²	42.1	26%	0.26	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	102.5	-178.2	-62.8	-173.7	-179.9	163.6	4.6	111.3	V316 H317 L318 Y319 E339 F343 D365	V316-R341 PolarHBondContact O-N 3.2Å; H317-R341 PolarHBondContact CE1-NH1 2.91Å; L318-R341 PolarHBondContact N-O 3.39Å; Y319-R341 HydrophobicContact CD1-CB 3.94Å; Y319-R341 PolarHBondContact N-O 2.83Å; E339-R341 IonicContact OE2-NH2 2.65Å; R341-F343 HydrophobicContact CB-CD1 4.31Å; R341-F343 HydrophobicContact CB-CE1 4.28Å; R341-D365 CarbonylContact C-O 3.29Å; R341-D365 WeakPolarHBondContact CA-O 3.3Å; R341-D365 HydrophobicContact CG-CB 4.34Å
342	L	98.4	Very high	97.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.225	C	C	.	.			trans	-118.1	8.4	-175.7	-54	-175.9	0	0	0	113.2	I303 V316 L318 V327 L340 N345 L347 D365 M366 N369	I303-L342 HydrophobicContact CD1-CD1 4.41Å; I303-L342 HydrophobicContact CD1-CD2 4.3Å; V316-L342 HydrophobicContact CG1-CD2 4.44Å; L318-L342 HydrophobicContact CB-CD2 3.85Å; L318-L342 HydrophobicContact CD1-CD2 3.81Å; L318-L342 HydrophobicContact CG-CD2 4.06Å; V327-L342 HydrophobicContact CG1-CD1 4.26Å; V327-L342 HydrophobicContact CG2-CD1 3.92Å; L340-L342 HydrophobicContact CD1-CD1 4Å; L340-L342 HydrophobicContact CD1-CD2 3.8Å; L340-L342 HydrophobicContact CD1-CG 3.81Å; L340-L342 HydrophobicContact CD2-CD1 4.45Å; L340-L342 HydrophobicContact CG-CD1 4.21Å; L340-L342 HydrophobicContact CG-CG 4.08Å; L342-N345 PolarHBondContact O-ND2 3.31Å; L342-N345 VanDerWaalsContact O-ND2 3.08Å; L342-L347 HydrophobicContact CB-CD1 3.78Å; L342-L347 HydrophobicContact CD1-CD1 4.07Å; L342-L347 HydrophobicContact CG-CD1 4.48Å; L342-D365 PolarHBondContact N-O 2.98Å; L342-M366 HydrophobicContact CB-CG 4.34Å; L342-M366 HydrophobicContact CD1-CE 4Å; L342-M366 HydrophobicContact CD1-CG 4.46Å; L342-N369 PolarHBondContact O-ND2 3.17Å
343	F	96.9	Very high	97.4	Very high	52 Å²	52	44.8 Å²	44.8	23%	0.228	25%	0.246	C	C	.	.			trans	-64.7	163.6	-171.9	68	-93	0	0	0	114.4	Y319 A320 R341 N345 D365 S367	Y319-F343 CarbonylContact C-O 3.12Å; Y319-F343 WeakPolarHBondContact CA-O 3.38Å; Y319-F343 VanDerWaalsContact CB-CD1 3.45Å; Y319-F343 WeakPolarHBondContact CB-O 3.31Å; Y319-F343 HydrophobicContact CD1-CD1 4.37Å; Y319-F343 AromaticContact CD1-CE1 3.61Å; Y319-F343 HydrophobicContact CD1-CE1 3.61Å; Y319-F343 AromaticContact CD1-CZ 3.88Å; Y319-F343 HydrophobicContact CD1-CZ 3.88Å; Y319-F343 HydrophobicContact CD2-CD2 4.43Å; Y319-F343 AromaticContact CD2-CE1 3.75Å; Y319-F343 HydrophobicContact CD2-CE1 3.75Å; Y319-F343 AromaticContact CD2-CE2 3.53Å; Y319-F343 HydrophobicContact CD2-CE2 3.53Å; Y319-F343 AromaticContact CD2-CZ 3.12Å; Y319-F343 HydrophobicContact CD2-CZ 3.12Å; Y319-F343 HydrophobicContact CE1-CE1 4.33Å; Y319-F343 HydrophobicContact CE1-CZ 4.4Å; Y319-F343 HydrophobicContact CE2-CE1 4.43Å; Y319-F343 HydrophobicContact CE2-CE2 4.37Å; Y319-F343 AromaticContact CE2-CZ 3.73Å; Y319-F343 HydrophobicContact CE2-CZ 3.73Å; Y319-F343 AromaticContact CG-CD1 3.93Å; Y319-F343 HydrophobicContact CG-CD1 3.93Å; Y319-F343 HydrophobicContact CG-CD2 4.38Å; Y319-F343 AromaticContact CG-CE1 3.29Å; Y319-F343 HydrophobicContact CG-CE1 3.29Å; Y319-F343 AromaticContact CG-CE2 3.8Å; Y319-F343 HydrophobicContact CG-CE2 3.8Å; Y319-F343 HydrophobicContact CG-CG 4.44Å; Y319-F343 AromaticContact CG-CZ 3.21Å; Y319-F343 HydrophobicContact CG-CZ 3.21Å; A320-F343 PolarHBondContact N-O 3.15Å; R341-F343 HydrophobicContact CB-CD1 4.31Å; R341-F343 HydrophobicContact CB-CE1 4.28Å; F343-N345 PolarHBondContact O-ND2 3.03Å; F343-D365 WeakPolarHBondContact CB-OD1 3.39Å; F343-D365 HydrophobicContact CD1-CB 4.01Å; F343-D365 WeakPolarHBondContact CD1-OD2 3.44Å; F343-D365 PolarHBondContact N-O 3.01Å; F343-S367 CarbonylContact C-O 3.27Å; F343-S367 WeakPolarHBondContact CA-O 3.49Å; F343-S367 WeakPolarHBondContact CB-O 3.48Å
344	A	94.6	Very high	97.4	Very high	26 Å²	26	41 Å²	41	22%	0.215	23%	0.233	C	C	.	.	S	Bend	trans	53.5	60.4	179.9	0	0	0	0	0	112.3	A320 N321 S367 D368	A320-A344 VanDerWaalsContact CA-O 3.24Å; A320-A344 WeakPolarHBondContact CA-O 3.39Å; A320-A344 HydrophobicContact CB-CB 4.46Å; A320-A344 PolarHBondContact N-O 3.24Å; N321-A344 PolarHBondContact N-O 3.38Å; N321-A344 VanDerWaalsContact N-O 3.15Å; A344-S367 PolarHBondContact N-O 2.92Å; A344-D368 WeakPolarHBondContact CA-O 3.34Å; A344-D368 PolarHBondContact N-O 3.01Å
345	N	98	Very high	97.4	Very high	13 Å²	13	40.7 Å²	40.7	7%	0.07	23%	0.231	C	C	.	.	S	Bend	trans	-139.3	-168.5	177.6	-88.5	-71.8	0	0	0	109.9	L318 N321 S322 L323 L342 F343 L347 D368 N369	L318-N345 PolarHBondContact O-ND2 2.56Å; N321-N345 WeakPolarHBondContact CA-OD1 3.32Å; N321-N345 WeakPolarHBondContact CB-OD1 3.5Å; N321-N345 PolarHBondContact O-OD1 2.83Å; S322-N345 PolarHBondContact N-OD1 2.8Å; L323-N345 HydrophobicContact CB-CB 4.44Å; L323-N345 VanDerWaalsContact CB-OD1 3.31Å; L323-N345 WeakPolarHBondContact CB-OD1 3.43Å; L323-N345 WeakPolarHBondContact CG-OD1 3.32Å; L323-N345 PolarHBondContact N-OD1 3.12Å; L342-N345 PolarHBondContact O-ND2 3.31Å; L342-N345 VanDerWaalsContact O-ND2 3.08Å; F343-N345 PolarHBondContact O-ND2 3.03Å; N345-L347 HydrophobicContact CB-CD1 4.41Å; N345-L347 HydrophobicContact CB-CG 4.06Å; N345-D368 PolarHBondContact N-O 2.96Å; N345-D368 VanDerWaalsContact N-O 3.15Å; N345-N369 WeakPolarHBondContact CA-OD1 3.34Å; N345-N369 WeakPolarHBondContact CB-OD1 3.45Å; N345-N369 PolarHBondContact O-OD1 2.97Å
346	R	98.3	Very high	97.4	Very high	160 Å²	160	37.8 Å²	37.8	60%	0.604	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	29.4	175.2	-55.8	177	-174.5	171.6	2.9	111.4	L323 T324 N369	L323-R346 CarbonylContact O-C 3.04Å; L323-R346 WeakPolarHBondContact O-CA 3.45Å; L323-R346 VanDerWaalsContact O-CB 3.3Å; L323-R346 WeakPolarHBondContact O-CB 3.4Å; L323-R346 PolarHBondContact O-N 3.01Å; T324-R346 HydrophobicContact CG2-CB 3.94Å; R346-N369 PolarHBondContact N-OD1 3.26Å
347	L	98.7	Very high	97.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	145.2	179.1	-60.1	171.8	0	0	0	110	I303 L323 G325 V327 L342 N345 N369 S370 I371	I303-L347 HydrophobicContact CD1-CD1 4.38Å; I303-L347 HydrophobicContact CD1-CD2 4.03Å; I303-L347 HydrophobicContact CG1-CD2 4.37Å; L323-L347 HydrophobicContact CB-CD2 4.03Å; L323-L347 PolarHBondContact O-N 3.08Å; G325-L347 WeakPolarHBondContact O-CA 3.45Å; V327-L347 HydrophobicContact CG2-CD1 4.35Å; L342-L347 HydrophobicContact CB-CD1 3.78Å; L342-L347 HydrophobicContact CD1-CD1 4.07Å; L342-L347 HydrophobicContact CG-CD1 4.48Å; N345-L347 HydrophobicContact CB-CD1 4.41Å; N345-L347 HydrophobicContact CB-CG 4.06Å; L347-N369 HydrophobicContact CB-CB 4.42Å; L347-N369 VanDerWaalsContact CB-OD1 3.24Å; L347-N369 WeakPolarHBondContact CB-OD1 3.42Å; L347-N369 WeakPolarHBondContact CG-OD1 3.39Å; L347-N369 PolarHBondContact N-OD1 3.16Å; L347-S370 CarbonylContact O-C 3.21Å; L347-S370 VanDerWaalsContact O-C 3.23Å; L347-S370 WeakPolarHBondContact O-CA 3.46Å; L347-S370 VanDerWaalsContact O-CB 3.3Å; L347-S370 WeakPolarHBondContact O-CB 3.46Å; L347-S370 PolarHBondContact O-N 3.12Å; L347-I371 HydrophobicContact CB-CG1 4.28Å; L347-I371 PolarHBondContact O-N 3.41Å
348	N	98.3	Very high	97.1	Very high	73 Å²	73	43.9 Å²	43.9	39%	0.39	23%	0.232	S	C	.	.			trans	-141.2	-168.8	-176.4	67	20.9	0	0	0	111.3	G325 P326 S370	G325-N348 WeakPolarHBondContact CA-OD1 3.18Å; G325-N348 PolarHBondContact O-N 2.85Å; G325-N348 PolarHBondContact O-OD1 3.24Å; P326-N348 VanDerWaalsContact CA-O 3.26Å; P326-N348 WeakPolarHBondContact CA-O 3.43Å; N348-S370 WeakPolarHBondContact CA-O 3.49Å
349	G	98	Very high	97	Very high	26 Å²	26	42 Å²	42	27%	0.268	22%	0.221	S	C	.	.	S	Bend	trans	74.5	-168.4	-179.2	0	0	0	0	0	113	S372	G349-S372 PolarHBondContact O-N 3.01Å; G349-S372 PolarHBondContact O-OG 2.81Å
350	T	98.2	Very high	97.1	Very high	85 Å²	85	41 Å²	41	52%	0.521	22%	0.219	S	C	.	.	B	Isolated β-bridge	trans	-98.8	152.2	-179.7	56.1	0	0	0	0	111.2	S372	T350-S372 WeakPolarHBondContact CA-O 3.2Å
351	L	98.3	Very high	97.1	Very high	12 Å²	12	41.1 Å²	41.1	6%	0.063	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-77.2	145.6	170.5	-64.5	175.2	0	0	0	110.9	V327 A353 M366 I371 P376 M390	V327-L351 HydrophobicContact CB-CD2 4.06Å; V327-L351 HydrophobicContact CG2-CD2 3.74Å; L351-A353 PolarHBondContact O-N 2.9Å; L351-M366 HydrophobicContact CD1-SD 3.95Å; L351-M366 HydrophobicContact CD2-CE 4.29Å; L351-M366 HydrophobicContact CD2-SD 3.66Å; L351-M366 HydrophobicContact CG-SD 4.48Å; L351-I371 HydrophobicContact CD1-CG2 4.18Å; L351-I371 HydrophobicContact CD2-CD1 4.44Å; L351-I371 HydrophobicContact CD2-CG2 4.03Å; L351-I371 HydrophobicContact CG-CG2 3.73Å; L351-P376 HydrophobicContact CB-CG 3.7Å; L351-P376 HydrophobicContact CD1-CG 4.16Å; L351-M390 HydrophobicContact CD1-CE 3.25Å
352	P	97.5	Very high	97.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-56.8	127.8	172.2	-29.8	40	0	0	0	111.6	E329 V331 A332 D354 L355 P376	E329-P352 WeakPolarHBondContact OE2-CB 3.39Å; V331-P352 HydrophobicContact CG1-CB 4.44Å; V331-P352 HydrophobicContact CG1-CG 3.84Å; A332-P352 HydrophobicContact CB-CB 4.04Å; P352-D354 PolarHBondContact O-N 3.01Å; P352-D354 VanDerWaalsContact O-N 3.16Å; P352-L355 VanDerWaalsContact O-CB 3.29Å; P352-L355 WeakPolarHBondContact O-CB 3.48Å; P352-L355 PolarHBondContact O-N 3.41Å; P352-P376 WeakPolarHBondContact O-CG 3.45Å
353	A	95.9	Very high	97	Very high	63 Å²	63	40 Å²	40	52%	0.521	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.8	-173.2	0	0	0	0	0	114	L351	L351-A353 PolarHBondContact O-N 2.9Å
354	D	96.2	Very high	97.1	Very high	74 Å²	74	37.6 Å²	37.6	40%	0.396	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	7	179.1	-85.2	-10.3	0	0	0	113.1	A332 P352 G356 K357	A332-D354 HydrophobicContact CB-CB 4.07Å; P352-D354 PolarHBondContact O-N 3.01Å; P352-D354 VanDerWaalsContact O-N 3.16Å; D354-G356 PolarHBondContact O-N 3.13Å; D354-K357 HydrophobicContact CB-CB 4.37Å; D354-K357 HydrophobicContact CB-CD 3.92Å; D354-K357 VanDerWaalsContact CG-CD 3.42Å; D354-K357 WeakPolarHBondContact O-CB 3.46Å; D354-K357 PolarHBondContact O-N 3.46Å; D354-K357 VanDerWaalsContact OD1-CD 3.29Å; D354-K357 WeakPolarHBondContact OD1-CD 3.3Å; D354-K357 IonicContact OD1-NZ 2.73Å; D354-K357 PolarHBondContact OD1-NZ 2.82Å; D354-K357 IonicContact OD2-NZ 3.68Å; D354-K357 PolarHBondContact OD2-NZ 3.22Å
355	L	97.2	Very high	97.3	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	129.3	174.2	174.5	63.6	0	0	0	110.2	V331 P352 K357 L361 M366 P376 A378 I379	V331-L355 HydrophobicContact CG1-CD1 3.98Å; V331-L355 HydrophobicContact CG2-CD1 3.83Å; P352-L355 VanDerWaalsContact O-CB 3.29Å; P352-L355 WeakPolarHBondContact O-CB 3.48Å; P352-L355 PolarHBondContact O-N 3.41Å; L355-K357 VanDerWaalsContact C-N 3.33Å; L355-L361 HydrophobicContact CD1-CD1 4.14Å; L355-L361 HydrophobicContact CG-CD1 4.4Å; L355-M366 HydrophobicContact CD2-CE 3.97Å; L355-P376 HydrophobicContact CB-CB 4.13Å; L355-P376 HydrophobicContact CB-CG 4.04Å; L355-P376 HydrophobicContact CD2-CG 4.3Å; L355-A378 CarbonylContact O-C 3.52Å; L355-I379 HydrophobicContact CB-CD1 4.48Å; L355-I379 HydrophobicContact CD2-CD1 3.76Å; L355-I379 HydrophobicContact CG-CD1 3.67Å; L355-I379 VanDerWaalsContact O-CA 3.25Å; L355-I379 WeakPolarHBondContact O-CA 3.26Å; L355-I379 PolarHBondContact O-N 3.44Å
356	G	96	Very high	97.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	-10.6	-177.2	0	0	0	0	0	115.6	D354 N358 A378	D354-G356 PolarHBondContact O-N 3.13Å; G356-N358 PolarHBondContact O-N 2.94Å; G356-A378 CarbonylContact C-O 3.07Å; G356-A378 WeakPolarHBondContact CA-O 3.39Å
357	K	96	Very high	97.2	Very high	85 Å²	85	29.6 Å²	29.6	37%	0.37	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-42.4	178.5	-173.4	174.7	-177.1	173.5	0	113.1	D354 L355 A378	D354-K357 HydrophobicContact CB-CB 4.37Å; D354-K357 HydrophobicContact CB-CD 3.92Å; D354-K357 VanDerWaalsContact CG-CD 3.42Å; D354-K357 WeakPolarHBondContact O-CB 3.46Å; D354-K357 PolarHBondContact O-N 3.46Å; D354-K357 VanDerWaalsContact OD1-CD 3.29Å; D354-K357 WeakPolarHBondContact OD1-CD 3.3Å; D354-K357 IonicContact OD1-NZ 2.73Å; D354-K357 PolarHBondContact OD1-NZ 2.82Å; D354-K357 IonicContact OD2-NZ 3.68Å; D354-K357 PolarHBondContact OD2-NZ 3.22Å; L355-K357 VanDerWaalsContact C-N 3.33Å; K357-A378 HydrophobicContact CB-CB 3.88Å; K357-A378 HydrophobicContact CG-CB 4.43Å; K357-A378 PolarHBondContact N-O 3.03Å
358	N	93.9	Very high	97	Very high	83 Å²	83	33.9 Å²	33.9	44%	0.444	20%	0.199	S	C	.	.	S	Bend	trans	-108.3	-4.1	-175.3	-59.3	-54.2	0	0	0	113.5	A332 G356	A332-N358 PolarHBondContact O-ND2 3.22Å; G356-N358 PolarHBondContact O-N 2.94Å
359	S	96.5	Very high	97	Very high	1 Å²	1	31 Å²	31	1%	0.007	18%	0.184	C	C	.	.	S	Bend	trans	-115.7	130.3	-167.1	-48.7	0	0	0	0	110.4	A334 L361 R382	A334-S359 WeakPolarHBondContact O-CB 3.22Å; A334-S359 PolarHBondContact O-OG 3.35Å; S359-L361 PolarHBondContact O-N 3.46Å; S359-R382 WeakPolarHBondContact O-CG 3.3Å
360	P	96.5	Very high	97	Very high	37 Å²	37	31.7 Å²	31.7	24%	0.24	19%	0.185	C	C	.	.			trans	-76	57.6	175.4	34.7	-36.2	0	0	0	111	A335 L337 V338 V362 E384	A335-P360 WeakPolarHBondContact O-CD 3.33Å; L337-P360 CarbonylContact O-C 3.54Å; V338-P360 HydrophobicContact CG2-CG 4.29Å; P360-V362 PolarHBondContact O-N 3.38Å; P360-E384 HydrophobicContact CB-CG 4.24Å
361	L	98.3	Very high	97.1	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.016	16%	0.16	C	C	.	.			trans	-59.3	125.3	-178.4	-68	171.3	0	0	0	109.9	L337 L355 S359 V364 I379 E384 L385	L337-L361 HydrophobicContact CB-CD2 4.36Å; L337-L361 HydrophobicContact CD2-CD2 4.06Å; L337-L361 HydrophobicContact CG-CD2 3.93Å; L337-L361 PolarHBondContact O-N 2.62Å; L355-L361 HydrophobicContact CD1-CD1 4.14Å; L355-L361 HydrophobicContact CG-CD1 4.4Å; S359-L361 PolarHBondContact O-N 3.46Å; L361-V364 HydrophobicContact CB-CG2 4.19Å; L361-V364 HydrophobicContact CD1-CG2 3.87Å; L361-V364 HydrophobicContact CD2-CG2 4.17Å; L361-V364 HydrophobicContact CG-CG2 4.3Å; L361-I379 HydrophobicContact CD1-CD1 3.97Å; L361-E384 CarbonylContact O-C 3.09Å; L361-E384 VanDerWaalsContact O-C 3.24Å; L361-L385 HydrophobicContact CB-CD1 4.05Å; L361-L385 WeakPolarHBondContact O-CA 3.13Å; L361-L385 PolarHBondContact O-N 2.92Å
362	V	97.7	Very high	97.1	Very high	43 Å²	43	29 Å²	29	26%	0.261	17%	0.171	S	C	.	.	S	Bend	trans	-104.1	-41.3	174.5	170.9	0	0	0	0	110.2	V338 P360 E384 E386 E387	V338-V362 HydrophobicContact CG1-CB 3.78Å; V338-V362 HydrophobicContact CG1-CG2 3.66Å; V338-V362 PolarHBondContact O-N 3.23Å; P360-V362 PolarHBondContact O-N 3.38Å; V362-E384 HydrophobicContact CG2-CB 4.25Å; V362-E386 HydrophobicContact CG1-CB 4.23Å; V362-E386 HydrophobicContact CG1-CG 4.12Å; V362-E386 PolarHBondContact O-N 3.22Å; V362-E387 PolarHBondContact O-N 3.24Å
363	C	96.7	Very high	97.1	Very high	4 Å²	4	29.8 Å²	29.8	3%	0.027	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	122.3	-178.3	-177.3	0	0	0	0	110.6	V338 E339 L340 E387	V338-C363 PolarHBondContact O-N 2.9Å; E339-C363 HydrophobicContact CG-CB 4.31Å; L340-C363 PolarHBondContact N-O 2.99Å; C363-E387 PolarHBondContact SG-OE2 2.89Å
364	V	98.5	Very high	97.2	Very high	1 Å²	1	33 Å²	33	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	115.1	171.4	178.7	0	0	0	0	108.4	L340 L361 M366 I379 L385 E387 L388 L389	L340-V364 WeakPolarHBondContact O-CA 3.35Å; L361-V364 HydrophobicContact CB-CG2 4.19Å; L361-V364 HydrophobicContact CD1-CG2 3.87Å; L361-V364 HydrophobicContact CD2-CG2 4.17Å; L361-V364 HydrophobicContact CG-CG2 4.3Å; V364-M366 HydrophobicContact CG1-CE 3.96Å; V364-M366 HydrophobicContact CG1-CG 4.07Å; V364-M366 HydrophobicContact CG1-SD 4.29Å; V364-I379 HydrophobicContact CG2-CD1 4.42Å; V364-L385 HydrophobicContact CG2-CD1 3.99Å; V364-E387 PolarHBondContact N-O 2.96Å; V364-L388 HydrophobicContact CB-CD1 4.06Å; V364-L388 HydrophobicContact CG1-CD1 4.18Å; V364-L389 PolarHBondContact O-N 3.36Å
365	D	98	Very high	97.3	Very high	22 Å²	22	29.7 Å²	29.7	12%	0.118	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	110.7	172.7	-166.5	-11.2	0	0	0	110.9	L340 R341 L342 F343 S367 L389	L340-D365 PolarHBondContact O-N 3.49Å; R341-D365 CarbonylContact C-O 3.29Å; R341-D365 WeakPolarHBondContact CA-O 3.3Å; R341-D365 HydrophobicContact CG-CB 4.34Å; L342-D365 PolarHBondContact N-O 2.98Å; F343-D365 WeakPolarHBondContact CB-OD1 3.39Å; F343-D365 HydrophobicContact CD1-CB 4.01Å; F343-D365 WeakPolarHBondContact CD1-OD2 3.44Å; F343-D365 PolarHBondContact N-O 3.01Å; D365-S367 VanDerWaalsContact OD1-CB 3.26Å; D365-S367 WeakPolarHBondContact OD1-CB 3.49Å; D365-S367 PolarHBondContact OD1-N 2.88Å; D365-S367 VanDerWaalsContact OD1-N 3.07Å; D365-S367 PolarHBondContact OD1-OG 2.93Å; D365-L389 CarbonylContact C-O 3.16Å; D365-L389 WeakPolarHBondContact CA-O 3.25Å; D365-L389 HydrophobicContact CB-CB 4.1Å; D365-L389 HydrophobicContact CB-CD1 4.22Å
366	M	98.1	Very high	97.4	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	17%	0.165	C	C	.	.			trans	-125.9	23.2	178.9	-57.6	-176.5	174.1	0	0	111.6	L340 L342 L351 L355 V364 N369 I371 L389 M390 N393	L340-M366 HydrophobicContact CD2-CE 3.26Å; L340-M366 HydrophobicContact CG-CE 3.93Å; L342-M366 HydrophobicContact CB-CG 4.34Å; L342-M366 HydrophobicContact CD1-CE 4Å; L342-M366 HydrophobicContact CD1-CG 4.46Å; L351-M366 HydrophobicContact CD1-SD 3.95Å; L351-M366 HydrophobicContact CD2-CE 4.29Å; L351-M366 HydrophobicContact CD2-SD 3.66Å; L351-M366 HydrophobicContact CG-SD 4.48Å; L355-M366 HydrophobicContact CD2-CE 3.97Å; V364-M366 HydrophobicContact CG1-CE 3.96Å; V364-M366 HydrophobicContact CG1-CG 4.07Å; V364-M366 HydrophobicContact CG1-SD 4.29Å; M366-N369 PolarHBondContact O-ND2 3.47Å; M366-I371 HydrophobicContact CB-CD1 3.77Å; M366-I371 HydrophobicContact SD-CD1 4.22Å; M366-L389 PolarHBondContact N-O 2.9Å; M366-M390 HydrophobicContact SD-CE 4.42Å; M366-N393 PolarHBondContact O-ND2 2.99Å
367	S	97	Very high	97.4	Very high	8 Å²	8	33.2 Å²	33.2	6%	0.056	19%	0.188	C	C	.	.			trans	-62.5	161.4	-176	-50.5	0	0	0	0	112.8	F343 A344 D365 N369 L389 L391	F343-S367 CarbonylContact C-O 3.27Å; F343-S367 WeakPolarHBondContact CA-O 3.49Å; F343-S367 WeakPolarHBondContact CB-O 3.48Å; A344-S367 PolarHBondContact N-O 2.92Å; D365-S367 VanDerWaalsContact OD1-CB 3.26Å; D365-S367 WeakPolarHBondContact OD1-CB 3.49Å; D365-S367 PolarHBondContact OD1-N 2.88Å; D365-S367 VanDerWaalsContact OD1-N 3.07Å; D365-S367 PolarHBondContact OD1-OG 2.93Å; S367-N369 PolarHBondContact O-ND2 3.35Å; S367-L389 PolarHBondContact OG-O 3.47Å; S367-L391 CarbonylContact C-O 3.41Å; S367-L391 WeakPolarHBondContact CA-O 3.23Å; S367-L391 PolarHBondContact OG-N 3.11Å
368	D	95.4	Very high	97.4	Very high	89 Å²	89	29.5 Å²	29.5	48%	0.476	17%	0.173	S	C	.	.	S	Bend	trans	53	64.9	175.2	-173.8	25.7	0	0	0	112.8	A344 N345 L391 D392	A344-D368 WeakPolarHBondContact CA-O 3.34Å; A344-D368 PolarHBondContact N-O 3.01Å; N345-D368 PolarHBondContact N-O 2.96Å; N345-D368 VanDerWaalsContact N-O 3.15Å; D368-L391 PolarHBondContact N-O 3.43Å; D368-D392 WeakPolarHBondContact CA-O 3.24Å; D368-D392 HydrophobicContact CB-CB 4.48Å; D368-D392 PolarHBondContact N-O 3.05Å
369	N	98.2	Very high	97.5	Very high	14 Å²	14	25.8 Å²	25.8	8%	0.075	15%	0.153	C	C	.	.	S	Bend	trans	-146.2	-168.2	179.6	-87.3	-77	0	0	0	110.1	L342 N345 R346 L347 M366 S367 I371 D392 N393	L342-N369 PolarHBondContact O-ND2 3.17Å; N345-N369 WeakPolarHBondContact CA-OD1 3.34Å; N345-N369 WeakPolarHBondContact CB-OD1 3.45Å; N345-N369 PolarHBondContact O-OD1 2.97Å; R346-N369 PolarHBondContact N-OD1 3.26Å; L347-N369 HydrophobicContact CB-CB 4.42Å; L347-N369 VanDerWaalsContact CB-OD1 3.24Å; L347-N369 WeakPolarHBondContact CB-OD1 3.42Å; L347-N369 WeakPolarHBondContact CG-OD1 3.39Å; L347-N369 PolarHBondContact N-OD1 3.16Å; M366-N369 PolarHBondContact O-ND2 3.47Å; S367-N369 PolarHBondContact O-ND2 3.35Å; N369-I371 HydrophobicContact CB-CD1 4.09Å; N369-I371 HydrophobicContact CB-CG1 4.04Å; N369-D392 PolarHBondContact N-O 3.14Å; N369-D392 VanDerWaalsContact N-O 3.12Å; N369-N393 WeakPolarHBondContact CA-OD1 3.25Å; N369-N393 WeakPolarHBondContact CB-OD1 3.46Å; N369-N393 PolarHBondContact O-OD1 2.94Å
370	S	98.2	Very high	97.5	Very high	40 Å²	40	26.3 Å²	26.3	28%	0.28	16%	0.157	S	C	.	.			trans	-117.4	28.2	173.1	-82.5	0	0	0	0	112.5	L347 N348 K394	L347-S370 CarbonylContact O-C 3.21Å; L347-S370 VanDerWaalsContact O-C 3.23Å; L347-S370 WeakPolarHBondContact O-CA 3.46Å; L347-S370 VanDerWaalsContact O-CB 3.3Å; L347-S370 WeakPolarHBondContact O-CB 3.46Å; L347-S370 PolarHBondContact O-N 3.12Å; N348-S370 WeakPolarHBondContact CA-O 3.49Å; S370-K394 PolarHBondContact OG-NZ 2.93Å
371	I	98.7	Very high	97.5	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	17%	0.17	C	C	.	.			trans	-66	137.9	-179.3	-61	165.3	0	0	0	109.2	L347 L351 M366 N369 N393 K394 L395	L347-I371 HydrophobicContact CB-CG1 4.28Å; L347-I371 PolarHBondContact O-N 3.41Å; L351-I371 HydrophobicContact CD1-CG2 4.18Å; L351-I371 HydrophobicContact CD2-CD1 4.44Å; L351-I371 HydrophobicContact CD2-CG2 4.03Å; L351-I371 HydrophobicContact CG-CG2 3.73Å; M366-I371 HydrophobicContact CB-CD1 3.77Å; M366-I371 HydrophobicContact SD-CD1 4.22Å; N369-I371 HydrophobicContact CB-CD1 4.09Å; N369-I371 HydrophobicContact CB-CG1 4.04Å; I371-N393 VanDerWaalsContact CB-OD1 3.3Å; I371-N393 WeakPolarHBondContact CB-OD1 3.3Å; I371-N393 PolarHBondContact N-OD1 3.34Å; I371-K394 CarbonylContact O-C 3.58Å; I371-K394 WeakPolarHBondContact O-CA 3.39Å; I371-K394 WeakPolarHBondContact O-CB 3.41Å; I371-K394 PolarHBondContact O-N 3.31Å; I371-L395 HydrophobicContact CG2-CD2 3.89Å; I371-L395 PolarHBondContact O-N 3.26Å
372	S	98.4	Very high	97.3	Very high	40 Å²	40	36.4 Å²	36.4	28%	0.28	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	177.5	-174.5	62.3	0	0	0	0	111.3	G349 T350	G349-S372 PolarHBondContact O-N 3.01Å; G349-S372 PolarHBondContact O-OG 2.81Å; T350-S372 WeakPolarHBondContact CA-O 3.2Å
373	G	98.2	Very high	97.2	Very high	16 Å²	16	35.7 Å²	35.7	17%	0.165	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.3	-165.9	-177.5	0	0	0	0	0	112.6	L395 S396	G373-L395 CarbonylContact O-C 3.51Å; G373-L395 WeakPolarHBondContact O-CA 3Å; G373-S396 PolarHBondContact O-N 3.06Å
374	E	98.2	Very high	97.2	Very high	131 Å²	131	39.4 Å²	39.4	61%	0.612	22%	0.216	S	C	*	.	P	Polyproline II helix	trans	-85.2	152.9	-173.9	-61	-176.6	179.3	0	0	112.4	S396	E374-S396 WeakPolarHBondContact CA-O 3.14Å
375	I	98.4	Very high	97.2	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.015	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-66.2	126.9	166	-60.6	171.6	0	0	0	107.4	M390 L395 P400 L414 L419	I375-M390 HydrophobicContact CG1-SD 4.22Å; I375-M390 HydrophobicContact CG2-SD 4.27Å; I375-L395 HydrophobicContact CG1-CD1 4.23Å; I375-P400 HydrophobicContact CB-CG 4.27Å; I375-P400 HydrophobicContact CG2-CG 3.98Å; I375-L414 HydrophobicContact CD1-CD1 3.76Å; I375-L414 HydrophobicContact CD1-CD2 3.88Å; I375-L414 HydrophobicContact CD1-CG 4.44Å; I375-L419 HydrophobicContact CD1-CD1 4.07Å; I375-L419 HydrophobicContact CD1-CD2 3.91Å; I375-L419 HydrophobicContact CG1-CD2 4.24Å
376	P	97.7	Very high	97.1	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.013	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-53.5	126.2	-177.5	-29.8	36.8	0	0	0	112.2	L351 P352 L355 A378 I379	L351-P376 HydrophobicContact CB-CG 3.7Å; L351-P376 HydrophobicContact CD1-CG 4.16Å; P352-P376 WeakPolarHBondContact O-CG 3.45Å; L355-P376 HydrophobicContact CB-CB 4.13Å; L355-P376 HydrophobicContact CB-CG 4.04Å; L355-P376 HydrophobicContact CD2-CG 4.3Å; P376-A378 PolarHBondContact O-N 3.09Å; P376-I379 HydrophobicContact CB-CB 4.44Å; P376-I379 VanDerWaalsContact O-CB 3.31Å; P376-I379 WeakPolarHBondContact O-CB 3.07Å; P376-I379 WeakPolarHBondContact O-CG2 3.27Å; P376-I379 PolarHBondContact O-N 3.34Å
377	P	96.7	Very high	97	Very high	74 Å²	74	42.8 Å²	42.8	48%	0.481	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-26	-174.5	24.2	-34	0	0	0	113.2	P400	P377-P400 HydrophobicContact CB-CB 4.32Å
378	A	95.6	Very high	97	Very high	7 Å²	7	42.4 Å²	42.4	6%	0.058	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	10.4	-179.5	0	0	0	0	0	113.9	L355 G356 K357 P376 C380 D381	L355-A378 CarbonylContact O-C 3.52Å; G356-A378 CarbonylContact C-O 3.07Å; G356-A378 WeakPolarHBondContact CA-O 3.39Å; K357-A378 HydrophobicContact CB-CB 3.88Å; K357-A378 HydrophobicContact CG-CB 4.43Å; K357-A378 PolarHBondContact N-O 3.03Å; P376-A378 PolarHBondContact O-N 3.09Å; A378-C380 PolarHBondContact O-N 3.48Å; A378-D381 HydrophobicContact CB-CB 4.44Å; A378-D381 WeakPolarHBondContact CB-OD2 3.3Å; A378-D381 PolarHBondContact O-N 2.91Å
379	I	96.9	Very high	97.1	Very high	4 Å²	4	39 Å²	39	2%	0.021	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-18.9	-171.7	-165.2	59.3	0	0	0	114.7	L355 L361 V364 P376 L385 L388 L403	L355-I379 HydrophobicContact CB-CD1 4.48Å; L355-I379 HydrophobicContact CD2-CD1 3.76Å; L355-I379 HydrophobicContact CG-CD1 3.67Å; L355-I379 VanDerWaalsContact O-CA 3.25Å; L355-I379 WeakPolarHBondContact O-CA 3.26Å; L355-I379 PolarHBondContact O-N 3.44Å; L361-I379 HydrophobicContact CD1-CD1 3.97Å; V364-I379 HydrophobicContact CG2-CD1 4.42Å; P376-I379 HydrophobicContact CB-CB 4.44Å; P376-I379 VanDerWaalsContact O-CB 3.31Å; P376-I379 WeakPolarHBondContact O-CB 3.07Å; P376-I379 WeakPolarHBondContact O-CG2 3.27Å; P376-I379 PolarHBondContact O-N 3.34Å; I379-L385 HydrophobicContact CG1-CD2 4.32Å; I379-L385 HydrophobicContact CG2-CD2 4.44Å; I379-L388 HydrophobicContact CG1-CD1 4.16Å; I379-L403 HydrophobicContact CG2-CD2 3.78Å; I379-L403 HydrophobicContact CG2-CG 4.39Å
380	C	96.2	Very high	97.1	Very high	13 Å²	13	38.5 Å²	38.5	9%	0.088	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-139.1	25.5	-176.4	175.7	0	0	0	0	112.4	A378 R382 G383 L385 C406	A378-C380 PolarHBondContact O-N 3.48Å; C380-R382 PolarHBondContact O-N 3.05Å; C380-R382 VanDerWaalsContact O-N 3.1Å; C380-G383 PolarHBondContact O-N 3.39Å; C380-L385 HydrophobicContact CB-CB 3.91Å; C380-L385 HydrophobicContact CB-CD2 3.85Å; C380-C406 HydrophobicContact CB-CB 4.21Å; C380-C406 WeakPolarHBondContact CB-SG 3.42Å; C380-C406 WeakPolarHBondContact SG-CB 3.4Å; C380-C406 CovalentContact SG-SG 2Å; C380-C406 PolarHBondContact SG-SG 2.83Å
381	D	95.4	Very high	97	Very high	98 Å²	98	37.5 Å²	37.5	52%	0.524	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-23	179.4	-86.3	2.7	0	0	0	113.1	A378 G383	A378-D381 HydrophobicContact CB-CB 4.44Å; A378-D381 WeakPolarHBondContact CB-OD2 3.3Å; A378-D381 PolarHBondContact O-N 2.91Å; D381-G383 VanDerWaalsContact C-N 3.35Å
382	R	95.3	Very high	96.9	Very high	153 Å²	153	40.6 Å²	40.6	58%	0.577	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-10.2	173.1	-59.1	-59.9	-67.6	-170.4	-5.7	114.2	S359 C380 E384	S359-R382 WeakPolarHBondContact O-CG 3.3Å; C380-R382 PolarHBondContact O-N 3.05Å; C380-R382 VanDerWaalsContact O-N 3.1Å; R382-E384 VanDerWaalsContact C-N 3.26Å; R382-E384 PolarHBondContact O-N 2.95Å
383	G	95.2	Very high	96.9	Very high	29 Å²	29	39.3 Å²	39.3	30%	0.299	21%	0.205	S	C	.	.	S	Bend	trans	74.1	5.2	173.7	0	0	0	0	0	116.3	C380 D381 R408	C380-G383 PolarHBondContact O-N 3.39Å; D381-G383 VanDerWaalsContact C-N 3.35Å; G383-R408 VanDerWaalsContact O-CG 3.26Å; G383-R408 WeakPolarHBondContact O-CG 3.45Å
384	E	96.5	Very high	96.9	Very high	82 Å²	82	42.8 Å²	42.8	38%	0.383	22%	0.216	S	C	.	.			trans	-93.6	-7.6	-176.2	-61	-56.7	154.6	0	0	114.2	P360 L361 V362 R382 E386	P360-E384 HydrophobicContact CB-CG 4.24Å; L361-E384 CarbonylContact O-C 3.09Å; L361-E384 VanDerWaalsContact O-C 3.24Å; V362-E384 HydrophobicContact CG2-CB 4.25Å; R382-E384 VanDerWaalsContact C-N 3.26Å; R382-E384 PolarHBondContact O-N 2.95Å; E384-E386 PolarHBondContact O-N 3.03Å
385	L	98.2	Very high	97	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.			trans	-65.4	120.3	-172.8	-166.2	66.3	0	0	0	111.8	L361 V364 I379 C380 L388 L403 R408 L409	L361-L385 HydrophobicContact CB-CD1 4.05Å; L361-L385 WeakPolarHBondContact O-CA 3.13Å; L361-L385 PolarHBondContact O-N 2.92Å; V364-L385 HydrophobicContact CG2-CD1 3.99Å; I379-L385 HydrophobicContact CG1-CD2 4.32Å; I379-L385 HydrophobicContact CG2-CD2 4.44Å; C380-L385 HydrophobicContact CB-CB 3.91Å; C380-L385 HydrophobicContact CB-CD2 3.85Å; L385-L388 HydrophobicContact CD2-CB 4.16Å; L385-L388 HydrophobicContact CD2-CD1 4.47Å; L385-L403 HydrophobicContact CD2-CD2 4.48Å; L385-R408 CarbonylContact O-C 3.45Å; L385-R408 VanDerWaalsContact O-C 3.27Å; L385-R408 WeakPolarHBondContact O-CB 3.19Å; L385-L409 HydrophobicContact CB-CD2 4.28Å; L385-L409 HydrophobicContact CD2-CD2 4.03Å; L385-L409 HydrophobicContact CG-CD2 3.86Å; L385-L409 WeakPolarHBondContact O-CA 3.49Å; L385-L409 WeakPolarHBondContact O-CG 3.26Å; L385-L409 PolarHBondContact O-N 3.06Å; L385-L409 VanDerWaalsContact O-N 3.09Å
386	E	96.3	Very high	97	Very high	52 Å²	52	38.6 Å²	38.6	24%	0.243	20%	0.201	C	C	.	.			trans	-102.2	-36.2	175.9	-64.7	-157.7	179.2	0	0	111.9	V362 E384 R408 R410 R411	V362-E386 HydrophobicContact CG1-CB 4.23Å; V362-E386 HydrophobicContact CG1-CG 4.12Å; V362-E386 PolarHBondContact O-N 3.22Å; E384-E386 PolarHBondContact O-N 3.03Å; E386-R408 HydrophobicContact CG-CB 4.19Å; E386-R410 PolarHBondContact O-N 3.07Å; E386-R410 WeakPolarHBondContact OE2-CD 3.48Å; E386-R410 IonicContact OE2-CZ 3.46Å; E386-R410 IonicContact OE2-NE 3.52Å; E386-R410 PolarHBondContact OE2-NE 2.91Å; E386-R411 PolarHBondContact O-N 3.4Å; E386-R411 VanDerWaalsContact O-N 3.17Å
387	E	95.4	Very high	97	Very high	43 Å²	43	39.1 Å²	39.1	20%	0.201	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	123.9	-174.9	-57.4	-172.4	152.9	0	0	111.9	V362 C363 V364 R411	V362-E387 PolarHBondContact O-N 3.24Å; C363-E387 PolarHBondContact SG-OE2 2.89Å; V364-E387 PolarHBondContact N-O 2.96Å; E387-R411 WeakPolarHBondContact CA-O 3.36Å; E387-R411 HydrophobicContact CG-CB 4.3Å; E387-R411 HydrophobicContact CG-CG 4.49Å; E387-R411 WeakPolarHBondContact OE1-CD 3.3Å
388	L	98.5	Very high	97	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	104	173.1	-177.1	63.2	0	0	0	109.8	V364 I379 L385 M390 L403 L409 R411 V412 R413 L414	V364-L388 HydrophobicContact CB-CD1 4.06Å; V364-L388 HydrophobicContact CG1-CD1 4.18Å; I379-L388 HydrophobicContact CG1-CD1 4.16Å; L385-L388 HydrophobicContact CD2-CB 4.16Å; L385-L388 HydrophobicContact CD2-CD1 4.47Å; L388-M390 HydrophobicContact CD1-CG 4.01Å; L388-M390 HydrophobicContact CD1-SD 3.78Å; L388-M390 HydrophobicContact CG-CG 4.37Å; L388-M390 HydrophobicContact CG-SD 4.29Å; L388-L403 HydrophobicContact CD2-CD1 4.05Å; L388-L403 HydrophobicContact CD2-CD2 3.8Å; L388-L409 HydrophobicContact CB-CD2 4.45Å; L388-R411 PolarHBondContact N-O 2.86Å; L388-V412 WeakPolarHBondContact O-CA 3.15Å; L388-R413 PolarHBondContact O-N 3.35Å; L388-L414 HydrophobicContact CG-CD2 4.5Å
389	L	97.4	Very high	97.2	Very high	17 Å²	17	44.1 Å²	44.1	9%	0.089	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	113.2	-175	-43.4	180	0	0	0	108.9	V364 D365 M366 S367 R411 R413	V364-L389 PolarHBondContact O-N 3.36Å; D365-L389 CarbonylContact C-O 3.16Å; D365-L389 WeakPolarHBondContact CA-O 3.25Å; D365-L389 HydrophobicContact CB-CB 4.1Å; D365-L389 HydrophobicContact CB-CD1 4.22Å; M366-L389 PolarHBondContact N-O 2.9Å; S367-L389 PolarHBondContact OG-O 3.47Å; L389-R411 HydrophobicContact CD2-CB 4.33Å; L389-R413 HydrophobicContact CD2-CB 3.92Å; L389-R413 HydrophobicContact CD2-CG 3.65Å
390	M	98.4	Very high	97.2	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.015	22%	0.218	C	C	.	.			trans	-143.9	30.9	-176.7	-49	179.5	78.4	0	0	111.5	L351 M366 I375 L388 L395 R413 L414 N417	L351-M390 HydrophobicContact CD1-CE 3.25Å; M366-M390 HydrophobicContact SD-CE 4.42Å; I375-M390 HydrophobicContact CG1-SD 4.22Å; I375-M390 HydrophobicContact CG2-SD 4.27Å; L388-M390 HydrophobicContact CD1-CG 4.01Å; L388-M390 HydrophobicContact CD1-SD 3.78Å; L388-M390 HydrophobicContact CG-CG 4.37Å; L388-M390 HydrophobicContact CG-SD 4.29Å; M390-L395 HydrophobicContact CB-CD1 3.67Å; M390-L395 HydrophobicContact CE-CD1 3.7Å; M390-L395 HydrophobicContact CE-CD2 4.13Å; M390-L395 HydrophobicContact CG-CD1 4.48Å; M390-L395 HydrophobicContact SD-CD1 4.06Å; M390-R413 PolarHBondContact N-O 3.48Å; M390-L414 HydrophobicContact CB-CD2 3.86Å; M390-L414 HydrophobicContact CG-CD2 4.13Å; M390-L414 HydrophobicContact SD-CD2 4.23Å; M390-N417 PolarHBondContact O-ND2 3.25Å
391	L	95.8	Very high	97.1	Very high	20 Å²	20	49.8 Å²	49.8	11%	0.105	25%	0.246	C	C	.	.			trans	-66.7	161.5	179.7	59.5	85.6	0	0	0	111.7	S367 D368 N393 R413 S415	S367-L391 CarbonylContact C-O 3.41Å; S367-L391 WeakPolarHBondContact CA-O 3.23Å; S367-L391 PolarHBondContact OG-N 3.11Å; D368-L391 PolarHBondContact N-O 3.43Å; L391-N393 PolarHBondContact O-ND2 2.87Å; L391-R413 HydrophobicContact CD2-CB 4.03Å; L391-R413 VanDerWaalsContact CD2-CZ 3.4Å; L391-R413 PolarHBondContact N-O 3.27Å; L391-S415 CarbonylContact C-O 3.17Å; L391-S415 WeakPolarHBondContact CA-O 3.32Å; L391-S415 WeakPolarHBondContact CB-O 3.49Å; L391-S415 VanDerWaalsContact CB-OG 3.26Å; L391-S415 WeakPolarHBondContact CB-OG 3.47Å
392	D	96.6	Very high	97.1	Very high	65 Å²	65	46 Å²	46	35%	0.348	23%	0.229	S	C	.	.	S	Bend	trans	54.4	60.8	177	-61.9	-44.2	0	0	0	112.8	D368 N369 S415 N416	D368-D392 WeakPolarHBondContact CA-O 3.24Å; D368-D392 HydrophobicContact CB-CB 4.48Å; D368-D392 PolarHBondContact N-O 3.05Å; N369-D392 PolarHBondContact N-O 3.14Å; N369-D392 VanDerWaalsContact N-O 3.12Å; D392-S415 PolarHBondContact N-O 2.75Å; D392-N416 VanDerWaalsContact OD1-CB 3.3Å; D392-N416 WeakPolarHBondContact OD1-CB 3.33Å; D392-N416 PolarHBondContact OD1-ND2 3.31Å
393	N	98.5	Very high	97.1	Very high	14 Å²	14	38.9 Å²	38.9	8%	0.075	20%	0.203	C	C	.	.	S	Bend	trans	-139.8	-168.3	179.1	-89.4	-76.5	0	0	0	110.9	M366 N369 I371 L391 L395 N416 N417	M366-N393 PolarHBondContact O-ND2 2.99Å; N369-N393 WeakPolarHBondContact CA-OD1 3.25Å; N369-N393 WeakPolarHBondContact CB-OD1 3.46Å; N369-N393 PolarHBondContact O-OD1 2.94Å; I371-N393 VanDerWaalsContact CB-OD1 3.3Å; I371-N393 WeakPolarHBondContact CB-OD1 3.3Å; I371-N393 PolarHBondContact N-OD1 3.34Å; L391-N393 PolarHBondContact O-ND2 2.87Å; N393-L395 HydrophobicContact CB-CD1 4.36Å; N393-L395 HydrophobicContact CB-CG 4.18Å; N393-N416 PolarHBondContact N-O 3.16Å; N393-N417 WeakPolarHBondContact CA-OD1 3.23Å; N393-N417 WeakPolarHBondContact CB-OD1 3.43Å; N393-N417 PolarHBondContact O-OD1 3.5Å
394	K	98.5	Very high	97.1	Very high	89 Å²	89	37.7 Å²	37.7	39%	0.387	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	25.5	177	-59.3	172.5	-176.5	160.6	0	111.4	S370 I371 N417	S370-K394 PolarHBondContact OG-NZ 2.93Å; I371-K394 CarbonylContact O-C 3.58Å; I371-K394 WeakPolarHBondContact O-CA 3.39Å; I371-K394 WeakPolarHBondContact O-CB 3.41Å; I371-K394 PolarHBondContact O-N 3.31Å; K394-N417 PolarHBondContact N-OD1 3.28Å
395	L	98.7	Very high	96.9	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	141.8	-179.5	-63.3	164.2	0	0	0	110	I371 G373 I375 M390 N393 N417 R418 L419	I371-L395 HydrophobicContact CG2-CD2 3.89Å; I371-L395 PolarHBondContact O-N 3.26Å; G373-L395 CarbonylContact O-C 3.51Å; G373-L395 WeakPolarHBondContact O-CA 3Å; I375-L395 HydrophobicContact CG1-CD1 4.23Å; M390-L395 HydrophobicContact CB-CD1 3.67Å; M390-L395 HydrophobicContact CE-CD1 3.7Å; M390-L395 HydrophobicContact CE-CD2 4.13Å; M390-L395 HydrophobicContact CG-CD1 4.48Å; M390-L395 HydrophobicContact SD-CD1 4.06Å; N393-L395 HydrophobicContact CB-CD1 4.36Å; N393-L395 HydrophobicContact CB-CG 4.18Å; L395-N417 HydrophobicContact CB-CB 4.32Å; L395-N417 VanDerWaalsContact CB-OD1 3.25Å; L395-N417 WeakPolarHBondContact CB-OD1 3.49Å; L395-N417 WeakPolarHBondContact CG-OD1 3.43Å; L395-N417 PolarHBondContact N-OD1 2.82Å; L395-R418 CarbonylContact O-C 2.99Å; L395-R418 WeakPolarHBondContact O-CA 3.25Å; L395-R418 VanDerWaalsContact O-CB 3.27Å; L395-R418 WeakPolarHBondContact O-CB 3.46Å; L395-R418 PolarHBondContact O-N 2.97Å; L395-L419 HydrophobicContact CB-CD2 4.05Å; L395-L419 PolarHBondContact O-N 2.72Å
396	S	98.4	Very high	96.7	Very high	46 Å²	46	43 Å²	43	32%	0.322	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	170.8	-175.8	58.4	0	0	0	0	110.9	G373 E374	G373-S396 PolarHBondContact O-N 3.06Å; E374-S396 WeakPolarHBondContact CA-O 3.14Å
397	G	98.1	Very high	96.7	Very high	13 Å²	13	47.8 Å²	47.8	13%	0.134	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80.1	-169.8	-177.7	0	0	0	0	0	112	L419 D420	G397-L419 WeakPolarHBondContact O-CA 3.39Å; G397-D420 WeakPolarHBondContact CA-OD1 3.38Å; G397-D420 PolarHBondContact O-N 3.45Å
398	R	98.1	Very high	96.7	Very high	179 Å²	179	51.7 Å²	51.7	68%	0.675	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	151.6	-170.8	-59.3	-176.5	-177.2	-175.4	-0.6	112.3	D420	R398-D420 WeakPolarHBondContact CA-O 3.46Å
399	I	98.3	Very high	96.7	Very high	6 Å²	6	51.7 Å²	51.7	3%	0.031	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-63.9	124.1	163.4	-61.3	178.1	0	0	0	107.8	L403 L414 L419 V423 P424 L438 L443	I399-L403 HydrophobicContact CG2-CD1 3.66Å; I399-L414 HydrophobicContact CD1-CD1 4.13Å; I399-L414 HydrophobicContact CG1-CD1 4.21Å; I399-L419 HydrophobicContact CG1-CD1 4.3Å; I399-V423 HydrophobicContact CD1-CG1 4.45Å; I399-V423 HydrophobicContact CD1-CG2 4.16Å; I399-P424 HydrophobicContact CG2-CG 4.38Å; I399-P424 WeakPolarHBondContact O-CG 2.96Å; I399-L438 HydrophobicContact CD1-CD1 4.16Å; I399-L438 HydrophobicContact CD1-CD2 3.93Å; I399-L443 HydrophobicContact CD1-CD1 4.23Å; I399-L443 HydrophobicContact CD1-CD2 3.95Å; I399-L443 HydrophobicContact CG1-CD2 4.2Å
400	P	97.1	Very high	96.5	Very high	14 Å²	14	56 Å²	56	9%	0.091	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-69.8	137.9	-171.3	23.5	-32.3	0	0	0	112.9	I375 P377 G402 L403	I375-P400 HydrophobicContact CB-CG 4.27Å; I375-P400 HydrophobicContact CG2-CG 3.98Å; P377-P400 HydrophobicContact CB-CB 4.32Å; P400-G402 PolarHBondContact O-N 2.82Å; P400-G402 VanDerWaalsContact O-N 3.09Å; P400-L403 HydrophobicContact CG-CD1 3.83Å; P400-L403 HydrophobicContact CG-CG 4.04Å; P400-L403 WeakPolarHBondContact O-CB 3.21Å; P400-L403 PolarHBondContact O-N 3.42Å
401	D	95.4	Very high	96.4	Very high	123 Å²	123	58 Å²	58	66%	0.658	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-56.9	-28.2	179.4	-71.6	-32.1	0	0	0	113.3	L403 G404 P424	D401-L403 PolarHBondContact O-N 2.7Å; D401-G404 PolarHBondContact O-N 2.63Å; D401-G404 VanDerWaalsContact O-N 3.08Å; D401-P424 WeakPolarHBondContact OD1-CB 3.35Å; D401-P424 WeakPolarHBondContact OD1-CG 3.46Å
402	G	93.6	Very high	96.5	Very high	18 Å²	18	57.3 Å²	57.3	19%	0.186	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-55.5	-33.2	176.4	0	0	0	0	0	113.2	P400 G404 R405	P400-G402 PolarHBondContact O-N 2.82Å; P400-G402 VanDerWaalsContact O-N 3.09Å; G402-G404 PolarHBondContact O-N 3.26Å; G402-R405 WeakPolarHBondContact O-CB 3.35Å; G402-R405 PolarHBondContact O-N 3.12Å
403	L	96.2	Very high	96.6	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.016	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-61.4	-30.2	177.8	-72.6	171.2	0	0	0	112.7	I379 L385 L388 I399 P400 D401 R405 C406 L409 V427	I379-L403 HydrophobicContact CG2-CD2 3.78Å; I379-L403 HydrophobicContact CG2-CG 4.39Å; L385-L403 HydrophobicContact CD2-CD2 4.48Å; L388-L403 HydrophobicContact CD2-CD1 4.05Å; L388-L403 HydrophobicContact CD2-CD2 3.8Å; I399-L403 HydrophobicContact CG2-CD1 3.66Å; P400-L403 HydrophobicContact CG-CD1 3.83Å; P400-L403 HydrophobicContact CG-CG 4.04Å; P400-L403 WeakPolarHBondContact O-CB 3.21Å; P400-L403 PolarHBondContact O-N 3.42Å; D401-L403 PolarHBondContact O-N 2.7Å; L403-R405 PolarHBondContact O-N 2.92Å; L403-R405 VanDerWaalsContact O-N 3.16Å; L403-C406 VanDerWaalsContact O-CB 3.29Å; L403-C406 WeakPolarHBondContact O-CB 3.3Å; L403-C406 PolarHBondContact O-N 2.82Å; L403-C406 VanDerWaalsContact O-N 3.11Å; L403-L409 HydrophobicContact CD2-CD1 3.9Å; L403-V427 HydrophobicContact CB-CG2 3.99Å
404	G	94.4	Very high	96.6	Very high	4 Å²	4	56.9 Å²	56.9	4%	0.041	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-64.7	-15.9	175	0	0	0	0	0	114.1	D401 G402	D401-G404 PolarHBondContact O-N 2.63Å; D401-G404 VanDerWaalsContact O-N 3.08Å; G402-G404 PolarHBondContact O-N 3.26Å
405	R	93	Very high	96.6	Very high	194 Å²	194	53 Å²	53	73%	0.732	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-93	-9.2	176.9	-57.6	179.5	-173.3	154.7	3.7	112.9	G402 L403 R407	G402-R405 WeakPolarHBondContact O-CB 3.35Å; G402-R405 PolarHBondContact O-N 3.12Å; L403-R405 PolarHBondContact O-N 2.92Å; L403-R405 VanDerWaalsContact O-N 3.16Å; R405-R407 PolarHBondContact O-N 3.27Å
406	C	94.9	Very high	96.5	Very high	0 Å²	0	57 Å²	57	0%	0	25%	0.252	C	S	.	.			trans	-79.9	79.6	-175.3	-62	0	0	0	0	112.4	C380 L403 R408 L409 L430	C380-C406 HydrophobicContact CB-CB 4.21Å; C380-C406 WeakPolarHBondContact CB-SG 3.42Å; C380-C406 WeakPolarHBondContact SG-CB 3.4Å; C380-C406 CovalentContact SG-SG 2Å; C380-C406 PolarHBondContact SG-SG 2.83Å; L403-C406 VanDerWaalsContact O-CB 3.29Å; L403-C406 WeakPolarHBondContact O-CB 3.3Å; L403-C406 PolarHBondContact O-N 2.82Å; L403-C406 VanDerWaalsContact O-N 3.11Å; C406-R408 PolarHBondContact O-N 2.8Å; C406-R408 VanDerWaalsContact O-N 3.11Å; C406-L409 HydrophobicContact CB-CB 4.36Å; C406-L409 HydrophobicContact CB-CD1 3.42Å; C406-L409 VanDerWaalsContact CB-CD1 3.42Å; C406-L409 HydrophobicContact CB-CG 3.61Å; C406-L409 PolarHBondContact O-N 3.41Å; C406-L409 VanDerWaalsContact O-N 3.13Å; C406-L430 WeakPolarHBondContact O-CD2 3.19Å
407	R	94.4	Very high	96.5	Very high	152 Å²	152	55.4 Å²	55.4	57%	0.574	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-22.9	-174.4	-60.3	-59.3	-173.8	174.1	-0.1	113.4	R405 H432	R405-R407 PolarHBondContact O-N 3.27Å; R407-H432 PolarHBondContact O-CD2 3.25Å
408	R	96.4	Very high	96.6	Very high	125 Å²	125	61.5 Å²	61.5	47%	0.472	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-14.8	178.8	-67.8	-71.8	-175.4	165.8	1.2	114.6	G383 L385 E386 C406 R410	G383-R408 VanDerWaalsContact O-CG 3.26Å; G383-R408 WeakPolarHBondContact O-CG 3.45Å; L385-R408 CarbonylContact O-C 3.45Å; L385-R408 VanDerWaalsContact O-C 3.27Å; L385-R408 WeakPolarHBondContact O-CB 3.19Å; E386-R408 HydrophobicContact CG-CB 4.19Å; C406-R408 PolarHBondContact O-N 2.8Å; C406-R408 VanDerWaalsContact O-N 3.11Å; R408-R410 PolarHBondContact O-N 2.03Å
409	L	97.8	Very high	96.6	Very high	1 Å²	1	53 Å²	53	1%	0.005	23%	0.227	C	C	.	.			trans	-59.2	127.5	-175.5	-84.1	174.3	0	0	0	111.8	L385 L388 L403 C406 V412 L430 H432 M433	L385-L409 HydrophobicContact CB-CD2 4.28Å; L385-L409 HydrophobicContact CD2-CD2 4.03Å; L385-L409 HydrophobicContact CG-CD2 3.86Å; L385-L409 WeakPolarHBondContact O-CA 3.49Å; L385-L409 WeakPolarHBondContact O-CG 3.26Å; L385-L409 PolarHBondContact O-N 3.06Å; L385-L409 VanDerWaalsContact O-N 3.09Å; L388-L409 HydrophobicContact CB-CD2 4.45Å; L403-L409 HydrophobicContact CD2-CD1 3.9Å; C406-L409 HydrophobicContact CB-CB 4.36Å; C406-L409 HydrophobicContact CB-CD1 3.42Å; C406-L409 VanDerWaalsContact CB-CD1 3.42Å; C406-L409 HydrophobicContact CB-CG 3.61Å; C406-L409 PolarHBondContact O-N 3.41Å; C406-L409 VanDerWaalsContact O-N 3.13Å; L409-V412 HydrophobicContact CD1-CG2 4.08Å; L409-V412 HydrophobicContact CD2-CG2 4.11Å; L409-L430 HydrophobicContact CB-CD1 4.18Å; L409-L430 HydrophobicContact CD1-CD1 3.99Å; L409-H432 CarbonylContact O-C 3.44Å; L409-M433 HydrophobicContact CB-CE 3.97Å; L409-M433 WeakPolarHBondContact O-CA 3.19Å; L409-M433 PolarHBondContact O-N 3.12Å; L409-M433 VanDerWaalsContact O-N 3.15Å
410	R	94.7	Very high	96.6	Very high	107 Å²	107	55.9 Å²	55.9	40%	0.404	24%	0.243	S	C	.	.			trans	-112	-35.3	176.8	-61.8	176.8	-176.8	-87	-1.4	112.1	E386 R408 H432 S434 L435	E386-R410 PolarHBondContact O-N 3.07Å; E386-R410 WeakPolarHBondContact OE2-CD 3.48Å; E386-R410 IonicContact OE2-CZ 3.46Å; E386-R410 IonicContact OE2-NE 3.52Å; E386-R410 PolarHBondContact OE2-NE 2.91Å; R408-R410 PolarHBondContact O-N 2.03Å; R410-H432 WeakPolarHBondContact CA-O 3.39Å; R410-H432 HydrophobicContact CG-CB 4.49Å; R410-S434 PolarHBondContact O-N 3.06Å; R410-S434 PolarHBondContact O-OG 3.06Å; R410-L435 PolarHBondContact O-N 2.9Å; R410-L435 VanDerWaalsContact O-N 3.15Å
411	R	95.6	Very high	96.6	Very high	46 Å²	46	55.8 Å²	55.8	17%	0.174	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	121.1	-171.8	-56.7	178.5	71.1	133.4	-0.7	110.4	E386 E387 L388 L389 L435	E386-R411 PolarHBondContact O-N 3.4Å; E386-R411 VanDerWaalsContact O-N 3.17Å; E387-R411 WeakPolarHBondContact CA-O 3.36Å; E387-R411 HydrophobicContact CG-CB 4.3Å; E387-R411 HydrophobicContact CG-CG 4.49Å; E387-R411 WeakPolarHBondContact OE1-CD 3.3Å; L388-R411 PolarHBondContact N-O 2.86Å; L389-R411 HydrophobicContact CD2-CB 4.33Å; R411-L435 WeakPolarHBondContact CA-O 3.1Å; R411-L435 HydrophobicContact CG-CB 4.36Å
412	V	98.5	Very high	96.8	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.024	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	117.1	172.1	174.6	0	0	0	0	107.7	L388 L409 L414 M433 L435 L436 E437 L438	L388-V412 WeakPolarHBondContact O-CA 3.15Å; L409-V412 HydrophobicContact CD1-CG2 4.08Å; L409-V412 HydrophobicContact CD2-CG2 4.11Å; V412-L414 HydrophobicContact CG1-CD1 3.82Å; V412-L414 HydrophobicContact CG1-CG 3.81Å; V412-M433 HydrophobicContact CB-CE 4.41Å; V412-M433 HydrophobicContact CB-SD 4.41Å; V412-M433 HydrophobicContact CG2-CE 3.69Å; V412-M433 HydrophobicContact CG2-SD 4.11Å; V412-L435 PolarHBondContact N-O 3.44Å; V412-L436 HydrophobicContact CB-CD1 3.84Å; V412-L436 HydrophobicContact CG1-CD1 3.96Å; V412-E437 PolarHBondContact O-N 2.87Å; V412-L438 HydrophobicContact CG1-CD2 4.37Å
413	R	98	Very high	97	Very high	71 Å²	71	54 Å²	54	27%	0.268	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	106.9	176.9	-55.3	-177.4	78.2	-163.5	-5.5	109.4	L388 L389 M390 L391 L435 E437	L388-R413 PolarHBondContact O-N 3.35Å; L389-R413 HydrophobicContact CD2-CB 3.92Å; L389-R413 HydrophobicContact CD2-CG 3.65Å; M390-R413 PolarHBondContact N-O 3.48Å; L391-R413 HydrophobicContact CD2-CB 4.03Å; L391-R413 VanDerWaalsContact CD2-CZ 3.4Å; L391-R413 PolarHBondContact N-O 3.27Å; R413-L435 HydrophobicContact CG-CD2 3.84Å; R413-L435 HydrophobicContact CG-CG 4.34Å; R413-E437 WeakPolarHBondContact CA-O 3.43Å; R413-E437 HydrophobicContact CB-CB 4.34Å; R413-E437 HydrophobicContact CG-CB 4.14Å; R413-E437 IonicContact CZ-OE1 2.63Å; R413-E437 IonicContact CZ-OE2 2.9Å; R413-E437 IonicContact NE-OE1 2.68Å; R413-E437 IonicContact NE-OE2 2.76Å; R413-E437 PolarHBondContact NE-OE2 2.93Å; R413-E437 IonicContact NH2-OE1 2.73Å; R413-E437 PolarHBondContact NH2-OE1 2.87Å; R413-E437 IonicContact NH2-OE2 2.77Å; R413-E437 PolarHBondContact NH2-OE2 2.98Å
414	L	98.7	Very high	97	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	23%	0.233	C	C	.	.			trans	-124.5	21	-177.3	-56.6	176	0	0	0	111.1	I375 L388 M390 I399 V412 N417 L419 E437 L438 N441	I375-L414 HydrophobicContact CD1-CD1 3.76Å; I375-L414 HydrophobicContact CD1-CD2 3.88Å; I375-L414 HydrophobicContact CD1-CG 4.44Å; L388-L414 HydrophobicContact CG-CD2 4.5Å; M390-L414 HydrophobicContact CB-CD2 3.86Å; M390-L414 HydrophobicContact CG-CD2 4.13Å; M390-L414 HydrophobicContact SD-CD2 4.23Å; I399-L414 HydrophobicContact CD1-CD1 4.13Å; I399-L414 HydrophobicContact CG1-CD1 4.21Å; V412-L414 HydrophobicContact CG1-CD1 3.82Å; V412-L414 HydrophobicContact CG1-CG 3.81Å; L414-N417 PolarHBondContact O-ND2 3.35Å; L414-L419 HydrophobicContact CB-CD1 3.71Å; L414-L419 HydrophobicContact CD1-CD1 3.96Å; L414-L419 HydrophobicContact CG-CD1 4.36Å; L414-E437 PolarHBondContact N-O 2.88Å; L414-L438 HydrophobicContact CB-CD2 3.97Å; L414-L438 HydrophobicContact CD1-CD2 3.9Å; L414-L438 HydrophobicContact CG-CD2 4.19Å; L414-N441 PolarHBondContact O-ND2 3.11Å
415	S	97.7	Very high	97.2	Very high	6 Å²	6	56.8 Å²	56.8	4%	0.042	25%	0.253	C	S	.	.			trans	-61.8	154.6	-176	41.2	0	0	0	0	112.8	L391 D392 N417 E437 N439	L391-S415 CarbonylContact C-O 3.17Å; L391-S415 WeakPolarHBondContact CA-O 3.32Å; L391-S415 WeakPolarHBondContact CB-O 3.49Å; L391-S415 VanDerWaalsContact CB-OG 3.26Å; L391-S415 WeakPolarHBondContact CB-OG 3.47Å; D392-S415 PolarHBondContact N-O 2.75Å; S415-N417 PolarHBondContact O-ND2 3.45Å; S415-N417 VanDerWaalsContact O-ND2 3.1Å; S415-E437 PolarHBondContact OG-OE1 2.8Å; S415-N439 CarbonylContact C-O 3.56Å; S415-N439 WeakPolarHBondContact CA-O 3.4Å; S415-N439 WeakPolarHBondContact CB-OD1 3.42Å
416	N	97.8	Very high	97.3	Very high	84 Å²	84	49.8 Å²	49.8	45%	0.449	24%	0.237	S	C	.	.	S	Bend	trans	52.8	61.4	176.8	-164.2	25	0	0	0	113.3	D392 N393 N439 D440	D392-N416 VanDerWaalsContact OD1-CB 3.3Å; D392-N416 WeakPolarHBondContact OD1-CB 3.33Å; D392-N416 PolarHBondContact OD1-ND2 3.31Å; N393-N416 PolarHBondContact N-O 3.16Å; N416-N439 PolarHBondContact N-O 2.77Å; N416-D440 VanDerWaalsContact CA-O 3.28Å; N416-D440 WeakPolarHBondContact CA-O 3.5Å; N416-D440 HydrophobicContact CB-CB 4.32Å; N416-D440 PolarHBondContact N-O 2.83Å
417	N	98.7	Very high	97.5	Very high	13 Å²	13	50 Å²	50	7%	0.07	24%	0.238	C	C	.	.	S	Bend	trans	-134.7	-165.5	176.7	-86.1	-77.6	0	0	0	109.8	M390 N393 K394 L395 L414 S415 L419 D440 N441	M390-N417 PolarHBondContact O-ND2 3.25Å; N393-N417 WeakPolarHBondContact CA-OD1 3.23Å; N393-N417 WeakPolarHBondContact CB-OD1 3.43Å; N393-N417 PolarHBondContact O-OD1 3.5Å; K394-N417 PolarHBondContact N-OD1 3.28Å; L395-N417 HydrophobicContact CB-CB 4.32Å; L395-N417 VanDerWaalsContact CB-OD1 3.25Å; L395-N417 WeakPolarHBondContact CB-OD1 3.49Å; L395-N417 WeakPolarHBondContact CG-OD1 3.43Å; L395-N417 PolarHBondContact N-OD1 2.82Å; L414-N417 PolarHBondContact O-ND2 3.35Å; S415-N417 PolarHBondContact O-ND2 3.45Å; S415-N417 VanDerWaalsContact O-ND2 3.1Å; N417-L419 HydrophobicContact CB-CD1 4.43Å; N417-L419 HydrophobicContact CB-CG 4.13Å; N417-D440 PolarHBondContact N-O 3.03Å; N417-D440 VanDerWaalsContact N-O 3.16Å; N417-N441 WeakPolarHBondContact CA-OD1 3.49Å; N417-N441 WeakPolarHBondContact CB-OD1 3.39Å; N417-N441 PolarHBondContact O-OD1 3.42Å
418	R	98.4	Very high	97.6	Very high	141 Å²	141	43 Å²	43	53%	0.532	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	28.3	176.7	-53	173.8	-179	177.2	-2.4	111.3	L395 N441	L395-R418 CarbonylContact O-C 2.99Å; L395-R418 WeakPolarHBondContact O-CA 3.25Å; L395-R418 VanDerWaalsContact O-CB 3.27Å; L395-R418 WeakPolarHBondContact O-CB 3.46Å; L395-R418 PolarHBondContact O-N 2.97Å; R418-N441 PolarHBondContact N-OD1 3.16Å
419	L	98.7	Very high	97.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	140.9	-179.4	-61	170.2	0	0	0	110.1	I375 L395 G397 I399 L414 N417 N441 Q442 L443	I375-L419 HydrophobicContact CD1-CD1 4.07Å; I375-L419 HydrophobicContact CD1-CD2 3.91Å; I375-L419 HydrophobicContact CG1-CD2 4.24Å; L395-L419 HydrophobicContact CB-CD2 4.05Å; L395-L419 PolarHBondContact O-N 2.72Å; G397-L419 WeakPolarHBondContact O-CA 3.39Å; I399-L419 HydrophobicContact CG1-CD1 4.3Å; L414-L419 HydrophobicContact CB-CD1 3.71Å; L414-L419 HydrophobicContact CD1-CD1 3.96Å; L414-L419 HydrophobicContact CG-CD1 4.36Å; N417-L419 HydrophobicContact CB-CD1 4.43Å; N417-L419 HydrophobicContact CB-CG 4.13Å; L419-N441 HydrophobicContact CB-CB 4.43Å; L419-N441 VanDerWaalsContact CB-OD1 3.31Å; L419-N441 WeakPolarHBondContact CB-OD1 3.42Å; L419-N441 PolarHBondContact N-OD1 3.29Å; L419-Q442 CarbonylContact O-C 3.57Å; L419-Q442 VanDerWaalsContact O-C 3.29Å; L419-Q442 VanDerWaalsContact O-CA 3.26Å; L419-Q442 WeakPolarHBondContact O-CA 3.29Å; L419-Q442 WeakPolarHBondContact O-CB 3.28Å; L419-Q442 PolarHBondContact O-N 3.29Å; L419-L443 HydrophobicContact CB-CD2 4.06Å; L419-L443 PolarHBondContact O-N 3.06Å
420	D	98.4	Very high	97.6	Very high	68 Å²	68	37.4 Å²	37.4	36%	0.364	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	178.5	-175.4	74.1	-6.2	0	0	0	112.5	G397 R398 Q442	G397-D420 WeakPolarHBondContact CA-OD1 3.38Å; G397-D420 PolarHBondContact O-N 3.45Å; R398-D420 WeakPolarHBondContact CA-O 3.46Å; D420-Q442 HydrophobicContact CB-CB 4.26Å
421	G	98	Very high	97.6	Very high	11 Å²	11	34.3 Å²	34.3	11%	0.113	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	69.9	-171.4	-176.7	0	0	0	0	0	113.3	L443 T444	G421-L443 WeakPolarHBondContact O-CA 3.35Å; G421-T444 VanDerWaalsContact CA-OG1 3.31Å; G421-T444 WeakPolarHBondContact CA-OG1 3.42Å; G421-T444 PolarHBondContact O-N 2.83Å; G421-T444 PolarHBondContact O-OG1 2.85Å
422	D	98.2	Very high	97.6	Very high	93 Å²	93	36 Å²	36	50%	0.497	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	141.4	-172.6	-63.7	5.2	0	0	0	111	P424 T444 G445	D422-P424 WeakPolarHBondContact O-CD 3.46Å; D422-T444 VanDerWaalsContact OD1-C 3.27Å; D422-T444 PolarHBondContact OD1-OG1 2.95Å; D422-G445 VanDerWaalsContact OD1-CA 3.26Å; D422-G445 WeakPolarHBondContact OD1-CA 3.41Å; D422-G445 PolarHBondContact OD1-N 3.18Å; D422-G445 VanDerWaalsContact OD1-N 3.11Å
423	V	98.3	Very high	97.6	Very high	10 Å²	10	35.9 Å²	35.9	6%	0.061	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-67.5	122.7	169	-177.8	0	0	0	0	108.5	I399 A425 V427 W428 L438 L443	I399-V423 HydrophobicContact CD1-CG1 4.45Å; I399-V423 HydrophobicContact CD1-CG2 4.16Å; V423-A425 PolarHBondContact O-N 2.93Å; V423-V427 HydrophobicContact CG1-CB 4.17Å; V423-V427 HydrophobicContact CG1-CG1 4.19Å; V423-W428 HydrophobicContact CB-CZ2 3.63Å; V423-W428 HydrophobicContact CG1-CD2 4.45Å; V423-W428 HydrophobicContact CG1-CZ2 3.96Å; V423-W428 HydrophobicContact CG2-CH2 4.48Å; V423-W428 HydrophobicContact CG2-CZ2 3.78Å; V423-W428 PolarHBondContact O-NE1 3.41Å; V423-L438 HydrophobicContact CG1-CD1 4.34Å; V423-L438 HydrophobicContact CG2-CD1 3.88Å; V423-L443 HydrophobicContact CG2-CD1 4.08Å; V423-L443 HydrophobicContact CG2-CD2 4.38Å
424	P	97.5	Very high	97.4	Very high	11 Å²	11	34.4 Å²	34.4	7%	0.071	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-52.6	130.2	-178	-27.7	33.6	0	0	0	112.1	I399 D401 D422 A426 V427	I399-P424 HydrophobicContact CG2-CG 4.38Å; I399-P424 WeakPolarHBondContact O-CG 2.96Å; D401-P424 WeakPolarHBondContact OD1-CB 3.35Å; D401-P424 WeakPolarHBondContact OD1-CG 3.46Å; D422-P424 WeakPolarHBondContact O-CD 3.46Å; P424-A426 PolarHBondContact O-N 3.05Å; P424-V427 HydrophobicContact CB-CG2 4.09Å; P424-V427 HydrophobicContact CG-CG2 4.41Å; P424-V427 WeakPolarHBondContact O-CB 3.29Å; P424-V427 PolarHBondContact O-N 2.66Å
425	A	96.8	Very high	97.3	Very high	56 Å²	56	35.2 Å²	35.2	46%	0.463	20%	0.2	S	C	.	.	H	α-helix	trans	-52	-36.5	-170.3	0	0	0	0	0	113.7	V423 V427	V423-A425 PolarHBondContact O-N 2.93Å; A425-V427 PolarHBondContact O-N 3.45Å
426	A	96.8	Very high	97.3	Very high	47 Å²	47	35 Å²	35	39%	0.388	20%	0.199	S	C	.	.	H	α-helix	trans	-70.3	-25.2	-179.6	0	0	0	0	0	114.2	P424 W428 G429	P424-A426 PolarHBondContact O-N 3.05Å; A426-W428 VanDerWaalsContact C-N 3.3Å; A426-W428 PolarHBondContact O-N 3.48Å; A426-G429 PolarHBondContact O-N 3.07Å
427	V	97.9	Very high	97.3	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-64.3	-37.5	178.2	173.2	0	0	0	0	110.9	L403 V423 P424 A425 G429 L430 L436	L403-V427 HydrophobicContact CB-CG2 3.99Å; V423-V427 HydrophobicContact CG1-CB 4.17Å; V423-V427 HydrophobicContact CG1-CG1 4.19Å; P424-V427 HydrophobicContact CB-CG2 4.09Å; P424-V427 HydrophobicContact CG-CG2 4.41Å; P424-V427 WeakPolarHBondContact O-CB 3.29Å; P424-V427 PolarHBondContact O-N 2.66Å; A425-V427 PolarHBondContact O-N 3.45Å; V427-G429 PolarHBondContact O-N 3.45Å; V427-L430 HydrophobicContact CG1-CD1 4.36Å; V427-L430 PolarHBondContact O-N 2.98Å; V427-L436 HydrophobicContact CG1-CD1 4.43Å
428	W	97.5	Very high	97.3	Very high	5 Å²	5	31.6 Å²	31.6	2%	0.019	18%	0.18	C	C	.	.	H	α-helix	trans	-58.6	-33.8	178.6	-64.3	100.8	0	0	0	113.2	V423 A426 L436 I447 I451 A454 L460 L462	V423-W428 HydrophobicContact CB-CZ2 3.63Å; V423-W428 HydrophobicContact CG1-CD2 4.45Å; V423-W428 HydrophobicContact CG1-CZ2 3.96Å; V423-W428 HydrophobicContact CG2-CH2 4.48Å; V423-W428 HydrophobicContact CG2-CZ2 3.78Å; V423-W428 PolarHBondContact O-NE1 3.41Å; A426-W428 VanDerWaalsContact C-N 3.3Å; A426-W428 PolarHBondContact O-N 3.48Å; W428-L436 HydrophobicContact CE3-CD2 4.31Å; W428-L436 HydrophobicContact CZ3-CD2 4.4Å; W428-I447 HydrophobicContact CD2-CG2 4.47Å; W428-I447 HydrophobicContact CE3-CG2 3.99Å; W428-I447 HydrophobicContact CH2-CB 4.41Å; W428-I447 HydrophobicContact CH2-CG1 4Å; W428-I447 HydrophobicContact CH2-CG2 4.36Å; W428-I447 HydrophobicContact CZ3-CB 4.47Å; W428-I447 HydrophobicContact CZ3-CG1 4.27Å; W428-I447 HydrophobicContact CZ3-CG2 3.92Å; W428-I451 HydrophobicContact CB-CB 4.2Å; W428-I451 HydrophobicContact CE3-CD1 4.17Å; W428-I451 WeakPolarHBondContact O-CA 3.25Å; W428-A454 WeakPolarHBondContact O-CB 3.39Å; W428-L460 HydrophobicContact CZ3-CD1 4.11Å; W428-L460 HydrophobicContact CZ3-CD2 4.38Å; W428-L462 HydrophobicContact CH2-CD1 3.81Å; W428-L462 HydrophobicContact CH2-CD2 3.92Å; W428-L462 HydrophobicContact CZ3-CD1 3.84Å; W428-L462 HydrophobicContact CZ3-CD2 4.12Å
429	G	96.5	Very high	97.3	Very high	8 Å²	8	26 Å²	26	8%	0.082	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	25.4	-175.2	0	0	0	0	0	115	A426 V427 V450	A426-G429 PolarHBondContact O-N 3.07Å; V427-G429 PolarHBondContact O-N 3.45Å; G429-V450 WeakPolarHBondContact CA-O 3.49Å
430	L	97.3	Very high	97.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.176	C	C	.	.			trans	-64.5	126.5	177.8	-77.1	170.7	0	0	0	110.6	C406 L409 V427 H432 M433	C406-L430 WeakPolarHBondContact O-CD2 3.19Å; L409-L430 HydrophobicContact CB-CD1 4.18Å; L409-L430 HydrophobicContact CD1-CD1 3.99Å; V427-L430 HydrophobicContact CG1-CD1 4.36Å; V427-L430 PolarHBondContact O-N 2.98Å; L430-H432 VanDerWaalsContact C-N 3.31Å; L430-H432 PolarHBondContact O-N 3.36Å; L430-M433 HydrophobicContact CB-CB 3.97Å; L430-M433 HydrophobicContact CB-CE 4.09Å; L430-M433 HydrophobicContact CD1-CE 3.38Å; L430-M433 HydrophobicContact CG-CE 4.37Å; L430-M433 WeakPolarHBondContact O-CB 3.09Å; L430-M433 PolarHBondContact O-N 3.01Å
431	P	94.9	Very high	97.3	Very high	43 Å²	43	26.2 Å²	26.2	28%	0.279	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-24.2	-164.9	27	-36.1	0	0	0	114.3	N456	P431-N456 PolarHBondContact O-ND2 3.3Å; P431-N456 VanDerWaalsContact O-ND2 3.12Å
432	H	95.4	Very high	97.4	Very high	80 Å²	80	29.2 Å²	29.2	37%	0.37	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-0.6	-179.9	-67.8	-60.2	0	0	0	113.5	R407 L409 R410 L430 S434	R407-H432 PolarHBondContact O-CD2 3.25Å; L409-H432 CarbonylContact O-C 3.44Å; R410-H432 WeakPolarHBondContact CA-O 3.39Å; R410-H432 HydrophobicContact CG-CB 4.49Å; L430-H432 VanDerWaalsContact C-N 3.31Å; L430-H432 PolarHBondContact O-N 3.36Å; H432-S434 PolarHBondContact O-N 2.94Å
433	M	97.5	Very high	97.4	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	15%	0.149	C	C	.	.			trans	-61.4	128.1	179.3	-168.2	65.1	68.5	0	0	109.9	L409 V412 L430 L435 L436 N456 L457	L409-M433 HydrophobicContact CB-CE 3.97Å; L409-M433 WeakPolarHBondContact O-CA 3.19Å; L409-M433 PolarHBondContact O-N 3.12Å; L409-M433 VanDerWaalsContact O-N 3.15Å; V412-M433 HydrophobicContact CB-CE 4.41Å; V412-M433 HydrophobicContact CB-SD 4.41Å; V412-M433 HydrophobicContact CG2-CE 3.69Å; V412-M433 HydrophobicContact CG2-SD 4.11Å; L430-M433 HydrophobicContact CB-CB 3.97Å; L430-M433 HydrophobicContact CB-CE 4.09Å; L430-M433 HydrophobicContact CD1-CE 3.38Å; L430-M433 HydrophobicContact CG-CE 4.37Å; L430-M433 WeakPolarHBondContact O-CB 3.09Å; L430-M433 PolarHBondContact O-N 3.01Å; M433-L435 VanDerWaalsContact SD-O 3.38Å; M433-L436 HydrophobicContact CG-CB 4.29Å; M433-L436 HydrophobicContact SD-CB 4.49Å; M433-N456 CarbonylContact O-C 3.41Å; M433-L457 HydrophobicContact CG-CD1 3.98Å; M433-L457 WeakPolarHBondContact O-CA 3.38Å; M433-L457 PolarHBondContact O-N 3.35Å
434	S	93.9	Very high	97.4	Very high	41 Å²	41	26.7 Å²	26.7	29%	0.287	16%	0.161	S	C	.	.			trans	-118.9	-32.2	179.2	65.5	0	0	0	0	112.4	R410 H432 N456 S458 K459	R410-S434 PolarHBondContact O-N 3.06Å; R410-S434 PolarHBondContact O-OG 3.06Å; H432-S434 PolarHBondContact O-N 2.94Å; S434-N456 WeakPolarHBondContact CA-O 3.29Å; S434-S458 WeakPolarHBondContact O-CA 3.43Å; S434-S458 WeakPolarHBondContact O-CB 3.31Å; S434-S458 PolarHBondContact O-N 3.01Å; S434-K459 PolarHBondContact O-N 3.46Å
435	L	96.3	Very high	97.4	Very high	16 Å²	16	26.7 Å²	26.7	8%	0.084	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	118.3	178	171.1	63.1	0	0	0	109.2	R410 R411 V412 R413 M433 E437 K459	R410-L435 PolarHBondContact O-N 2.9Å; R410-L435 VanDerWaalsContact O-N 3.15Å; R411-L435 WeakPolarHBondContact CA-O 3.1Å; R411-L435 HydrophobicContact CG-CB 4.36Å; V412-L435 PolarHBondContact N-O 3.44Å; R413-L435 HydrophobicContact CG-CD2 3.84Å; R413-L435 HydrophobicContact CG-CG 4.34Å; M433-L435 VanDerWaalsContact SD-O 3.38Å; L435-E437 HydrophobicContact CD1-CB 4.21Å; L435-K459 HydrophobicContact CD1-CB 3.57Å; L435-K459 HydrophobicContact CD1-CD 4.24Å; L435-K459 HydrophobicContact CD1-CG 4.46Å
436	L	98.5	Very high	97.5	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	106.8	170	-178.4	60	0	0	0	108.8	V412 V427 W428 M433 L438 L457 K459 L460 V461	V412-L436 HydrophobicContact CB-CD1 3.84Å; V412-L436 HydrophobicContact CG1-CD1 3.96Å; V427-L436 HydrophobicContact CG1-CD1 4.43Å; W428-L436 HydrophobicContact CE3-CD2 4.31Å; W428-L436 HydrophobicContact CZ3-CD2 4.4Å; M433-L436 HydrophobicContact CG-CB 4.29Å; M433-L436 HydrophobicContact SD-CB 4.49Å; L436-L438 HydrophobicContact CD1-CD1 3.95Å; L436-L438 HydrophobicContact CD1-CD2 3.94Å; L436-L438 HydrophobicContact CD1-CG 3.86Å; L436-L438 HydrophobicContact CD2-CD1 4.29Å; L436-L438 HydrophobicContact CG-CD1 4.06Å; L436-L438 HydrophobicContact CG-CG 4.08Å; L436-L457 HydrophobicContact CB-CD1 4.22Å; L436-K459 PolarHBondContact N-O 3.33Å; L436-L460 HydrophobicContact CB-CD1 3.92Å; L436-L460 HydrophobicContact CD2-CD1 3.78Å; L436-L460 HydrophobicContact CG-CD1 4.01Å; L436-V461 PolarHBondContact O-N 3.48Å
437	E	98.4	Very high	97.5	Very high	25 Å²	25	25.7 Å²	25.7	12%	0.117	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	109.4	-176	-175.8	-178.9	147	0	0	109.7	V412 R413 L414 S415 L435 N439 V461	V412-E437 PolarHBondContact O-N 2.87Å; R413-E437 WeakPolarHBondContact CA-O 3.43Å; R413-E437 HydrophobicContact CB-CB 4.34Å; R413-E437 HydrophobicContact CG-CB 4.14Å; R413-E437 IonicContact CZ-OE1 2.63Å; R413-E437 IonicContact CZ-OE2 2.9Å; R413-E437 IonicContact NE-OE1 2.68Å; R413-E437 IonicContact NE-OE2 2.76Å; R413-E437 PolarHBondContact NE-OE2 2.93Å; R413-E437 IonicContact NH2-OE1 2.73Å; R413-E437 PolarHBondContact NH2-OE1 2.87Å; R413-E437 IonicContact NH2-OE2 2.77Å; R413-E437 PolarHBondContact NH2-OE2 2.98Å; L414-E437 PolarHBondContact N-O 2.88Å; S415-E437 PolarHBondContact OG-OE1 2.8Å; L435-E437 HydrophobicContact CD1-CB 4.21Å; E437-N439 WeakPolarHBondContact CG-OD1 3.46Å; E437-V461 WeakPolarHBondContact CA-O 3.31Å; E437-V461 HydrophobicContact CB-CB 4.39Å; E437-V461 HydrophobicContact CG-CB 4.11Å; E437-V461 HydrophobicContact CG-CG1 4.39Å
438	L	98.7	Very high	97.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.			trans	-130.2	10.7	-172.5	-56.2	179.8	0	0	0	112.2	I399 V412 L414 V423 L436 N441 L443 V461 L462 N465	I399-L438 HydrophobicContact CD1-CD1 4.16Å; I399-L438 HydrophobicContact CD1-CD2 3.93Å; V412-L438 HydrophobicContact CG1-CD2 4.37Å; L414-L438 HydrophobicContact CB-CD2 3.97Å; L414-L438 HydrophobicContact CD1-CD2 3.9Å; L414-L438 HydrophobicContact CG-CD2 4.19Å; V423-L438 HydrophobicContact CG1-CD1 4.34Å; V423-L438 HydrophobicContact CG2-CD1 3.88Å; L436-L438 HydrophobicContact CD1-CD1 3.95Å; L436-L438 HydrophobicContact CD1-CD2 3.94Å; L436-L438 HydrophobicContact CD1-CG 3.86Å; L436-L438 HydrophobicContact CD2-CD1 4.29Å; L436-L438 HydrophobicContact CG-CD1 4.06Å; L436-L438 HydrophobicContact CG-CG 4.08Å; L438-N441 PolarHBondContact O-ND2 2.95Å; L438-N441 VanDerWaalsContact O-ND2 3.16Å; L438-L443 HydrophobicContact CB-CD1 3.73Å; L438-L443 HydrophobicContact CD1-CD1 4.07Å; L438-L443 HydrophobicContact CG-CD1 4.39Å; L438-V461 PolarHBondContact N-O 2.81Å; L438-L462 HydrophobicContact CB-CD2 4.08Å; L438-L462 HydrophobicContact CD1-CD2 3.96Å; L438-L462 HydrophobicContact CG-CD2 4.3Å; L438-N465 PolarHBondContact O-ND2 3.44Å
439	N	98.5	Very high	97.6	Very high	22 Å²	22	29.3 Å²	29.3	12%	0.118	17%	0.17	C	C	.	.			trans	-61.9	159.4	-176.5	53.7	-72.7	0	0	0	113.4	S415 N416 E437 N441 V461 S463	S415-N439 CarbonylContact C-O 3.56Å; S415-N439 WeakPolarHBondContact CA-O 3.4Å; S415-N439 WeakPolarHBondContact CB-OD1 3.42Å; N416-N439 PolarHBondContact N-O 2.77Å; E437-N439 WeakPolarHBondContact CG-OD1 3.46Å; N439-N441 PolarHBondContact O-ND2 3.49Å; N439-N441 VanDerWaalsContact O-ND2 3.15Å; N439-V461 HydrophobicContact CB-CG1 4.02Å; N439-V461 PolarHBondContact N-O 3.27Å; N439-V461 WeakPolarHBondContact OD1-CG1 3.35Å; N439-S463 CarbonylContact C-O 3.48Å; N439-S463 WeakPolarHBondContact CA-O 3.27Å; N439-S463 WeakPolarHBondContact CB-O 3.14Å
440	D	98.7	Very high	97.6	Very high	61 Å²	61	32.5 Å²	32.5	33%	0.326	19%	0.188	S	C	.	.	S	Bend	trans	58	55.7	177.1	-54.3	-68.4	0	0	0	112	N416 N417 S463 N464	N416-D440 VanDerWaalsContact CA-O 3.28Å; N416-D440 WeakPolarHBondContact CA-O 3.5Å; N416-D440 HydrophobicContact CB-CB 4.32Å; N416-D440 PolarHBondContact N-O 2.83Å; N417-D440 PolarHBondContact N-O 3.03Å; N417-D440 VanDerWaalsContact N-O 3.16Å; D440-S463 PolarHBondContact N-O 3.22Å; D440-N464 WeakPolarHBondContact CA-O 3.29Å; D440-N464 PolarHBondContact N-O 2.89Å; D440-N464 VanDerWaalsContact OD1-CB 3.29Å; D440-N464 WeakPolarHBondContact OD1-CB 3.13Å; D440-N464 PolarHBondContact OD1-ND2 3.49Å
441	N	98.8	Very high	97.6	Very high	12 Å²	12	32.5 Å²	32.5	6%	0.064	19%	0.188	C	C	.	.	S	Bend	trans	-136.3	-168.2	176.5	-84.1	-77.3	0	0	0	110.1	L414 N417 R418 L419 L438 N439 L443 N464 N465	L414-N441 PolarHBondContact O-ND2 3.11Å; N417-N441 WeakPolarHBondContact CA-OD1 3.49Å; N417-N441 WeakPolarHBondContact CB-OD1 3.39Å; N417-N441 PolarHBondContact O-OD1 3.42Å; R418-N441 PolarHBondContact N-OD1 3.16Å; L419-N441 HydrophobicContact CB-CB 4.43Å; L419-N441 VanDerWaalsContact CB-OD1 3.31Å; L419-N441 WeakPolarHBondContact CB-OD1 3.42Å; L419-N441 PolarHBondContact N-OD1 3.29Å; L438-N441 PolarHBondContact O-ND2 2.95Å; L438-N441 VanDerWaalsContact O-ND2 3.16Å; N439-N441 PolarHBondContact O-ND2 3.49Å; N439-N441 VanDerWaalsContact O-ND2 3.15Å; N441-L443 HydrophobicContact CB-CD1 4.25Å; N441-L443 HydrophobicContact CB-CG 4.03Å; N441-N464 PolarHBondContact N-O 3.47Å; N441-N465 WeakPolarHBondContact CA-OD1 3.47Å; N441-N465 WeakPolarHBondContact CB-OD1 3.19Å; N441-N465 PolarHBondContact O-OD1 2.82Å
442	Q	98.4	Very high	97.6	Very high	75 Å²	75	31.6 Å²	31.6	35%	0.35	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	25.8	177.7	-55	179.1	38.6	0	0	111.8	L419 D420 N465	L419-Q442 CarbonylContact O-C 3.57Å; L419-Q442 VanDerWaalsContact O-C 3.29Å; L419-Q442 VanDerWaalsContact O-CA 3.26Å; L419-Q442 WeakPolarHBondContact O-CA 3.29Å; L419-Q442 WeakPolarHBondContact O-CB 3.28Å; L419-Q442 PolarHBondContact O-N 3.29Å; D420-Q442 HydrophobicContact CB-CB 4.26Å; Q442-N465 PolarHBondContact N-OD1 2.91Å
443	L	98.7	Very high	97.6	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	138.2	-174	-62.7	167.3	0	0	0	111.5	I399 L419 G421 V423 L438 N441 N465 R466 L467	I399-L443 HydrophobicContact CD1-CD1 4.23Å; I399-L443 HydrophobicContact CD1-CD2 3.95Å; I399-L443 HydrophobicContact CG1-CD2 4.2Å; L419-L443 HydrophobicContact CB-CD2 4.06Å; L419-L443 PolarHBondContact O-N 3.06Å; G421-L443 WeakPolarHBondContact O-CA 3.35Å; V423-L443 HydrophobicContact CG2-CD1 4.08Å; V423-L443 HydrophobicContact CG2-CD2 4.38Å; L438-L443 HydrophobicContact CB-CD1 3.73Å; L438-L443 HydrophobicContact CD1-CD1 4.07Å; L438-L443 HydrophobicContact CG-CD1 4.39Å; N441-L443 HydrophobicContact CB-CD1 4.25Å; N441-L443 HydrophobicContact CB-CG 4.03Å; L443-N465 HydrophobicContact CB-CB 4.44Å; L443-N465 VanDerWaalsContact CB-OD1 3.3Å; L443-N465 WeakPolarHBondContact CB-OD1 2.99Å; L443-N465 PolarHBondContact N-OD1 2.82Å; L443-R466 CarbonylContact O-C 3.45Å; L443-R466 WeakPolarHBondContact O-CA 3.31Å; L443-R466 WeakPolarHBondContact O-CB 3.43Å; L443-R466 PolarHBondContact O-N 3.28Å; L443-L467 HydrophobicContact CB-CD2 4.41Å; L443-L467 PolarHBondContact O-N 2.78Å
444	T	98.5	Very high	97.5	Very high	49 Å²	49	29.6 Å²	29.6	30%	0.301	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-171.4	179.8	60.5	0	0	0	0	111.3	G421 D422 R466 L467	G421-T444 VanDerWaalsContact CA-OG1 3.31Å; G421-T444 WeakPolarHBondContact CA-OG1 3.42Å; G421-T444 PolarHBondContact O-N 2.83Å; G421-T444 PolarHBondContact O-OG1 2.85Å; D422-T444 VanDerWaalsContact OD1-C 3.27Å; D422-T444 PolarHBondContact OD1-OG1 2.95Å; T444-R466 HydrophobicContact CG2-CB 4.05Å; T444-L467 WeakPolarHBondContact O-CD2 3.43Å
445	G	97.9	Very high	97.4	Very high	11 Å²	11	30 Å²	30	11%	0.113	19%	0.194	C	C	.	.	S	Bend	trans	86.9	-156.4	177.1	0	0	0	0	0	112	D422 T468	D422-G445 VanDerWaalsContact OD1-CA 3.26Å; D422-G445 WeakPolarHBondContact OD1-CA 3.41Å; D422-G445 PolarHBondContact OD1-N 3.18Å; D422-G445 VanDerWaalsContact OD1-N 3.11Å; G445-T468 PolarHBondContact O-N 3.48Å; G445-T468 PolarHBondContact O-OG1 2.84Å
446	V	98	Very high	97.3	Very high	78 Å²	78	31.6 Å²	31.6	47%	0.473	20%	0.202	S	C	.	.	B	Isolated β-bridge	trans	-126.4	155	-174.7	-56	0	0	0	0	110.4	S448	V446-S448 PolarHBondContact O-N 3.41Å
447	I	98.3	Very high	97.2	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	20%	0.202	C	C	.	.			trans	-67.6	116.4	167.2	-57.3	173.4	0	0	0	107.4	W428 I451 L462 P472 L491	W428-I447 HydrophobicContact CD2-CG2 4.47Å; W428-I447 HydrophobicContact CE3-CG2 3.99Å; W428-I447 HydrophobicContact CH2-CB 4.41Å; W428-I447 HydrophobicContact CH2-CG1 4Å; W428-I447 HydrophobicContact CH2-CG2 4.36Å; W428-I447 HydrophobicContact CZ3-CB 4.47Å; W428-I447 HydrophobicContact CZ3-CG1 4.27Å; W428-I447 HydrophobicContact CZ3-CG2 3.92Å; I447-I451 HydrophobicContact CG2-CD1 4.06Å; I447-L462 HydrophobicContact CD1-CD1 4Å; I447-L462 HydrophobicContact CG1-CD1 4.25Å; I447-P472 HydrophobicContact CB-CG 4.22Å; I447-P472 HydrophobicContact CG2-CG 3.78Å; I447-L491 HydrophobicContact CD1-CD1 4.41Å; I447-L491 HydrophobicContact CD1-CD2 4.24Å
448	S	97.9	Very high	97.1	Very high	15 Å²	15	32.4 Å²	32.4	11%	0.105	21%	0.211	C	C	.	.			trans	-70.3	138.1	-174.4	-173.3	0	0	0	0	112	V446 V450 I451	V446-S448 PolarHBondContact O-N 3.41Å; S448-V450 PolarHBondContact O-N 2.95Å; S448-V450 PolarHBondContact OG-N 2.6Å; S448-I451 WeakPolarHBondContact O-CB 3.27Å; S448-I451 VanDerWaalsContact O-CG2 3.26Å; S448-I451 WeakPolarHBondContact O-CG2 3.44Å; S448-I451 PolarHBondContact O-N 3.44Å
449	P	97.9	Very high	97.1	Very high	69 Å²	69	36.2 Å²	36.2	45%	0.448	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-55.4	-20.7	170.1	-27.7	36	0	0	0	114.2	I451 G452 P472 E474	P449-I451 PolarHBondContact O-N 2.94Å; P449-I451 VanDerWaalsContact O-N 3.08Å; P449-G452 PolarHBondContact O-N 3.27Å; P449-P472 HydrophobicContact CB-CB 4.47Å; P449-P472 HydrophobicContact CG-CB 4.31Å; P449-E474 HydrophobicContact CB-CG 4.22Å; P449-E474 WeakPolarHBondContact O-CB 3.43Å; P449-E474 WeakPolarHBondContact O-CG 3.48Å
450	V	97.2	Very high	97.1	Very high	75 Å²	75	35.1 Å²	35.1	46%	0.455	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-62.5	-14.5	175.6	-178.2	0	0	0	0	112.2	G429 S448 G452 G453	G429-V450 WeakPolarHBondContact CA-O 3.49Å; S448-V450 PolarHBondContact O-N 2.95Å; S448-V450 PolarHBondContact OG-N 2.6Å; V450-G452 PolarHBondContact O-N 2.85Å; V450-G453 PolarHBondContact O-N 3.02Å
451	I	97.7	Very high	97.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-52.1	-26.7	172.5	-164.4	167.9	0	0	0	113.9	W428 I447 S448 P449 G453 A454 L457 L460 P472 E474 I475	W428-I451 HydrophobicContact CB-CB 4.2Å; W428-I451 HydrophobicContact CE3-CD1 4.17Å; W428-I451 WeakPolarHBondContact O-CA 3.25Å; I447-I451 HydrophobicContact CG2-CD1 4.06Å; S448-I451 WeakPolarHBondContact O-CB 3.27Å; S448-I451 VanDerWaalsContact O-CG2 3.26Å; S448-I451 WeakPolarHBondContact O-CG2 3.44Å; S448-I451 PolarHBondContact O-N 3.44Å; P449-I451 PolarHBondContact O-N 2.94Å; P449-I451 VanDerWaalsContact O-N 3.08Å; I451-G453 PolarHBondContact O-N 2.76Å; I451-A454 WeakPolarHBondContact O-CB 3.4Å; I451-A454 PolarHBondContact O-N 2.83Å; I451-L457 HydrophobicContact CD1-CD2 4.12Å; I451-L457 HydrophobicContact CG1-CD2 4.24Å; I451-L460 HydrophobicContact CD1-CD2 3.63Å; I451-P472 HydrophobicContact CG2-CG 4.01Å; I451-E474 HydrophobicContact CG2-CB 4.38Å; I451-I475 HydrophobicContact CD1-CD1 4.3Å; I451-I475 HydrophobicContact CD1-CG1 4.16Å; I451-I475 HydrophobicContact CG2-CB 4.35Å
452	G	95	Very high	97.1	Very high	25 Å²	25	32.6 Å²	32.6	26%	0.258	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-60.9	-15.6	174.6	0	0	0	0	0	114.3	P449 V450 E474	P449-G452 PolarHBondContact O-N 3.27Å; V450-G452 PolarHBondContact O-N 2.85Å; G452-E474 WeakPolarHBondContact CA-O 3.24Å
453	G	94.9	Very high	97.1	Very high	39 Å²	39	29.6 Å²	29.6	40%	0.402	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-80.1	-14.7	172.4	0	0	0	0	0	115	V450 I451 A455	V450-G453 PolarHBondContact O-N 3.02Å; I451-G453 PolarHBondContact O-N 2.76Å; G453-A455 VanDerWaalsContact C-N 3.26Å; G453-A455 PolarHBondContact O-N 2.95Å
454	A	95.7	Very high	97.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	22%	0.215	C	C	.	.			trans	-84.4	64.3	-178.3	0	0	0	0	0	111.9	W428 I451 N456 L457	W428-A454 WeakPolarHBondContact O-CB 3.39Å; I451-A454 WeakPolarHBondContact O-CB 3.4Å; I451-A454 PolarHBondContact O-N 2.83Å; A454-N456 PolarHBondContact O-N 2.82Å; A454-L457 HydrophobicContact CB-CB 3.95Å; A454-L457 HydrophobicContact CB-CD2 4.41Å; A454-L457 VanDerWaalsContact O-CB 3.29Å; A454-L457 WeakPolarHBondContact O-CB 3.25Å; A454-L457 PolarHBondContact O-N 3.24Å
455	A	90.5	Very high	97.1	Very high	51 Å²	51	31.4 Å²	31.4	42%	0.421	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.9	-174.2	0	0	0	0	0	114.8	G453	G453-A455 VanDerWaalsContact C-N 3.26Å; G453-A455 PolarHBondContact O-N 2.95Å
456	N	94.7	Very high	97.1	Very high	48 Å²	48	37.1 Å²	37.1	26%	0.257	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-0.3	178.3	-74.6	-43.9	0	0	0	114.3	P431 M433 S434 A454 S458 K480	P431-N456 PolarHBondContact O-ND2 3.3Å; P431-N456 VanDerWaalsContact O-ND2 3.12Å; M433-N456 CarbonylContact O-C 3.41Å; S434-N456 WeakPolarHBondContact CA-O 3.29Å; A454-N456 PolarHBondContact O-N 2.82Å; N456-S458 PolarHBondContact O-N 3.48Å; N456-K480 PolarHBondContact OD1-NZ 3.42Å
457	L	97.8	Very high	97.1	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.016	20%	0.2	C	C	.	.			trans	-65.6	118.6	-174	-173.4	64.9	0	0	0	109.8	M433 L436 I451 A454 L460 A478 K480 L481	M433-L457 HydrophobicContact CG-CD1 3.98Å; M433-L457 WeakPolarHBondContact O-CA 3.38Å; M433-L457 PolarHBondContact O-N 3.35Å; L436-L457 HydrophobicContact CB-CD1 4.22Å; I451-L457 HydrophobicContact CD1-CD2 4.12Å; I451-L457 HydrophobicContact CG1-CD2 4.24Å; A454-L457 HydrophobicContact CB-CB 3.95Å; A454-L457 HydrophobicContact CB-CD2 4.41Å; A454-L457 VanDerWaalsContact O-CB 3.29Å; A454-L457 WeakPolarHBondContact O-CB 3.25Å; A454-L457 PolarHBondContact O-N 3.24Å; L457-L460 HydrophobicContact CD2-CB 4.23Å; L457-L460 HydrophobicContact CD2-CD2 4.31Å; L457-A478 HydrophobicContact CB-CB 4.45Å; L457-K480 CarbonylContact O-C 3.58Å; L457-L481 HydrophobicContact CD2-CD1 4.28Å; L457-L481 HydrophobicContact CG-CD1 4.1Å; L457-L481 VanDerWaalsContact O-CA 3.25Å; L457-L481 WeakPolarHBondContact O-CA 3.34Å; L457-L481 PolarHBondContact O-N 2.74Å; L457-L481 VanDerWaalsContact O-N 3.07Å
458	S	96.3	Very high	97.1	Very high	43 Å²	43	35.9 Å²	35.9	30%	0.301	22%	0.215	S	C	.	.			trans	-107.8	-37.6	-179.9	-175.5	0	0	0	0	112	S434 N456 K480 Y482 E483	S434-S458 WeakPolarHBondContact O-CA 3.43Å; S434-S458 WeakPolarHBondContact O-CB 3.31Å; S434-S458 PolarHBondContact O-N 3.01Å; N456-S458 PolarHBondContact O-N 3.48Å; S458-K480 WeakPolarHBondContact CA-O 3.48Å; S458-Y482 WeakPolarHBondContact O-CA 3.39Å; S458-Y482 PolarHBondContact O-N 2.79Å; S458-E483 PolarHBondContact O-N 2.88Å
459	K	97.1	Very high	97.1	Very high	79 Å²	79	36.2 Å²	36.2	34%	0.343	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	124	179.2	-63.7	-163.6	169.1	-137.4	0	110.9	S434 L435 L436 E483	S434-K459 PolarHBondContact O-N 3.46Å; L435-K459 HydrophobicContact CD1-CB 3.57Å; L435-K459 HydrophobicContact CD1-CD 4.24Å; L435-K459 HydrophobicContact CD1-CG 4.46Å; L436-K459 PolarHBondContact N-O 3.33Å; K459-E483 HydrophobicContact CB-CB 4.43Å; K459-E483 WeakPolarHBondContact CE-OE2 3.15Å; K459-E483 HydrophobicContact CG-CB 4.1Å; K459-E483 IonicContact NZ-OE2 2.68Å; K459-E483 PolarHBondContact NZ-OE2 3.47Å
460	L	98.6	Very high	97.1	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	107.4	173.2	-176.2	58.5	0	0	0	109.3	W428 L436 I451 L457 L462 I475 L481 E483 L484 S485	W428-L460 HydrophobicContact CZ3-CD1 4.11Å; W428-L460 HydrophobicContact CZ3-CD2 4.38Å; L436-L460 HydrophobicContact CB-CD1 3.92Å; L436-L460 HydrophobicContact CD2-CD1 3.78Å; L436-L460 HydrophobicContact CG-CD1 4.01Å; I451-L460 HydrophobicContact CD1-CD2 3.63Å; L457-L460 HydrophobicContact CD2-CB 4.23Å; L457-L460 HydrophobicContact CD2-CD2 4.31Å; L460-L462 HydrophobicContact CD1-CD1 4.04Å; L460-L462 HydrophobicContact CD1-CD2 3.84Å; L460-L462 HydrophobicContact CD1-CG 3.91Å; L460-L462 HydrophobicContact CD2-CD1 4.02Å; L460-L462 HydrophobicContact CG-CD1 3.85Å; L460-L462 HydrophobicContact CG-CD2 4.43Å; L460-L462 HydrophobicContact CG-CG 3.93Å; L460-I475 HydrophobicContact CD2-CD1 4.44Å; L460-L481 HydrophobicContact CB-CD1 4.05Å; L460-E483 PolarHBondContact N-O 3.29Å; L460-L484 HydrophobicContact CB-CD1 4.22Å; L460-L484 HydrophobicContact CD2-CD1 3.83Å; L460-L484 HydrophobicContact CG-CD1 4.14Å; L460-S485 PolarHBondContact O-N 2.63Å
461	V	98.4	Very high	97.2	Very high	19 Å²	19	32.6 Å²	32.6	12%	0.115	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	110.4	-175.1	-171.8	0	0	0	0	108.7	L436 E437 L438 N439 S485	L436-V461 PolarHBondContact O-N 3.48Å; E437-V461 WeakPolarHBondContact CA-O 3.31Å; E437-V461 HydrophobicContact CB-CB 4.39Å; E437-V461 HydrophobicContact CG-CB 4.11Å; E437-V461 HydrophobicContact CG-CG1 4.39Å; L438-V461 PolarHBondContact N-O 2.81Å; N439-V461 HydrophobicContact CB-CG1 4.02Å; N439-V461 PolarHBondContact N-O 3.27Å; N439-V461 WeakPolarHBondContact OD1-CG1 3.35Å; V461-S485 CarbonylContact C-O 3.53Å; V461-S485 WeakPolarHBondContact CA-O 3.49Å
462	L	98.8	Very high	97.2	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.202	C	C	.	.			trans	-129	6.8	-169.4	-57.5	175	0	0	0	112.2	W428 L438 I447 L460 N465 L467 S485 A486 N489	W428-L462 HydrophobicContact CH2-CD1 3.81Å; W428-L462 HydrophobicContact CH2-CD2 3.92Å; W428-L462 HydrophobicContact CZ3-CD1 3.84Å; W428-L462 HydrophobicContact CZ3-CD2 4.12Å; L438-L462 HydrophobicContact CB-CD2 4.08Å; L438-L462 HydrophobicContact CD1-CD2 3.96Å; L438-L462 HydrophobicContact CG-CD2 4.3Å; I447-L462 HydrophobicContact CD1-CD1 4Å; I447-L462 HydrophobicContact CG1-CD1 4.25Å; L460-L462 HydrophobicContact CD1-CD1 4.04Å; L460-L462 HydrophobicContact CD1-CD2 3.84Å; L460-L462 HydrophobicContact CD1-CG 3.91Å; L460-L462 HydrophobicContact CD2-CD1 4.02Å; L460-L462 HydrophobicContact CG-CD1 3.85Å; L460-L462 HydrophobicContact CG-CD2 4.43Å; L460-L462 HydrophobicContact CG-CG 3.93Å; L462-N465 PolarHBondContact O-ND2 2.9Å; L462-L467 HydrophobicContact CB-CD1 3.9Å; L462-L467 HydrophobicContact CD1-CD1 3.93Å; L462-L467 HydrophobicContact CD2-CD1 4.48Å; L462-L467 HydrophobicContact CG-CD1 4.33Å; L462-S485 PolarHBondContact N-O 3.25Å; L462-A486 HydrophobicContact CB-CB 4.13Å; L462-A486 HydrophobicContact CD1-CB 4.47Å; L462-N489 PolarHBondContact O-ND2 3.23Å
463	S	98.7	Very high	97.3	Very high	12 Å²	12	35.3 Å²	35.3	8%	0.084	21%	0.213	C	C	.	.			trans	-54.4	152.1	-172.2	-49.6	0	0	0	0	113	N439 D440 N465 D487	N439-S463 CarbonylContact C-O 3.48Å; N439-S463 WeakPolarHBondContact CA-O 3.27Å; N439-S463 WeakPolarHBondContact CB-O 3.14Å; D440-S463 PolarHBondContact N-O 3.22Å; S463-N465 PolarHBondContact O-ND2 3.18Å; S463-D487 CarbonylContact C-O 3.38Å; S463-D487 WeakPolarHBondContact CA-O 3.48Å; S463-D487 VanDerWaalsContact CB-OD1 3.26Å; S463-D487 WeakPolarHBondContact CB-OD1 3.42Å; S463-D487 PolarHBondContact OG-OD1 2.89Å
464	N	98.6	Very high	97.5	Very high	77 Å²	77	37 Å²	37	41%	0.412	21%	0.21	S	C	.	.	S	Bend	trans	53	61.2	177.1	-57.6	-36.6	0	0	0	113.4	D440 N441 D487 G488	D440-N464 WeakPolarHBondContact CA-O 3.29Å; D440-N464 PolarHBondContact N-O 2.89Å; D440-N464 VanDerWaalsContact OD1-CB 3.29Å; D440-N464 WeakPolarHBondContact OD1-CB 3.13Å; D440-N464 PolarHBondContact OD1-ND2 3.49Å; N441-N464 PolarHBondContact N-O 3.47Å; N464-D487 PolarHBondContact N-O 2.7Å; N464-G488 WeakPolarHBondContact CA-O 3.48Å
465	N	98.8	Very high	97.5	Very high	12 Å²	12	37 Å²	37	6%	0.064	21%	0.21	C	C	.	.	S	Bend	trans	-133.9	-168.2	174.4	-87	-74	0	0	0	110	L438 N441 Q442 L443 L462 S463 L467 G488 N489	L438-N465 PolarHBondContact O-ND2 3.44Å; N441-N465 WeakPolarHBondContact CA-OD1 3.47Å; N441-N465 WeakPolarHBondContact CB-OD1 3.19Å; N441-N465 PolarHBondContact O-OD1 2.82Å; Q442-N465 PolarHBondContact N-OD1 2.91Å; L443-N465 HydrophobicContact CB-CB 4.44Å; L443-N465 VanDerWaalsContact CB-OD1 3.3Å; L443-N465 WeakPolarHBondContact CB-OD1 2.99Å; L443-N465 PolarHBondContact N-OD1 2.82Å; L462-N465 PolarHBondContact O-ND2 2.9Å; S463-N465 PolarHBondContact O-ND2 3.18Å; N465-L467 HydrophobicContact CB-CG 4.19Å; N465-G488 PolarHBondContact N-O 2.96Å; N465-N489 WeakPolarHBondContact CA-OD1 3.11Å; N465-N489 WeakPolarHBondContact CB-OD1 3.12Å; N465-N489 PolarHBondContact O-OD1 3.24Å
466	R	98.3	Very high	97.7	Very high	131 Å²	131	35.5 Å²	35.5	49%	0.494	20%	0.201	S	C	.	.			trans	-116.3	31.2	177.3	-62	-179.4	-173.6	167	6.6	111.6	L443 T444 N489 M490	L443-R466 CarbonylContact O-C 3.45Å; L443-R466 WeakPolarHBondContact O-CA 3.31Å; L443-R466 WeakPolarHBondContact O-CB 3.43Å; L443-R466 PolarHBondContact O-N 3.28Å; T444-R466 HydrophobicContact CG2-CB 4.05Å; R466-N489 PolarHBondContact N-OD1 3.34Å; R466-M490 HydrophobicContact CB-CE 3.59Å; R466-M490 HydrophobicContact CG-CE 4.24Å; R466-M490 VanDerWaalsContact O-CE 3.27Å; R466-M490 WeakPolarHBondContact O-CE 3.24Å
467	L	98.7	Very high	97.8	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	21%	0.212	C	C	.	.			trans	-66.9	142.2	179.4	-60.4	174.8	0	0	0	110.6	L443 T444 L462 N465 N489 M490 L491	L443-L467 HydrophobicContact CB-CD2 4.41Å; L443-L467 PolarHBondContact O-N 2.78Å; T444-L467 WeakPolarHBondContact O-CD2 3.43Å; L462-L467 HydrophobicContact CB-CD1 3.9Å; L462-L467 HydrophobicContact CD1-CD1 3.93Å; L462-L467 HydrophobicContact CD2-CD1 4.48Å; L462-L467 HydrophobicContact CG-CD1 4.33Å; N465-L467 HydrophobicContact CB-CG 4.19Å; L467-N489 HydrophobicContact CB-CB 4.41Å; L467-N489 VanDerWaalsContact CB-OD1 3.28Å; L467-N489 WeakPolarHBondContact CB-OD1 3.48Å; L467-N489 WeakPolarHBondContact CG-OD1 3.45Å; L467-N489 PolarHBondContact N-OD1 3Å; L467-M490 CarbonylContact O-C 3.47Å; L467-M490 WeakPolarHBondContact O-CA 3.45Å; L467-M490 WeakPolarHBondContact O-CB 3.48Å; L467-M490 PolarHBondContact O-N 2.96Å; L467-L491 HydrophobicContact CB-CD2 4.05Å; L467-L491 PolarHBondContact O-N 2.88Å
468	T	98.4	Very high	97.6	Very high	54 Å²	54	36.4 Å²	36.4	33%	0.331	21%	0.211	S	C	.	.	B	Isolated β-bridge	trans	-127.3	-178.5	-175.8	62	0	0	0	0	111	G445 M490	G445-T468 PolarHBondContact O-N 3.48Å; G445-T468 PolarHBondContact O-OG1 2.84Å; T468-M490 HydrophobicContact CG2-CB 4.04Å; T468-M490 HydrophobicContact CG2-CE 3.93Å
469	G	97.9	Very high	97.5	Very high	22 Å²	22	37.8 Å²	37.8	23%	0.227	22%	0.221	C	C	.	.	S	Bend	trans	77.3	-174.7	178.2	0	0	0	0	0	113	L491 S492	G469-L491 CarbonylContact O-C 3.54Å; G469-L491 WeakPolarHBondContact O-CA 3.26Å; G469-S492 PolarHBondContact O-N 3.12Å; G469-S492 PolarHBondContact O-OG 3.25Å
470	S	98.1	Very high	97.4	Very high	64 Å²	64	39 Å²	39	45%	0.448	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-89.3	152.1	179.7	-52.7	0	0	0	0	111.7	P472 S492	S470-P472 WeakPolarHBondContact O-CD 3.49Å; S470-S492 VanDerWaalsContact CA-O 3.23Å; S470-S492 WeakPolarHBondContact CA-O 3.26Å; S470-S492 PolarHBondContact OG-O 3.43Å
471	I	98.3	Very high	97.3	Very high	4 Å²	4	39 Å²	39	2%	0.021	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-65.7	118.7	167.3	-61.6	168.8	0	0	0	107.5	I475 L491 L495 P496 L510 L515	I471-I475 HydrophobicContact CG2-CD1 4.04Å; I471-I475 HydrophobicContact CG2-CG2 3.97Å; I471-L491 HydrophobicContact CD1-CD1 4.45Å; I471-L491 HydrophobicContact CG1-CD1 4.22Å; I471-L495 HydrophobicContact CD1-CD2 4.1Å; I471-P496 HydrophobicContact CB-CG 4.45Å; I471-P496 HydrophobicContact CG2-CG 4.07Å; I471-L510 HydrophobicContact CD1-CD1 3.74Å; I471-L510 HydrophobicContact CD1-CD2 4Å; I471-L515 HydrophobicContact CD1-CD1 4.47Å; I471-L515 HydrophobicContact CD1-CD2 4.18Å
472	P	97.9	Very high	97.2	Very high	8 Å²	8	42 Å²	42	5%	0.052	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-69.1	141.5	-173.5	27.2	-35.4	0	0	0	111.6	I447 P449 I451 S470 E474 I475	I447-P472 HydrophobicContact CB-CG 4.22Å; I447-P472 HydrophobicContact CG2-CG 3.78Å; P449-P472 HydrophobicContact CB-CB 4.47Å; P449-P472 HydrophobicContact CG-CB 4.31Å; I451-P472 HydrophobicContact CG2-CG 4.01Å; S470-P472 WeakPolarHBondContact O-CD 3.49Å; P472-E474 WeakPolarHBondContact CB-OE2 3.49Å; P472-E474 PolarHBondContact O-N 3.38Å; P472-E474 VanDerWaalsContact O-N 3.17Å; P472-I475 WeakPolarHBondContact O-CB 3.16Å; P472-I475 WeakPolarHBondContact O-CG2 3.44Å; P472-I475 PolarHBondContact O-N 3Å; P472-I475 VanDerWaalsContact O-N 3.11Å
473	P	97.8	Very high	97.2	Very high	74 Å²	74	42.6 Å²	42.6	48%	0.481	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-61.3	-23.8	178.1	25.2	-33.5	0	0	0	113.5	I475 G476 P496 S498	P473-I475 PolarHBondContact O-N 3.45Å; P473-I475 VanDerWaalsContact O-N 3.15Å; P473-G476 PolarHBondContact O-N 3.07Å; P473-G476 VanDerWaalsContact O-N 3.14Å; P473-P496 HydrophobicContact CB-CB 4Å; P473-S498 WeakPolarHBondContact CA-OG 3.5Å; P473-S498 VanDerWaalsContact O-CB 3.32Å; P473-S498 WeakPolarHBondContact O-CB 3.35Å; P473-S498 PolarHBondContact O-OG 3.3Å
474	E	97.5	Very high	97.2	Very high	74 Å²	74	42 Å²	42	35%	0.346	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-63.1	-16.4	176.1	-65.4	77.7	-171.7	0	0	113.3	P449 I451 G452 P472 G476 S477	P449-E474 HydrophobicContact CB-CG 4.22Å; P449-E474 WeakPolarHBondContact O-CB 3.43Å; P449-E474 WeakPolarHBondContact O-CG 3.48Å; I451-E474 HydrophobicContact CG2-CB 4.38Å; G452-E474 WeakPolarHBondContact CA-O 3.24Å; P472-E474 WeakPolarHBondContact CB-OE2 3.49Å; P472-E474 PolarHBondContact O-N 3.38Å; P472-E474 VanDerWaalsContact O-N 3.17Å; E474-G476 PolarHBondContact O-N 3.36Å; E474-S477 VanDerWaalsContact O-CB 3.28Å; E474-S477 WeakPolarHBondContact O-CB 3.19Å; E474-S477 PolarHBondContact O-N 3.01Å; E474-S477 PolarHBondContact O-OG 3.29Å
475	I	96.8	Very high	97.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-58.7	-28.5	172.7	-159.2	165.2	0	0	0	112.3	I451 L460 I471 P472 P473 S477 A478 L481 L484 P496 L499	I451-I475 HydrophobicContact CD1-CD1 4.3Å; I451-I475 HydrophobicContact CD1-CG1 4.16Å; I451-I475 HydrophobicContact CG2-CB 4.35Å; L460-I475 HydrophobicContact CD2-CD1 4.44Å; I471-I475 HydrophobicContact CG2-CD1 4.04Å; I471-I475 HydrophobicContact CG2-CG2 3.97Å; P472-I475 WeakPolarHBondContact O-CB 3.16Å; P472-I475 WeakPolarHBondContact O-CG2 3.44Å; P472-I475 PolarHBondContact O-N 3Å; P472-I475 VanDerWaalsContact O-N 3.11Å; P473-I475 PolarHBondContact O-N 3.45Å; P473-I475 VanDerWaalsContact O-N 3.15Å; I475-S477 PolarHBondContact O-N 3.3Å; I475-A478 WeakPolarHBondContact O-CB 3.44Å; I475-A478 PolarHBondContact O-N 2.98Å; I475-A478 VanDerWaalsContact O-N 3.11Å; I475-L481 HydrophobicContact CD1-CD2 4.3Å; I475-L481 HydrophobicContact CG1-CD2 4.04Å; I475-L484 HydrophobicContact CD1-CD1 4.09Å; I475-L484 HydrophobicContact CD1-CD2 3.68Å; I475-P496 HydrophobicContact CG2-CG 4.25Å; I475-L499 HydrophobicContact CG2-CD1 4.1Å
476	G	94.9	Very high	97.1	Very high	21 Å²	21	38.1 Å²	38.1	22%	0.216	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-67.1	-13.2	175.5	0	0	0	0	0	113.9	P473 E474 A478 L502	P473-G476 PolarHBondContact O-N 3.07Å; P473-G476 VanDerWaalsContact O-N 3.14Å; E474-G476 PolarHBondContact O-N 3.36Å; G476-A478 VanDerWaalsContact C-N 3.34Å; G476-L502 WeakPolarHBondContact O-CD2 3.18Å
477	S	95.5	Very high	97.1	Very high	70 Å²	70	33.6 Å²	33.6	49%	0.49	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-80.2	-15.7	173.4	-56.6	0	0	0	0	112.9	E474 I475 S479	E474-S477 VanDerWaalsContact O-CB 3.28Å; E474-S477 WeakPolarHBondContact O-CB 3.19Å; E474-S477 PolarHBondContact O-N 3.01Å; E474-S477 PolarHBondContact O-OG 3.29Å; I475-S477 PolarHBondContact O-N 3.3Å; S477-S479 PolarHBondContact O-N 3.47Å
478	A	94.9	Very high	97.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.206	C	C	.	.			trans	-77.6	69.7	173.5	0	0	0	0	0	110.1	L457 I475 G476 K480 L481 L502	L457-A478 HydrophobicContact CB-CB 4.45Å; I475-A478 WeakPolarHBondContact O-CB 3.44Å; I475-A478 PolarHBondContact O-N 2.98Å; I475-A478 VanDerWaalsContact O-N 3.11Å; G476-A478 VanDerWaalsContact C-N 3.34Å; A478-K480 PolarHBondContact O-N 2.82Å; A478-L481 HydrophobicContact CB-CB 4.21Å; A478-L481 WeakPolarHBondContact O-CB 3.32Å; A478-L481 PolarHBondContact O-N 3.47Å; A478-L502 WeakPolarHBondContact O-CD2 3.4Å
479	S	92.4	Very high	97.1	Very high	72 Å²	72	32.2 Å²	32.2	50%	0.503	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.4	-170.2	58.5	0	0	0	0	115.2	S477 E504	S477-S479 PolarHBondContact O-N 3.47Å; S479-E504 WeakPolarHBondContact O-CG 3.27Å
480	K	95.5	Very high	97.2	Very high	103 Å²	103	35.7 Å²	35.7	45%	0.448	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	1.2	176.1	-62.4	-166.9	-173.9	170.8	0	114.3	N456 L457 S458 A478 Y482	N456-K480 PolarHBondContact OD1-NZ 3.42Å; L457-K480 CarbonylContact O-C 3.58Å; S458-K480 WeakPolarHBondContact CA-O 3.48Å; A478-K480 PolarHBondContact O-N 2.82Å; K480-Y482 PolarHBondContact O-N 3.24Å
481	L	97.6	Very high	97.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.184	C	C	.	.			trans	-66.1	108.8	-175	-171.3	68.5	0	0	0	110.2	L457 L460 I475 A478 E483 L484 L502 E504 L505	L457-L481 HydrophobicContact CD2-CD1 4.28Å; L457-L481 HydrophobicContact CG-CD1 4.1Å; L457-L481 VanDerWaalsContact O-CA 3.25Å; L457-L481 WeakPolarHBondContact O-CA 3.34Å; L457-L481 PolarHBondContact O-N 2.74Å; L457-L481 VanDerWaalsContact O-N 3.07Å; L460-L481 HydrophobicContact CB-CD1 4.05Å; I475-L481 HydrophobicContact CD1-CD2 4.3Å; I475-L481 HydrophobicContact CG1-CD2 4.04Å; A478-L481 HydrophobicContact CB-CB 4.21Å; A478-L481 WeakPolarHBondContact O-CB 3.32Å; A478-L481 PolarHBondContact O-N 3.47Å; L481-E483 WeakPolarHBondContact CD1-O 3.4Å; L481-L484 HydrophobicContact CD2-CB 4.25Å; L481-L502 HydrophobicContact CB-CD1 4.3Å; L481-L502 HydrophobicContact CD2-CD1 3.92Å; L481-E504 CarbonylContact O-C 3.53Å; L481-L505 VanDerWaalsContact O-CA 3.29Å; L481-L505 WeakPolarHBondContact O-CA 3.19Å; L481-L505 PolarHBondContact O-N 3.2Å
482	Y	96.5	Very high	97.2	Very high	83 Å²	83	34.5 Å²	34.5	33%	0.325	20%	0.197	S	C	.	.			trans	-91.3	-37.8	176.3	173.3	-96.3	0	0	0	111.6	S458 K480 E504 G506 R507	S458-Y482 WeakPolarHBondContact O-CA 3.39Å; S458-Y482 PolarHBondContact O-N 2.79Å; K480-Y482 PolarHBondContact O-N 3.24Å; Y482-E504 WeakPolarHBondContact CA-O 3.15Å; Y482-E504 WeakPolarHBondContact CD2-O 3.36Å; Y482-G506 WeakPolarHBondContact O-CA 3.31Å; Y482-G506 PolarHBondContact O-N 3.12Å; Y482-R507 HydrophobicContact CE1-CG 4.32Å; Y482-R507 PolarHBondContact O-N 3.38Å
483	E	97.4	Very high	97.2	Very high	12 Å²	12	34.9 Å²	34.9	6%	0.056	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	124	-175.2	177.8	167	-168.2	0	0	111.1	S458 K459 L460 L481 S485 R507	S458-E483 PolarHBondContact O-N 2.88Å; K459-E483 HydrophobicContact CB-CB 4.43Å; K459-E483 WeakPolarHBondContact CE-OE2 3.15Å; K459-E483 HydrophobicContact CG-CB 4.1Å; K459-E483 IonicContact NZ-OE2 2.68Å; K459-E483 PolarHBondContact NZ-OE2 3.47Å; L460-E483 PolarHBondContact N-O 3.29Å; L481-E483 WeakPolarHBondContact CD1-O 3.4Å; E483-S485 WeakPolarHBondContact CG-OG 3.3Å; E483-S485 PolarHBondContact OE1-OG 3.17Å; E483-R507 WeakPolarHBondContact CA-O 3.45Å; E483-R507 HydrophobicContact CB-CB 4.36Å; E483-R507 HydrophobicContact CG-CB 4.13Å; E483-R507 IonicContact OE1-CZ 2.74Å; E483-R507 IonicContact OE1-NH1 2.63Å; E483-R507 PolarHBondContact OE1-NH1 3.4Å; E483-R507 IonicContact OE2-NH1 3.49Å
484	L	98.5	Very high	97.2	Very high	1 Å²	1	35 Å²	35	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	103.2	167.6	176.2	57.6	0	0	0	109	L460 I475 L481 L499 R507 L508 V509 L510	L460-L484 HydrophobicContact CB-CD1 4.22Å; L460-L484 HydrophobicContact CD2-CD1 3.83Å; L460-L484 HydrophobicContact CG-CD1 4.14Å; I475-L484 HydrophobicContact CD1-CD1 4.09Å; I475-L484 HydrophobicContact CD1-CD2 3.68Å; L481-L484 HydrophobicContact CD2-CB 4.25Å; L484-L499 HydrophobicContact CD2-CD1 4.04Å; L484-R507 PolarHBondContact N-O 2.93Å; L484-L508 HydrophobicContact CB-CD1 3.9Å; L484-L508 HydrophobicContact CD2-CD1 3.72Å; L484-L508 HydrophobicContact CG-CD1 3.94Å; L484-V509 PolarHBondContact O-N 3.48Å; L484-L510 HydrophobicContact CG-CD2 4.33Å
485	S	98.6	Very high	97.2	Very high	6 Å²	6	31.9 Å²	31.9	4%	0.042	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	109.7	177.9	-58.9	0	0	0	0	108.5	L460 V461 L462 E483 V509	L460-S485 PolarHBondContact O-N 2.63Å; V461-S485 CarbonylContact C-O 3.53Å; V461-S485 WeakPolarHBondContact CA-O 3.49Å; L462-S485 PolarHBondContact N-O 3.25Å; E483-S485 WeakPolarHBondContact CG-OG 3.3Å; E483-S485 PolarHBondContact OE1-OG 3.17Å; S485-V509 CarbonylContact C-O 3.58Å; S485-V509 WeakPolarHBondContact CA-O 3.14Å
486	A	98.6	Very high	97.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.193	C	C	.	.			trans	-139.6	30.5	-179.5	0	0	0	0	0	111.4	L462 N489 L491 V509 L510 N513	L462-A486 HydrophobicContact CB-CB 4.13Å; L462-A486 HydrophobicContact CD1-CB 4.47Å; A486-N489 PolarHBondContact O-ND2 2.92Å; A486-L491 HydrophobicContact CB-CD1 3.79Å; A486-V509 PolarHBondContact N-O 3.25Å; A486-L510 HydrophobicContact CB-CD2 3.86Å; A486-N513 PolarHBondContact O-ND2 2.85Å
487	D	98.4	Very high	97.3	Very high	37 Å²	37	34.5 Å²	34.5	20%	0.198	21%	0.213	C	C	.	.			trans	-65.9	156.9	176	56.6	-69.5	0	0	0	112.8	S463 N464 N489 V509 R511	S463-D487 CarbonylContact C-O 3.38Å; S463-D487 WeakPolarHBondContact CA-O 3.48Å; S463-D487 VanDerWaalsContact CB-OD1 3.26Å; S463-D487 WeakPolarHBondContact CB-OD1 3.42Å; S463-D487 PolarHBondContact OG-OD1 2.89Å; N464-D487 PolarHBondContact N-O 2.7Å; D487-N489 PolarHBondContact O-ND2 3.41Å; D487-V509 HydrophobicContact CB-CG1 4.01Å; D487-V509 PolarHBondContact N-O 3.48Å; D487-V509 WeakPolarHBondContact OD1-CG1 3.38Å; D487-R511 CarbonylContact C-O 3.3Å; D487-R511 WeakPolarHBondContact CA-O 3.08Å; D487-R511 HydrophobicContact CB-CB 4.02Å; D487-R511 WeakPolarHBondContact CB-O 3.34Å
488	G	98.4	Very high	97.3	Very high	14 Å²	14	33.2 Å²	33.2	14%	0.144	20%	0.204	C	C	.	.	S	Bend	trans	64.7	43.2	179.5	0	0	0	0	0	113.2	N464 N465 R511 N512	N464-G488 WeakPolarHBondContact CA-O 3.48Å; N465-G488 PolarHBondContact N-O 2.96Å; G488-R511 PolarHBondContact N-O 3.21Å; G488-N512 WeakPolarHBondContact CA-O 3.45Å; G488-N512 PolarHBondContact N-O 3.12Å
489	N	98.8	Very high	97.3	Very high	12 Å²	12	33.2 Å²	33.2	6%	0.064	20%	0.204	C	C	.	.	S	Bend	trans	-126.5	-172.1	176.6	-84.4	-83	0	0	0	110.5	L462 N465 R466 L467 A486 D487 L491 N512 N513	L462-N489 PolarHBondContact O-ND2 3.23Å; N465-N489 WeakPolarHBondContact CA-OD1 3.11Å; N465-N489 WeakPolarHBondContact CB-OD1 3.12Å; N465-N489 PolarHBondContact O-OD1 3.24Å; R466-N489 PolarHBondContact N-OD1 3.34Å; L467-N489 HydrophobicContact CB-CB 4.41Å; L467-N489 VanDerWaalsContact CB-OD1 3.28Å; L467-N489 WeakPolarHBondContact CB-OD1 3.48Å; L467-N489 WeakPolarHBondContact CG-OD1 3.45Å; L467-N489 PolarHBondContact N-OD1 3Å; A486-N489 PolarHBondContact O-ND2 2.92Å; D487-N489 PolarHBondContact O-ND2 3.41Å; N489-L491 HydrophobicContact CB-CG 4.11Å; N489-N512 PolarHBondContact N-O 3.42Å; N489-N513 WeakPolarHBondContact CA-OD1 3.18Å; N489-N513 WeakPolarHBondContact CB-OD1 3.21Å; N489-N513 PolarHBondContact O-OD1 3.28Å; N489-N513 VanDerWaalsContact O-OD1 3.14Å
490	M	98.3	Very high	97.4	Very high	95 Å²	95	30 Å²	30	47%	0.468	18%	0.182	S	C	.	.			trans	-112.7	30.8	174.7	-62	178.4	-74	0	0	111.6	R466 L467 T468 N513	R466-M490 HydrophobicContact CB-CE 3.59Å; R466-M490 HydrophobicContact CG-CE 4.24Å; R466-M490 VanDerWaalsContact O-CE 3.27Å; R466-M490 WeakPolarHBondContact O-CE 3.24Å; L467-M490 CarbonylContact O-C 3.47Å; L467-M490 WeakPolarHBondContact O-CA 3.45Å; L467-M490 WeakPolarHBondContact O-CB 3.48Å; L467-M490 PolarHBondContact O-N 2.96Å; T468-M490 HydrophobicContact CG2-CB 4.04Å; T468-M490 HydrophobicContact CG2-CE 3.93Å; M490-N513 PolarHBondContact N-OD1 2.69Å
491	L	98.7	Very high	97.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	18%	0.182	C	C	.	.			trans	-63.8	144.8	177.7	-60.6	173.6	0	0	0	110.1	I447 L467 G469 I471 A486 N489 N513 S514 L515	I447-L491 HydrophobicContact CD1-CD1 4.41Å; I447-L491 HydrophobicContact CD1-CD2 4.24Å; L467-L491 HydrophobicContact CB-CD2 4.05Å; L467-L491 PolarHBondContact O-N 2.88Å; G469-L491 CarbonylContact O-C 3.54Å; G469-L491 WeakPolarHBondContact O-CA 3.26Å; I471-L491 HydrophobicContact CD1-CD1 4.45Å; I471-L491 HydrophobicContact CG1-CD1 4.22Å; A486-L491 HydrophobicContact CB-CD1 3.79Å; N489-L491 HydrophobicContact CB-CG 4.11Å; L491-N513 HydrophobicContact CB-CB 4.4Å; L491-N513 VanDerWaalsContact CB-OD1 3.26Å; L491-N513 WeakPolarHBondContact CB-OD1 3.34Å; L491-N513 WeakPolarHBondContact CG-OD1 3.4Å; L491-N513 PolarHBondContact N-OD1 3.26Å; L491-S514 CarbonylContact O-C 3.55Å; L491-S514 WeakPolarHBondContact O-CA 3.3Å; L491-S514 WeakPolarHBondContact O-CB 3.33Å; L491-S514 PolarHBondContact O-N 2.65Å; L491-L515 HydrophobicContact CB-CD2 4.02Å; L491-L515 HydrophobicContact CB-CG 4.46Å; L491-L515 PolarHBondContact O-N 3.4Å
492	S	98.4	Very high	97.2	Very high	42 Å²	42	27.2 Å²	27.2	29%	0.294	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	178.1	-171	61.6	0	0	0	0	112.2	G469 S470 S514	G469-S492 PolarHBondContact O-N 3.12Å; G469-S492 PolarHBondContact O-OG 3.25Å; S470-S492 VanDerWaalsContact CA-O 3.23Å; S470-S492 WeakPolarHBondContact CA-O 3.26Å; S470-S492 PolarHBondContact OG-O 3.43Å; S492-S514 WeakPolarHBondContact CA-O 3.37Å
493	G	97.9	Very high	97.1	Very high	16 Å²	16	29.4 Å²	29.4	17%	0.165	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	73.5	-176.9	-178.6	0	0	0	0	0	113.8	L515 S516	G493-L515 WeakPolarHBondContact O-CA 3.47Å; G493-S516 PolarHBondContact O-N 2.82Å
494	P	97.9	Very high	97.1	Very high	76 Å²	76	32.3 Å²	32.3	49%	0.494	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	156.8	-178.8	33.1	-35.2	0	0	0	113.2	S516	P494-S516 VanDerWaalsContact CA-O 3.27Å; P494-S516 WeakPolarHBondContact CA-O 3.09Å
495	L	98	Very high	97	Very high	10 Å²	10	32.2 Å²	32.2	5%	0.052	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-62.7	130.7	165.4	-64.6	177.6	0	0	0	109.2	I471 L499 L510 L515 L520 L534 F539	I471-L495 HydrophobicContact CD1-CD2 4.1Å; L495-L499 HydrophobicContact CD2-CD2 4.34Å; L495-L510 HydrophobicContact CD2-CD1 3.49Å; L495-L510 VanDerWaalsContact CD2-CD1 3.49Å; L495-L515 HydrophobicContact CD2-CD1 4.31Å; L495-L520 HydrophobicContact CB-CD1 4.02Å; L495-L520 HydrophobicContact CB-CD2 3.98Å; L495-L520 HydrophobicContact CB-CG 3.82Å; L495-L520 HydrophobicContact CD1-CG 4.31Å; L495-L520 WeakPolarHBondContact O-CD2 3.38Å; L495-L534 HydrophobicContact CD1-CD1 4.23Å; L495-F539 HydrophobicContact CD1-CE1 3.99Å; L495-F539 HydrophobicContact CD1-CZ 3.88Å; L495-F539 HydrophobicContact CD2-CZ 4.17Å; L495-F539 HydrophobicContact CG-CE1 3.79Å; L495-F539 HydrophobicContact CG-CZ 3.79Å
496	P	97	Very high	96.9	Very high	15 Å²	15	32 Å²	32	10%	0.097	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-71	138.5	178.9	27.7	-33	0	0	0	110.9	I471 P473 I475 S498 L499	I471-P496 HydrophobicContact CB-CG 4.45Å; I471-P496 HydrophobicContact CG2-CG 4.07Å; P473-P496 HydrophobicContact CB-CB 4Å; I475-P496 HydrophobicContact CG2-CG 4.25Å; P496-S498 PolarHBondContact O-N 3.11Å; P496-S498 VanDerWaalsContact O-N 3.15Å; P496-L499 HydrophobicContact CG-CB 4.3Å; P496-L499 VanDerWaalsContact O-CB 3.24Å; P496-L499 WeakPolarHBondContact O-CB 3.28Å; P496-L499 PolarHBondContact O-N 3.09Å
497	G	95.8	Very high	96.8	Very high	60 Å²	60	35.7 Å²	35.7	62%	0.619	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-58.9	-28.5	-179.2	0	0	0	0	0	114.2	L499 G500	G497-L499 PolarHBondContact O-N 2.87Å; G497-G500 PolarHBondContact O-N 3.36Å; G497-G500 VanDerWaalsContact O-N 3.12Å
498	S	95	Very high	96.8	Very high	43 Å²	43	34 Å²	34	30%	0.301	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-61.9	-26.2	175.8	55.8	0	0	0	0	113.7	P473 P496 G500 G501	P473-S498 WeakPolarHBondContact CA-OG 3.5Å; P473-S498 VanDerWaalsContact O-CB 3.32Å; P473-S498 WeakPolarHBondContact O-CB 3.35Å; P473-S498 PolarHBondContact O-OG 3.3Å; P496-S498 PolarHBondContact O-N 3.11Å; P496-S498 VanDerWaalsContact O-N 3.15Å; S498-G500 PolarHBondContact O-N 2.79Å; S498-G501 PolarHBondContact O-N 2.94Å; S498-G501 VanDerWaalsContact O-N 3.12Å
499	L	95.8	Very high	96.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-62.9	-32.1	175.2	-170.2	74.1	0	0	0	111.7	I475 L484 L495 P496 G497 G501 L502 L508 L520 W526	I475-L499 HydrophobicContact CG2-CD1 4.1Å; L484-L499 HydrophobicContact CD2-CD1 4.04Å; L495-L499 HydrophobicContact CD2-CD2 4.34Å; P496-L499 HydrophobicContact CG-CB 4.3Å; P496-L499 VanDerWaalsContact O-CB 3.24Å; P496-L499 WeakPolarHBondContact O-CB 3.28Å; P496-L499 PolarHBondContact O-N 3.09Å; G497-L499 PolarHBondContact O-N 2.87Å; L499-G501 PolarHBondContact O-N 3.35Å; L499-L502 HydrophobicContact CD1-CD1 3.75Å; L499-L502 PolarHBondContact O-N 3.05Å; L499-L508 HydrophobicContact CD2-CD1 4.24Å; L499-L508 HydrophobicContact CD2-CD2 3.84Å; L499-L520 HydrophobicContact CB-CD1 3.94Å; L499-L520 HydrophobicContact CD2-CD1 4.23Å; L499-L520 HydrophobicContact CG-CD1 4.48Å; L499-W526 HydrophobicContact CD2-CZ2 4.49Å; L499-W526 HydrophobicContact CG-CZ2 4.31Å; L499-W526 PolarHBondContact O-NE1 2.86Å
500	G	94.4	Very high	96.8	Very high	5 Å²	5	33.3 Å²	33.3	5%	0.052	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-66.8	-15.6	176.8	0	0	0	0	0	114.1	G497 S498	G497-G500 PolarHBondContact O-N 3.36Å; G497-G500 VanDerWaalsContact O-N 3.12Å; S498-G500 PolarHBondContact O-N 2.79Å
501	G	93.7	Very high	96.8	Very high	43 Å²	43	34.3 Å²	34.3	44%	0.443	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-91.7	-3.4	179.1	0	0	0	0	0	115.2	S498 L499 E503	S498-G501 PolarHBondContact O-N 2.94Å; S498-G501 VanDerWaalsContact O-N 3.12Å; L499-G501 PolarHBondContact O-N 3.35Å; G501-E503 PolarHBondContact O-N 3.3Å
502	L	95.5	Very high	96.8	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	23%	0.228	C	C	.	.			trans	-74.8	105.3	-178.4	-68.3	177.7	0	0	0	111.6	G476 A478 L481 L499 E504 L505	G476-L502 WeakPolarHBondContact O-CD2 3.18Å; A478-L502 WeakPolarHBondContact O-CD2 3.4Å; L481-L502 HydrophobicContact CB-CD1 4.3Å; L481-L502 HydrophobicContact CD2-CD1 3.92Å; L499-L502 HydrophobicContact CD1-CD1 3.75Å; L499-L502 PolarHBondContact O-N 3.05Å; L502-E504 VanDerWaalsContact C-N 3.34Å; L502-E504 PolarHBondContact O-N 3.14Å; L502-L505 HydrophobicContact CB-CB 3.97Å; L502-L505 HydrophobicContact CD1-CD1 4.49Å
503	E	94.7	Very high	96.8	Very high	129 Å²	129	37.4 Å²	37.4	60%	0.603	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-27.6	-176	-63.1	-178.2	-179.7	0	0	114	G501 S525	G501-E503 PolarHBondContact O-N 3.3Å; E503-S525 WeakPolarHBondContact CA-O 3.36Å
504	E	96	Very high	96.8	Very high	72 Å²	72	40.3 Å²	40.3	34%	0.336	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-9.5	-177.5	-68.5	-63.1	133.9	0	0	113.6	S479 L481 Y482 L502 G506 K528	S479-E504 WeakPolarHBondContact O-CG 3.27Å; L481-E504 CarbonylContact O-C 3.53Å; Y482-E504 WeakPolarHBondContact CA-O 3.15Å; Y482-E504 WeakPolarHBondContact CD2-O 3.36Å; L502-E504 VanDerWaalsContact C-N 3.34Å; L502-E504 PolarHBondContact O-N 3.14Å; E504-G506 PolarHBondContact O-N 3.27Å; E504-K528 IonicContact OE1-NZ 3.22Å; E504-K528 PolarHBondContact OE1-NZ 3.42Å; E504-K528 IonicContact OE2-NZ 3.81Å; E504-K528 PolarHBondContact OE2-NZ 2.82Å
505	L	97.6	Very high	96.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.211	C	C	.	.			trans	-63	118.2	-172.7	-167.4	69.2	0	0	0	111.2	L481 L502 L508 W526 K528 L529	L481-L505 VanDerWaalsContact O-CA 3.29Å; L481-L505 WeakPolarHBondContact O-CA 3.19Å; L481-L505 PolarHBondContact O-N 3.2Å; L502-L505 HydrophobicContact CB-CB 3.97Å; L502-L505 HydrophobicContact CD1-CD1 4.49Å; L505-L508 HydrophobicContact CD2-CB 4.28Å; L505-L508 HydrophobicContact CD2-CD2 4.38Å; L505-W526 HydrophobicContact CD2-CZ2 4.25Å; L505-K528 CarbonylContact O-C 3.5Å; L505-K528 VanDerWaalsContact O-C 3.3Å; L505-L529 HydrophobicContact CD2-CD1 4.15Å; L505-L529 HydrophobicContact CG-CD1 3.98Å; L505-L529 VanDerWaalsContact O-CA 3.29Å; L505-L529 WeakPolarHBondContact O-CA 3.19Å; L505-L529 PolarHBondContact O-N 2.95Å
506	G	95.4	Very high	96.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.224	C	C	.	.			trans	-110.2	-29.3	-178.8	0	0	0	0	0	114.5	Y482 E504 K528 S530 E531	Y482-G506 WeakPolarHBondContact O-CA 3.31Å; Y482-G506 PolarHBondContact O-N 3.12Å; E504-G506 PolarHBondContact O-N 3.27Å; G506-K528 WeakPolarHBondContact CA-O 3.09Å; G506-S530 PolarHBondContact O-N 2.96Å; G506-S530 PolarHBondContact O-OG 2.85Å; G506-E531 PolarHBondContact O-N 3.04Å
507	R	97	Very high	96.9	Very high	79 Å²	79	39 Å²	39	30%	0.298	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	126.5	-179.8	-58.1	-178	73.5	-160.3	8.2	110.8	Y482 E483 L484 E531	Y482-R507 HydrophobicContact CE1-CG 4.32Å; Y482-R507 PolarHBondContact O-N 3.38Å; E483-R507 WeakPolarHBondContact CA-O 3.45Å; E483-R507 HydrophobicContact CB-CB 4.36Å; E483-R507 HydrophobicContact CG-CB 4.13Å; E483-R507 IonicContact OE1-CZ 2.74Å; E483-R507 IonicContact OE1-NH1 2.63Å; E483-R507 PolarHBondContact OE1-NH1 3.4Å; E483-R507 IonicContact OE2-NH1 3.49Å; L484-R507 PolarHBondContact N-O 2.93Å; R507-E531 HydrophobicContact CG-CB 4.36Å; R507-E531 IonicContact CZ-OE2 2.57Å; R507-E531 VanDerWaalsContact CZ-OE2 3.25Å; R507-E531 IonicContact NE-OE2 3.73Å; R507-E531 PolarHBondContact NE-OE2 3.39Å; R507-E531 IonicContact NH2-OE1 2.76Å; R507-E531 IonicContact NH2-OE2 3.25Å; R507-E531 PolarHBondContact NH2-OE2 3.17Å
508	L	98.5	Very high	96.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	103.7	174.4	-177.1	60.1	0	0	0	109.8	L484 L499 L505 L510 W526 L529 E531 L532 N533	L484-L508 HydrophobicContact CB-CD1 3.9Å; L484-L508 HydrophobicContact CD2-CD1 3.72Å; L484-L508 HydrophobicContact CG-CD1 3.94Å; L499-L508 HydrophobicContact CD2-CD1 4.24Å; L499-L508 HydrophobicContact CD2-CD2 3.84Å; L505-L508 HydrophobicContact CD2-CB 4.28Å; L505-L508 HydrophobicContact CD2-CD2 4.38Å; L508-L510 HydrophobicContact CD1-CD1 3.78Å; L508-L510 HydrophobicContact CD1-CD2 4.41Å; L508-L510 HydrophobicContact CD1-CG 3.88Å; L508-L510 HydrophobicContact CG-CD1 4.2Å; L508-L510 HydrophobicContact CG-CG 4.31Å; L508-W526 HydrophobicContact CD2-CH2 4Å; L508-W526 HydrophobicContact CD2-CZ2 4.2Å; L508-L529 HydrophobicContact CB-CD1 4.09Å; L508-E531 PolarHBondContact N-O 2.82Å; L508-L532 HydrophobicContact CB-CD1 3.98Å; L508-L532 HydrophobicContact CD2-CD1 3.71Å; L508-L532 HydrophobicContact CG-CD1 4.04Å; L508-N533 PolarHBondContact O-N 2.99Å
509	V	98.5	Very high	97.1	Very high	13 Å²	13	40.3 Å²	40.3	8%	0.079	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	102.5	-174.4	-172.2	0	0	0	0	108.8	L484 S485 A486 D487 E531 N533	L484-V509 PolarHBondContact O-N 3.48Å; S485-V509 CarbonylContact C-O 3.58Å; S485-V509 WeakPolarHBondContact CA-O 3.14Å; A486-V509 PolarHBondContact N-O 3.25Å; D487-V509 HydrophobicContact CB-CG1 4.01Å; D487-V509 PolarHBondContact N-O 3.48Å; D487-V509 WeakPolarHBondContact OD1-CG1 3.38Å; V509-E531 HydrophobicContact CG2-CG 4.32Å; V509-N533 HydrophobicContact CG1-CB 4.23Å
510	L	98.7	Very high	97.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.			trans	-127.2	19.3	-175.6	-60.6	177.7	0	0	0	112.3	I471 L484 A486 L495 L508 N513 L515 N533 L534 N537	I471-L510 HydrophobicContact CD1-CD1 3.74Å; I471-L510 HydrophobicContact CD1-CD2 4Å; L484-L510 HydrophobicContact CG-CD2 4.33Å; A486-L510 HydrophobicContact CB-CD2 3.86Å; L495-L510 HydrophobicContact CD2-CD1 3.49Å; L495-L510 VanDerWaalsContact CD2-CD1 3.49Å; L508-L510 HydrophobicContact CD1-CD1 3.78Å; L508-L510 HydrophobicContact CD1-CD2 4.41Å; L508-L510 HydrophobicContact CD1-CG 3.88Å; L508-L510 HydrophobicContact CG-CD1 4.2Å; L508-L510 HydrophobicContact CG-CG 4.31Å; L510-N513 PolarHBondContact O-ND2 2.85Å; L510-N513 VanDerWaalsContact O-ND2 3.09Å; L510-L515 HydrophobicContact CB-CD1 3.76Å; L510-L515 HydrophobicContact CD1-CD1 3.95Å; L510-L515 HydrophobicContact CG-CD1 4.39Å; L510-N533 PolarHBondContact N-O 3.46Å; L510-L534 HydrophobicContact CB-CD2 3.91Å; L510-L534 HydrophobicContact CD1-CD2 4.03Å; L510-L534 HydrophobicContact CG-CD2 4.29Å; L510-N537 PolarHBondContact O-ND2 2.98Å
511	R	98.3	Very high	96.9	Very high	116 Å²	116	49.4 Å²	49.4	44%	0.438	25%	0.253	S	S	.	.			trans	-54.4	151.3	-178.7	173.5	173	179.3	-130.9	-4.6	112.4	D487 G488 N513 N533 A535 D536	D487-R511 CarbonylContact C-O 3.3Å; D487-R511 WeakPolarHBondContact CA-O 3.08Å; D487-R511 HydrophobicContact CB-CB 4.02Å; D487-R511 WeakPolarHBondContact CB-O 3.34Å; G488-R511 PolarHBondContact N-O 3.21Å; R511-N513 PolarHBondContact O-ND2 3.16Å; R511-N533 PolarHBondContact N-O 3.43Å; R511-A535 CarbonylContact C-O 3.53Å; R511-A535 WeakPolarHBondContact CA-O 3.43Å; R511-A535 HydrophobicContact CB-CB 4.49Å; R511-A535 HydrophobicContact CG-CB 3.99Å; R511-D536 HydrophobicContact CG-CB 4.48Å; R511-D536 IonicContact CZ-OD2 2.83Å; R511-D536 IonicContact NE-OD2 2.77Å; R511-D536 PolarHBondContact NE-OD2 3.36Å; R511-D536 IonicContact NH2-OD2 3.79Å; R511-D536 PolarHBondContact NH2-OD2 3.46Å
512	N	98.4	Very high	96.6	Very high	93 Å²	93	49.5 Å²	49.5	50%	0.497	25%	0.254	S	S	.	.	S	Bend	trans	57.4	62.8	170.1	-171.5	31.3	0	0	0	111.4	G488 N489 A535 D536	G488-N512 WeakPolarHBondContact CA-O 3.45Å; G488-N512 PolarHBondContact N-O 3.12Å; N489-N512 PolarHBondContact N-O 3.42Å; N512-A535 PolarHBondContact N-O 3.27Å; N512-D536 VanDerWaalsContact CA-O 3.27Å; N512-D536 WeakPolarHBondContact CA-O 3.2Å; N512-D536 HydrophobicContact CB-CB 4.31Å; N512-D536 PolarHBondContact N-O 2.97Å
513	N	98.7	Very high	96.5	Very high	13 Å²	13	49.5 Å²	49.5	7%	0.07	25%	0.254	C	S	.	.	S	Bend	trans	-138	-174.3	176.6	-87.1	-78.3	0	0	0	109.1	A486 N489 M490 L491 L510 R511 L515 D536 N537	A486-N513 PolarHBondContact O-ND2 2.85Å; N489-N513 WeakPolarHBondContact CA-OD1 3.18Å; N489-N513 WeakPolarHBondContact CB-OD1 3.21Å; N489-N513 PolarHBondContact O-OD1 3.28Å; N489-N513 VanDerWaalsContact O-OD1 3.14Å; M490-N513 PolarHBondContact N-OD1 2.69Å; L491-N513 HydrophobicContact CB-CB 4.4Å; L491-N513 VanDerWaalsContact CB-OD1 3.26Å; L491-N513 WeakPolarHBondContact CB-OD1 3.34Å; L491-N513 WeakPolarHBondContact CG-OD1 3.4Å; L491-N513 PolarHBondContact N-OD1 3.26Å; L510-N513 PolarHBondContact O-ND2 2.85Å; L510-N513 VanDerWaalsContact O-ND2 3.09Å; R511-N513 PolarHBondContact O-ND2 3.16Å; N513-L515 HydrophobicContact CB-CD1 4.23Å; N513-L515 HydrophobicContact CB-CG 4.04Å; N513-D536 PolarHBondContact N-O 3.23Å; N513-N537 WeakPolarHBondContact CA-OD1 3.46Å; N513-N537 WeakPolarHBondContact CB-OD1 3.31Å; N513-N537 PolarHBondContact O-OD1 3.5Å
514	S	98	Very high	96.3	Very high	77 Å²	77	47.1 Å²	47.1	54%	0.538	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	27.9	173.2	-61.5	0	0	0	0	112.6	L491 S492	L491-S514 CarbonylContact O-C 3.55Å; L491-S514 WeakPolarHBondContact O-CA 3.3Å; L491-S514 WeakPolarHBondContact O-CB 3.33Å; L491-S514 PolarHBondContact O-N 2.65Å; S492-S514 WeakPolarHBondContact CA-O 3.37Å
515	L	98.6	Very high	96.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	148	-179.2	-61.2	165.8	0	0	0	110.2	I471 L491 G493 L495 L510 N513 N537 G538 F539	I471-L515 HydrophobicContact CD1-CD1 4.47Å; I471-L515 HydrophobicContact CD1-CD2 4.18Å; L491-L515 HydrophobicContact CB-CD2 4.02Å; L491-L515 HydrophobicContact CB-CG 4.46Å; L491-L515 PolarHBondContact O-N 3.4Å; G493-L515 WeakPolarHBondContact O-CA 3.47Å; L495-L515 HydrophobicContact CD2-CD1 4.31Å; L510-L515 HydrophobicContact CB-CD1 3.76Å; L510-L515 HydrophobicContact CD1-CD1 3.95Å; L510-L515 HydrophobicContact CG-CD1 4.39Å; N513-L515 HydrophobicContact CB-CD1 4.23Å; N513-L515 HydrophobicContact CB-CG 4.04Å; L515-N537 HydrophobicContact CB-CB 4.49Å; L515-N537 VanDerWaalsContact CB-OD1 3.25Å; L515-N537 WeakPolarHBondContact CB-OD1 3.43Å; L515-N537 PolarHBondContact N-OD1 3.35Å; L515-G538 CarbonylContact O-C 3.12Å; L515-G538 WeakPolarHBondContact O-CA 3.5Å; L515-G538 PolarHBondContact O-N 3.06Å; L515-F539 HydrophobicContact CB-CE1 4.09Å; L515-F539 HydrophobicContact CB-CE2 4Å; L515-F539 HydrophobicContact CB-CZ 3.52Å; L515-F539 HydrophobicContact CD1-CE2 4.44Å; L515-F539 HydrophobicContact CD1-CZ 4.04Å; L515-F539 HydrophobicContact CG-CZ 4.41Å
516	S	98.1	Very high	96	Very high	47 Å²	47	45.9 Å²	45.9	33%	0.329	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	-170.2	-171.7	59.6	0	0	0	0	111.6	G493 P494 F539	G493-S516 PolarHBondContact O-N 2.82Å; P494-S516 VanDerWaalsContact CA-O 3.27Å; P494-S516 WeakPolarHBondContact CA-O 3.09Å; S516-F539 WeakPolarHBondContact O-CE1 3.41Å
517	G	97.5	Very high	95.9	Very high	27 Å²	27	51 Å²	51	28%	0.278	27%	0.266	S	S	.	.	S	Bend	trans	79.7	-163.1	-177.3	0	0	0	0	0	112.6	T540	G517-T540 PolarHBondContact O-N 3.1Å; G517-T540 PolarHBondContact O-OG1 3.42Å
518	Q	97.4	Very high	95.8	Very high	117 Å²	117	51.6 Å²	51.6	55%	0.547	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-94.6	153.4	179.7	-63.9	-178.1	9.4	0	0	110.9	T540	Q518-T540 WeakPolarHBondContact CA-O 3.27Å
519	L	97.5	Very high	95.8	Very high	13 Å²	13	51.6 Å²	51.6	7%	0.068	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-60.1	145.1	167.6	-62.4	179	0	0	0	110.2	L534 F539 P544 L558 L563	L519-L534 HydrophobicContact CD2-CD1 3.54Å; L519-F539 HydrophobicContact CD2-CB 4.15Å; L519-F539 HydrophobicContact CD2-CD1 4.03Å; L519-F539 HydrophobicContact CD2-CD2 4.19Å; L519-F539 HydrophobicContact CD2-CG 3.85Å; L519-P544 HydrophobicContact CB-CG 3.82Å; L519-L558 HydrophobicContact CD1-CD1 4.13Å; L519-L558 HydrophobicContact CD1-CD2 4.46Å; L519-L563 HydrophobicContact CD1-CD1 4.23Å; L519-L563 HydrophobicContact CD1-CD2 3.74Å; L519-L563 HydrophobicContact CG-CD2 3.93Å
520	L	95.5	Very high	95.6	Very high	20 Å²	20	52.2 Å²	52.2	11%	0.105	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-62.4	138.7	-175.7	-68.8	-179.9	0	0	0	112	L495 L499 I523 W526	L495-L520 HydrophobicContact CB-CD1 4.02Å; L495-L520 HydrophobicContact CB-CD2 3.98Å; L495-L520 HydrophobicContact CB-CG 3.82Å; L495-L520 HydrophobicContact CD1-CG 4.31Å; L495-L520 WeakPolarHBondContact O-CD2 3.38Å; L499-L520 HydrophobicContact CB-CD1 3.94Å; L499-L520 HydrophobicContact CD2-CD1 4.23Å; L499-L520 HydrophobicContact CG-CD1 4.48Å; L520-I523 HydrophobicContact CB-CG2 3.69Å; L520-W526 HydrophobicContact CD1-CH2 4.23Å; L520-W526 HydrophobicContact CD1-CZ2 4.1Å
521	R	91.7	Very high	95.6	Very high	176 Å²	176	53.7 Å²	53.7	66%	0.664	28%	0.282	S	S	*	.	S	Bend	trans	-103.2	156.5	167.2	-64	-174.1	-179.9	-169.4	-2.3	109.7
522	G	87.3	Confident	95.6	Very high	45 Å²	45	48.4 Å²	48.4	46%	0.464	26%	0.262	S	S	.	.			trans	77.6	24	-177.7	0	0	0	0	0	114.2	N524	G522-N524 PolarHBondContact O-N 3.1Å
523	I	93	Very high	95.6	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-75.1	18.7	179.1	58.6	171	0	0	0	114.1	L520 S525 W526 E546 L547 L550	L520-I523 HydrophobicContact CB-CG2 3.69Å; I523-S525 PolarHBondContact O-N 3.16Å; I523-S525 VanDerWaalsContact O-N 3.08Å; I523-W526 HydrophobicContact CB-CD2 3.83Å; I523-W526 HydrophobicContact CB-CE3 3.55Å; I523-W526 HydrophobicContact CB-CG 4.4Å; I523-W526 HydrophobicContact CB-CH2 4.43Å; I523-W526 HydrophobicContact CB-CZ3 3.89Å; I523-W526 HydrophobicContact CD1-CE3 3.9Å; I523-W526 HydrophobicContact CD1-CZ3 3.94Å; I523-W526 HydrophobicContact CG1-CE3 4.28Å; I523-W526 HydrophobicContact CG2-CD2 4.04Å; I523-W526 HydrophobicContact CG2-CE3 3.73Å; I523-W526 HydrophobicContact CG2-CH2 3.67Å; I523-W526 HydrophobicContact CG2-CZ2 3.96Å; I523-W526 HydrophobicContact CG2-CZ3 3.54Å; I523-W526 WeakPolarHBondContact O-CB 3.12Å; I523-W526 PolarHBondContact O-N 3.39Å; I523-E546 HydrophobicContact CG1-CB 4.14Å; I523-L547 HydrophobicContact CD1-CD2 3.48Å; I523-L547 VanDerWaalsContact CD1-CD2 3.48Å; I523-L547 HydrophobicContact CD1-CG 3.86Å; I523-L550 HydrophobicContact CD1-CD1 4.35Å
524	N	89.8	Confident	95.5	Very high	79 Å²	79	44.1 Å²	44.1	42%	0.422	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-61.2	-22.2	-176.5	-69.9	-33.8	0	0	0	112.9	G522 W526 K527	G522-N524 PolarHBondContact O-N 3.1Å; N524-W526 VanDerWaalsContact C-N 3.31Å; N524-K527 WeakPolarHBondContact O-CD 3.22Å; N524-K527 WeakPolarHBondContact O-CE 3.33Å; N524-K527 PolarHBondContact O-NZ 2.86Å
525	S	93	Very high	95.6	Very high	40 Å²	40	40.4 Å²	40.4	28%	0.28	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-73.4	-17.4	177.6	-59.3	0	0	0	0	113.7	E503 I523 K527	E503-S525 WeakPolarHBondContact CA-O 3.36Å; I523-S525 PolarHBondContact O-N 3.16Å; I523-S525 VanDerWaalsContact O-N 3.08Å; S525-K527 PolarHBondContact O-N 2.99Å
526	W	95.5	Very high	95.6	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.027	23%	0.229	C	C	.	.			trans	-72	52	-179.8	-70.5	-10.1	0	0	0	113.6	L499 L505 L508 L520 I523 N524 K528 L529 L532 L550	L499-W526 HydrophobicContact CD2-CZ2 4.49Å; L499-W526 HydrophobicContact CG-CZ2 4.31Å; L499-W526 PolarHBondContact O-NE1 2.86Å; L505-W526 HydrophobicContact CD2-CZ2 4.25Å; L508-W526 HydrophobicContact CD2-CH2 4Å; L508-W526 HydrophobicContact CD2-CZ2 4.2Å; L520-W526 HydrophobicContact CD1-CH2 4.23Å; L520-W526 HydrophobicContact CD1-CZ2 4.1Å; I523-W526 HydrophobicContact CB-CD2 3.83Å; I523-W526 HydrophobicContact CB-CE3 3.55Å; I523-W526 HydrophobicContact CB-CG 4.4Å; I523-W526 HydrophobicContact CB-CH2 4.43Å; I523-W526 HydrophobicContact CB-CZ3 3.89Å; I523-W526 HydrophobicContact CD1-CE3 3.9Å; I523-W526 HydrophobicContact CD1-CZ3 3.94Å; I523-W526 HydrophobicContact CG1-CE3 4.28Å; I523-W526 HydrophobicContact CG2-CD2 4.04Å; I523-W526 HydrophobicContact CG2-CE3 3.73Å; I523-W526 HydrophobicContact CG2-CH2 3.67Å; I523-W526 HydrophobicContact CG2-CZ2 3.96Å; I523-W526 HydrophobicContact CG2-CZ3 3.54Å; I523-W526 WeakPolarHBondContact O-CB 3.12Å; I523-W526 PolarHBondContact O-N 3.39Å; N524-W526 VanDerWaalsContact C-N 3.31Å; W526-K528 PolarHBondContact O-N 3.23Å; W526-L529 HydrophobicContact CB-CB 3.86Å; W526-L529 HydrophobicContact CB-CD2 4.32Å; W526-L529 HydrophobicContact CD2-CD2 3.93Å; W526-L529 HydrophobicContact CE3-CD2 3.41Å; W526-L529 VanDerWaalsContact CE3-CD2 3.41Å; W526-L529 HydrophobicContact CG-CB 4.47Å; W526-L529 HydrophobicContact CG-CD2 4.35Å; W526-L529 HydrophobicContact CZ3-CD2 3.96Å; W526-L529 PolarHBondContact O-N 2.84Å; W526-L532 HydrophobicContact CZ3-CD2 4.43Å; W526-L550 HydrophobicContact CB-CD1 4.5Å; W526-L550 HydrophobicContact CB-CD2 3.93Å; W526-L550 HydrophobicContact CE3-CD1 4.31Å
527	K	92.8	Very high	95.6	Very high	108 Å²	108	41.9 Å²	41.9	47%	0.47	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.3	-175.6	-62	-50.1	-169.8	-157.7	0	113.6	N524 S525 P551 V552	N524-K527 WeakPolarHBondContact O-CD 3.22Å; N524-K527 WeakPolarHBondContact O-CE 3.33Å; N524-K527 PolarHBondContact O-NZ 2.86Å; S525-K527 PolarHBondContact O-N 2.99Å; K527-P551 HydrophobicContact CD-CG 4.37Å; K527-P551 WeakPolarHBondContact O-CG 3.43Å; K527-V552 WeakPolarHBondContact O-CG2 3.42Å
528	K	95.8	Very high	95.6	Very high	91 Å²	91	41.4 Å²	41.4	40%	0.396	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-4.5	179.8	-59.4	-170.2	-170.7	178.4	0	113.5	E504 L505 G506 W526 S530	E504-K528 IonicContact OE1-NZ 3.22Å; E504-K528 PolarHBondContact OE1-NZ 3.42Å; E504-K528 IonicContact OE2-NZ 3.81Å; E504-K528 PolarHBondContact OE2-NZ 2.82Å; L505-K528 CarbonylContact O-C 3.5Å; L505-K528 VanDerWaalsContact O-C 3.3Å; G506-K528 WeakPolarHBondContact CA-O 3.09Å; W526-K528 PolarHBondContact O-N 3.23Å; K528-S530 PolarHBondContact O-N 3.23Å; K528-S530 VanDerWaalsContact O-N 3.13Å
529	L	97.4	Very high	95.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.187	C	C	.	.			trans	-69	113.2	-173.1	-169.2	78.5	0	0	0	110.4	L505 L508 W526 L532 L550 V552 L553	L505-L529 HydrophobicContact CD2-CD1 4.15Å; L505-L529 HydrophobicContact CG-CD1 3.98Å; L505-L529 VanDerWaalsContact O-CA 3.29Å; L505-L529 WeakPolarHBondContact O-CA 3.19Å; L505-L529 PolarHBondContact O-N 2.95Å; L508-L529 HydrophobicContact CB-CD1 4.09Å; W526-L529 HydrophobicContact CB-CB 3.86Å; W526-L529 HydrophobicContact CB-CD2 4.32Å; W526-L529 HydrophobicContact CD2-CD2 3.93Å; W526-L529 HydrophobicContact CE3-CD2 3.41Å; W526-L529 VanDerWaalsContact CE3-CD2 3.41Å; W526-L529 HydrophobicContact CG-CB 4.47Å; W526-L529 HydrophobicContact CG-CD2 4.35Å; W526-L529 HydrophobicContact CZ3-CD2 3.96Å; W526-L529 PolarHBondContact O-N 2.84Å; L529-L532 HydrophobicContact CD2-CB 4.14Å; L529-L550 HydrophobicContact CD2-CD1 4.08Å; L529-V552 CarbonylContact O-C 3.59Å; L529-L553 HydrophobicContact CD2-CD1 4.43Å; L529-L553 HydrophobicContact CG-CD1 4.47Å; L529-L553 VanDerWaalsContact O-CA 3.29Å; L529-L553 WeakPolarHBondContact O-CA 3.29Å; L529-L553 PolarHBondContact O-N 2.7Å
530	S	95.7	Very high	95.7	Very high	26 Å²	26	37.8 Å²	37.8	18%	0.182	20%	0.2	C	C	.	.			trans	-103	-31.6	179.7	61	0	0	0	0	112.1	G506 K528 N554 Y555	G506-S530 PolarHBondContact O-N 2.96Å; G506-S530 PolarHBondContact O-OG 2.85Å; K528-S530 PolarHBondContact O-N 3.23Å; K528-S530 VanDerWaalsContact O-N 3.13Å; S530-N554 PolarHBondContact O-N 3.15Å; S530-N554 PolarHBondContact O-OD1 3.41Å; S530-Y555 PolarHBondContact O-N 3.42Å
531	E	96.7	Very high	95.8	Very high	31 Å²	31	37.5 Å²	37.5	15%	0.145	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	121.2	-177.1	-178.4	175.7	-177.6	0	0	111.2	G506 R507 L508 V509 Y555	G506-E531 PolarHBondContact O-N 3.04Å; R507-E531 HydrophobicContact CG-CB 4.36Å; R507-E531 IonicContact CZ-OE2 2.57Å; R507-E531 VanDerWaalsContact CZ-OE2 3.25Å; R507-E531 IonicContact NE-OE2 3.73Å; R507-E531 PolarHBondContact NE-OE2 3.39Å; R507-E531 IonicContact NH2-OE1 2.76Å; R507-E531 IonicContact NH2-OE2 3.25Å; R507-E531 PolarHBondContact NH2-OE2 3.17Å; L508-E531 PolarHBondContact N-O 2.82Å; V509-E531 HydrophobicContact CG2-CG 4.32Å; E531-Y555 HydrophobicContact CG-CD1 3.88Å; E531-Y555 HydrophobicContact CG-CG 3.94Å
532	L	98.3	Very high	96	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	108.6	171.7	-178.2	59.5	0	0	0	109.4	L508 W526 L529 L534 L547 L553 Y555 L556 D557	L508-L532 HydrophobicContact CB-CD1 3.98Å; L508-L532 HydrophobicContact CD2-CD1 3.71Å; L508-L532 HydrophobicContact CG-CD1 4.04Å; W526-L532 HydrophobicContact CZ3-CD2 4.43Å; L529-L532 HydrophobicContact CD2-CB 4.14Å; L532-L534 HydrophobicContact CD1-CD1 3.97Å; L532-L534 HydrophobicContact CD1-CD2 4.03Å; L532-L534 HydrophobicContact CD1-CG 3.78Å; L532-L534 HydrophobicContact CG-CD1 4.33Å; L532-L534 HydrophobicContact CG-CG 4.18Å; L532-L547 HydrophobicContact CD2-CD2 3.61Å; L532-L553 HydrophobicContact CB-CD1 4.02Å; L532-Y555 PolarHBondContact N-O 3.08Å; L532-L556 HydrophobicContact CB-CD1 4.12Å; L532-L556 HydrophobicContact CD2-CD1 3.85Å; L532-L556 HydrophobicContact CG-CD1 4.14Å; L532-L556 WeakPolarHBondContact O-CA 3.34Å; L532-D557 PolarHBondContact O-N 3.11Å
533	N	98.4	Very high	96.5	Very high	12 Å²	12	29.7 Å²	29.7	6%	0.064	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	102.9	179.2	-169.8	-13.9	0	0	0	110.4	L508 V509 L510 R511 A535 Y555	L508-N533 PolarHBondContact O-N 2.99Å; V509-N533 HydrophobicContact CG1-CB 4.23Å; L510-N533 PolarHBondContact N-O 3.46Å; R511-N533 PolarHBondContact N-O 3.43Å; N533-A535 WeakPolarHBondContact OD1-CB 3.48Å; N533-A535 PolarHBondContact OD1-N 2.77Å; N533-Y555 HydrophobicContact CB-CE1 4.08Å
534	L	98.6	Very high	96.6	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.021	17%	0.172	C	C	.	.			trans	-116.6	18.6	-179.5	-57.2	-178.3	0	0	0	111.6	L495 L510 L519 L532 N537 F539 D557 L558 N561	L495-L534 HydrophobicContact CD1-CD1 4.23Å; L510-L534 HydrophobicContact CB-CD2 3.91Å; L510-L534 HydrophobicContact CD1-CD2 4.03Å; L510-L534 HydrophobicContact CG-CD2 4.29Å; L519-L534 HydrophobicContact CD2-CD1 3.54Å; L532-L534 HydrophobicContact CD1-CD1 3.97Å; L532-L534 HydrophobicContact CD1-CD2 4.03Å; L532-L534 HydrophobicContact CD1-CG 3.78Å; L532-L534 HydrophobicContact CG-CD1 4.33Å; L532-L534 HydrophobicContact CG-CG 4.18Å; L534-N537 PolarHBondContact O-ND2 2.82Å; L534-F539 HydrophobicContact CB-CD2 4.18Å; L534-F539 HydrophobicContact CB-CE2 3.86Å; L534-F539 HydrophobicContact CD1-CE2 4.24Å; L534-F539 HydrophobicContact CD2-CE2 4.37Å; L534-F539 HydrophobicContact CG-CE2 4.39Å; L534-D557 PolarHBondContact N-O 3.05Å; L534-L558 HydrophobicContact CB-CD2 3.96Å; L534-L558 HydrophobicContact CD1-CD2 4.01Å; L534-L558 HydrophobicContact CG-CD2 4.24Å; L534-N561 PolarHBondContact O-ND2 2.78Å
535	A	98.5	Very high	96.9	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.165	C	C	.	.			trans	-61.7	159.8	-174.6	0	0	0	0	0	112.6	R511 N512 N533 N537 D557 S559	R511-A535 CarbonylContact C-O 3.53Å; R511-A535 WeakPolarHBondContact CA-O 3.43Å; R511-A535 HydrophobicContact CB-CB 4.49Å; R511-A535 HydrophobicContact CG-CB 3.99Å; N512-A535 PolarHBondContact N-O 3.27Å; N533-A535 WeakPolarHBondContact OD1-CB 3.48Å; N533-A535 PolarHBondContact OD1-N 2.77Å; A535-N537 PolarHBondContact O-N 3.03Å; A535-N537 PolarHBondContact O-ND2 2.84Å; A535-D557 HydrophobicContact CB-CB 4.44Å; A535-D557 WeakPolarHBondContact CB-OD1 3.49Å; A535-D557 PolarHBondContact N-O 2.95Å; A535-S559 CarbonylContact C-O 3.21Å; A535-S559 WeakPolarHBondContact CA-O 3.4Å
536	D	98.4	Very high	97	Very high	60 Å²	60	28.7 Å²	28.7	32%	0.321	16%	0.164	S	C	.	.	S	Bend	trans	53.9	58.7	174	-56.7	-46	0	0	0	112.4	R511 N512 N513 S559 G560	R511-D536 HydrophobicContact CG-CB 4.48Å; R511-D536 IonicContact CZ-OD2 2.83Å; R511-D536 IonicContact NE-OD2 2.77Å; R511-D536 PolarHBondContact NE-OD2 3.36Å; R511-D536 IonicContact NH2-OD2 3.79Å; R511-D536 PolarHBondContact NH2-OD2 3.46Å; N512-D536 VanDerWaalsContact CA-O 3.27Å; N512-D536 WeakPolarHBondContact CA-O 3.2Å; N512-D536 HydrophobicContact CB-CB 4.31Å; N512-D536 PolarHBondContact N-O 2.97Å; N513-D536 PolarHBondContact N-O 3.23Å; D536-S559 PolarHBondContact N-O 3.26Å; D536-G560 WeakPolarHBondContact CA-O 3.32Å
537	N	98.7	Very high	97	Very high	17 Å²	17	28.5 Å²	28.5	9%	0.091	16%	0.164	C	C	.	.	S	Bend	trans	-139.8	-169.7	-179.8	-87.1	-77.7	0	0	0	110.6	L510 N513 L515 L534 A535 F539 G560 N561	L510-N537 PolarHBondContact O-ND2 2.98Å; N513-N537 WeakPolarHBondContact CA-OD1 3.46Å; N513-N537 WeakPolarHBondContact CB-OD1 3.31Å; N513-N537 PolarHBondContact O-OD1 3.5Å; L515-N537 HydrophobicContact CB-CB 4.49Å; L515-N537 VanDerWaalsContact CB-OD1 3.25Å; L515-N537 WeakPolarHBondContact CB-OD1 3.43Å; L515-N537 PolarHBondContact N-OD1 3.35Å; L534-N537 PolarHBondContact O-ND2 2.82Å; A535-N537 PolarHBondContact O-N 3.03Å; A535-N537 PolarHBondContact O-ND2 2.84Å; N537-F539 HydrophobicContact CB-CD2 3.73Å; N537-F539 HydrophobicContact CB-CE2 3.79Å; N537-G560 PolarHBondContact N-O 3.05Å; N537-G560 VanDerWaalsContact N-O 3.11Å; N537-G560 VanDerWaalsContact O-O 3.1Å; N537-N561 WeakPolarHBondContact CA-OD1 3.47Å; N537-N561 WeakPolarHBondContact CB-OD1 3.5Å; N537-N561 PolarHBondContact O-OD1 3.2Å
538	G	97.8	Very high	97	Very high	17 Å²	17	23.5 Å²	23.5	18%	0.175	14%	0.143	C	C	.	.			trans	-110	25.7	178.5	0	0	0	0	0	114.7	L515 N561	L515-G538 CarbonylContact O-C 3.12Å; L515-G538 WeakPolarHBondContact O-CA 3.5Å; L515-G538 PolarHBondContact O-N 3.06Å; G538-N561 PolarHBondContact N-OD1 3.43Å
539	F	98.6	Very high	96.9	Very high	1 Å²	1	23.3 Å²	23.3	0%	0.004	15%	0.146	C	C	.	.			trans	-64.9	143.3	-178.8	-68.4	-65.8	0	0	0	112.3	L495 L515 S516 L519 L534 N537 N561 R562 L563	L495-F539 HydrophobicContact CD1-CE1 3.99Å; L495-F539 HydrophobicContact CD1-CZ 3.88Å; L495-F539 HydrophobicContact CD2-CZ 4.17Å; L495-F539 HydrophobicContact CG-CE1 3.79Å; L495-F539 HydrophobicContact CG-CZ 3.79Å; L515-F539 HydrophobicContact CB-CE1 4.09Å; L515-F539 HydrophobicContact CB-CE2 4Å; L515-F539 HydrophobicContact CB-CZ 3.52Å; L515-F539 HydrophobicContact CD1-CE2 4.44Å; L515-F539 HydrophobicContact CD1-CZ 4.04Å; L515-F539 HydrophobicContact CG-CZ 4.41Å; S516-F539 WeakPolarHBondContact O-CE1 3.41Å; L519-F539 HydrophobicContact CD2-CB 4.15Å; L519-F539 HydrophobicContact CD2-CD1 4.03Å; L519-F539 HydrophobicContact CD2-CD2 4.19Å; L519-F539 HydrophobicContact CD2-CG 3.85Å; L534-F539 HydrophobicContact CB-CD2 4.18Å; L534-F539 HydrophobicContact CB-CE2 3.86Å; L534-F539 HydrophobicContact CD1-CE2 4.24Å; L534-F539 HydrophobicContact CD2-CE2 4.37Å; L534-F539 HydrophobicContact CG-CE2 4.39Å; N537-F539 HydrophobicContact CB-CD2 3.73Å; N537-F539 HydrophobicContact CB-CE2 3.79Å; F539-N561 HydrophobicContact CB-CB 4.39Å; F539-N561 WeakPolarHBondContact CB-OD1 3.39Å; F539-N561 VanDerWaalsContact CD2-OD1 3.3Å; F539-N561 WeakPolarHBondContact CD2-OD1 3.12Å; F539-N561 PolarHBondContact N-OD1 3.17Å; F539-R562 CarbonylContact O-C 3.57Å; F539-R562 WeakPolarHBondContact O-CA 2.83Å; F539-R562 WeakPolarHBondContact O-CB 3.37Å; F539-R562 PolarHBondContact O-N 3.35Å; F539-L563 HydrophobicContact CB-CD2 4.07Å; F539-L563 PolarHBondContact O-N 3Å
540	T	98.1	Very high	96.8	Very high	54 Å²	54	23.4 Å²	23.4	33%	0.331	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	170.8	-175.4	57.6	0	0	0	0	111.3	G517 Q518 R562	G517-T540 PolarHBondContact O-N 3.1Å; G517-T540 PolarHBondContact O-OG1 3.42Å; Q518-T540 WeakPolarHBondContact CA-O 3.27Å; T540-R562 HydrophobicContact CG2-CB 4.03Å
541	G	97	Very high	96.6	Very high	14 Å²	14	26.4 Å²	26.4	14%	0.144	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80.9	-173	179.2	0	0	0	0	0	112.8	L563 T564	G541-L563 WeakPolarHBondContact O-CA 3.44Å; G541-T564 PolarHBondContact O-N 3.34Å
542	A	96.7	Very high	96.4	Very high	50 Å²	50	28.5 Å²	28.5	41%	0.413	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	149.4	-176.3	0	0	0	0	0	112.7	P544 T564	A542-P544 WeakPolarHBondContact O-CD 3.48Å; A542-T564 VanDerWaalsContact CA-O 3.3Å; A542-T564 WeakPolarHBondContact CA-O 3.43Å
543	I	97.3	Very high	96.3	Very high	7 Å²	7	28.5 Å²	28.5	4%	0.036	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-64.7	122.6	166.9	-59.8	173.4	0	0	0	107.8	A545 L547 L558 L563 P568 L571 V581 L586	I543-A545 PolarHBondContact O-N 3.21Å; I543-L547 HydrophobicContact CG2-CD1 3.78Å; I543-L558 HydrophobicContact CD1-CD1 4.25Å; I543-L558 HydrophobicContact CG1-CD1 4.21Å; I543-L558 HydrophobicContact CG2-CD1 4.19Å; I543-L563 HydrophobicContact CG1-CD1 4.1Å; I543-P568 HydrophobicContact CB-CG 4.02Å; I543-P568 HydrophobicContact CG2-CG 4.01Å; I543-P568 WeakPolarHBondContact O-CG 3.29Å; I543-L571 HydrophobicContact CG2-CD1 4.4Å; I543-V581 HydrophobicContact CD1-CG1 4.21Å; I543-L586 HydrophobicContact CD1-CD1 4.09Å; I543-L586 HydrophobicContact CD1-CD2 3.83Å; I543-L586 HydrophobicContact CG1-CD2 4.25Å
544	P	96.2	Very high	96	Very high	11 Å²	11	30.8 Å²	30.8	7%	0.071	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-63.3	134	178.6	-21.2	32.3	0	0	0	111.5	L519 A542 E546 L547	L519-P544 HydrophobicContact CB-CG 3.82Å; A542-P544 WeakPolarHBondContact O-CD 3.48Å; P544-E546 VanDerWaalsContact CB-OE2 3.22Å; P544-E546 WeakPolarHBondContact CB-OE2 3.34Å; P544-E546 PolarHBondContact O-N 3.46Å; P544-L547 PolarHBondContact O-N 2.75Å
545	A	95	Very high	95.9	Very high	33 Å²	33	33.6 Å²	33.6	27%	0.273	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-66.5	-27.5	178.6	0	0	0	0	0	112	I543 L547 G548 P568 Q570	I543-A545 PolarHBondContact O-N 3.21Å; A545-L547 PolarHBondContact O-N 2.89Å; A545-L547 VanDerWaalsContact O-N 3.13Å; A545-G548 PolarHBondContact O-N 3.01Å; A545-P568 HydrophobicContact CB-CB 4.16Å; A545-Q570 HydrophobicContact CB-CB 4.4Å; A545-Q570 HydrophobicContact CB-CG 4.07Å; A545-Q570 VanDerWaalsContact O-CB 3.29Å; A545-Q570 WeakPolarHBondContact O-CB 3.4Å
546	E	94.7	Very high	95.9	Very high	56 Å²	56	33.7 Å²	33.7	26%	0.262	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-60.6	-19.8	179.2	-58.1	92.3	148.2	0	0	113	I523 P544 G548 D549	I523-E546 HydrophobicContact CG1-CB 4.14Å; P544-E546 VanDerWaalsContact CB-OE2 3.22Å; P544-E546 WeakPolarHBondContact CB-OE2 3.34Å; P544-E546 PolarHBondContact O-N 3.46Å; E546-G548 PolarHBondContact O-N 3.13Å; E546-D549 PolarHBondContact O-N 3.18Å
547	L	95.6	Very high	95.9	Very high	3 Å²	3	31.7 Å²	31.7	2%	0.016	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-58.9	-34.4	171.8	-77	171.5	0	0	0	111.7	I523 L532 I543 P544 A545 D549 L550 L553 L558 L571 L574	I523-L547 HydrophobicContact CD1-CD2 3.48Å; I523-L547 VanDerWaalsContact CD1-CD2 3.48Å; I523-L547 HydrophobicContact CD1-CG 3.86Å; L532-L547 HydrophobicContact CD2-CD2 3.61Å; I543-L547 HydrophobicContact CG2-CD1 3.78Å; P544-L547 PolarHBondContact O-N 2.75Å; A545-L547 PolarHBondContact O-N 2.89Å; A545-L547 VanDerWaalsContact O-N 3.13Å; L547-D549 PolarHBondContact O-N 2.73Å; L547-L550 HydrophobicContact CD2-CD1 4.03Å; L547-L550 PolarHBondContact O-N 3.21Å; L547-L553 HydrophobicContact CD2-CD2 4.44Å; L547-L558 HydrophobicContact CD1-CD1 4.48Å; L547-L571 HydrophobicContact CB-CD2 3.76Å; L547-L574 WeakPolarHBondContact O-CD1 3.43Å
548	G	93.7	Very high	95.9	Very high	3 Å²	3	30.9 Å²	30.9	3%	0.031	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-68.2	-15.7	176.6	0	0	0	0	0	114.4	A545 E546 Q570 N573	A545-G548 PolarHBondContact O-N 3.01Å; E546-G548 PolarHBondContact O-N 3.13Å; G548-Q570 VanDerWaalsContact CA-O 3.24Å; G548-Q570 WeakPolarHBondContact CA-O 3.06Å; G548-N573 VanDerWaalsContact O-CB 3.3Å; G548-N573 WeakPolarHBondContact O-CB 3.2Å
549	D	93.2	Very high	95.9	Very high	86 Å²	86	30.5 Å²	30.5	46%	0.46	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-93.9	0.7	-179.3	-60.7	-37.4	0	0	0	112.7	E546 L547	E546-D549 PolarHBondContact O-N 3.18Å; L547-D549 PolarHBondContact O-N 2.73Å
550	L	95	Very high	95.8	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.016	19%	0.193	C	C	.	.			trans	-77.4	118.5	178.2	-61	-175.7	0	0	0	110.2	I523 W526 L529 L547 V552 L553 L574	I523-L550 HydrophobicContact CD1-CD1 4.35Å; W526-L550 HydrophobicContact CB-CD1 4.5Å; W526-L550 HydrophobicContact CB-CD2 3.93Å; W526-L550 HydrophobicContact CE3-CD1 4.31Å; L529-L550 HydrophobicContact CD2-CD1 4.08Å; L547-L550 HydrophobicContact CD2-CD1 4.03Å; L547-L550 PolarHBondContact O-N 3.21Å; L550-V552 VanDerWaalsContact C-N 3.31Å; L550-V552 PolarHBondContact O-N 2.97Å; L550-L553 HydrophobicContact CB-CB 3.89Å; L550-L553 HydrophobicContact CD1-CB 4.47Å; L550-L553 HydrophobicContact CD1-CD2 4.07Å; L550-L574 WeakPolarHBondContact O-CD2 3.38Å
551	P	91.1	Very high	95.8	Very high	89 Å²	89	29.4 Å²	29.4	58%	0.578	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-21.6	-163.1	28.1	-36.6	0	0	0	114.6	K527	K527-P551 HydrophobicContact CD-CG 4.37Å; K527-P551 WeakPolarHBondContact O-CG 3.43Å
552	V	93.5	Very high	95.9	Very high	74 Å²	74	36.2 Å²	36.2	45%	0.448	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.8	6.9	-172.7	-59.2	0	0	0	0	113.8	K527 L529 L550 N554	K527-V552 WeakPolarHBondContact O-CG2 3.42Å; L529-V552 CarbonylContact O-C 3.59Å; L550-V552 VanDerWaalsContact C-N 3.31Å; L550-V552 PolarHBondContact O-N 2.97Å; V552-N554 PolarHBondContact O-N 3.33Å
553	L	96	Very high	95.9	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	18%	0.182	C	C	.	.			trans	-65.3	120.6	179.3	-176.8	68.1	0	0	0	109.6	L529 L532 L547 L550 Y555 L556 L574 L576	L529-L553 HydrophobicContact CD2-CD1 4.43Å; L529-L553 HydrophobicContact CG-CD1 4.47Å; L529-L553 VanDerWaalsContact O-CA 3.29Å; L529-L553 WeakPolarHBondContact O-CA 3.29Å; L529-L553 PolarHBondContact O-N 2.7Å; L532-L553 HydrophobicContact CB-CD1 4.02Å; L547-L553 HydrophobicContact CD2-CD2 4.44Å; L550-L553 HydrophobicContact CB-CB 3.89Å; L550-L553 HydrophobicContact CD1-CB 4.47Å; L550-L553 HydrophobicContact CD1-CD2 4.07Å; L553-Y555 WeakPolarHBondContact CD1-O 3.39Å; L553-L556 HydrophobicContact CD2-CB 4.44Å; L553-L556 HydrophobicContact CD2-CD1 4.47Å; L553-L556 HydrophobicContact CD2-CD2 4.47Å; L553-L574 HydrophobicContact CB-CD1 4.48Å; L553-L574 HydrophobicContact CB-CD2 4.21Å; L553-L574 HydrophobicContact CD2-CD1 3.82Å; L553-L574 HydrophobicContact CG-CD1 4.41Å; L553-L576 HydrophobicContact CG-CD2 4.22Å
554	N	92.4	Very high	95.9	Very high	61 Å²	61	36 Å²	36	33%	0.326	20%	0.196	S	C	.	.			trans	-127.3	-17.7	-176.9	69.7	21.5	0	0	0	113.4	S530 V552 L576 N577 Q578	S530-N554 PolarHBondContact O-N 3.15Å; S530-N554 PolarHBondContact O-OD1 3.41Å; V552-N554 PolarHBondContact O-N 3.33Å; N554-L576 CarbonylContact O-C 3.21Å; N554-L576 WeakPolarHBondContact O-CA 3.49Å; N554-N577 PolarHBondContact O-N 3.38Å; N554-Q578 PolarHBondContact O-N 3.1Å
555	Y	96.9	Very high	95.8	Very high	63 Å²	63	36.9 Å²	36.9	25%	0.247	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	114.9	176.5	-172.4	-62	0	0	0	108.6	S530 E531 L532 N533 L553 D557 Q578	S530-Y555 PolarHBondContact O-N 3.42Å; E531-Y555 HydrophobicContact CG-CD1 3.88Å; E531-Y555 HydrophobicContact CG-CG 3.94Å; L532-Y555 PolarHBondContact N-O 3.08Å; N533-Y555 HydrophobicContact CB-CE1 4.08Å; L553-Y555 WeakPolarHBondContact CD1-O 3.39Å; Y555-D557 HydrophobicContact CE1-CB 3.74Å; Y555-Q578 WeakPolarHBondContact CA-O 3.43Å; Y555-Q578 HydrophobicContact CD1-CB 4.41Å; Y555-Q578 HydrophobicContact CD2-CB 3.44Å; Y555-Q578 VanDerWaalsContact CD2-CB 3.44Å; Y555-Q578 HydrophobicContact CD2-CG 3.59Å; Y555-Q578 HydrophobicContact CE2-CB 3.64Å; Y555-Q578 HydrophobicContact CE2-CG 3.61Å; Y555-Q578 HydrophobicContact CG-CB 3.83Å; Y555-Q578 HydrophobicContact CG-CG 4.46Å
556	L	97.8	Very high	95.7	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	108.9	178.4	178.5	60.8	0	0	0	110.3	L532 L553 L558 L571 L576 Q578 F579 N580	L532-L556 HydrophobicContact CB-CD1 4.12Å; L532-L556 HydrophobicContact CD2-CD1 3.85Å; L532-L556 HydrophobicContact CG-CD1 4.14Å; L532-L556 WeakPolarHBondContact O-CA 3.34Å; L553-L556 HydrophobicContact CD2-CB 4.44Å; L553-L556 HydrophobicContact CD2-CD1 4.47Å; L553-L556 HydrophobicContact CD2-CD2 4.47Å; L556-L558 HydrophobicContact CD1-CD1 4.1Å; L556-L558 HydrophobicContact CD1-CD2 3.97Å; L556-L558 HydrophobicContact CD1-CG 3.82Å; L556-L558 HydrophobicContact CG-CD1 4.5Å; L556-L558 HydrophobicContact CG-CG 4.3Å; L556-L571 HydrophobicContact CD2-CD2 4.22Å; L556-L576 HydrophobicContact CB-CD1 4.13Å; L556-L576 HydrophobicContact CB-CD2 4Å; L556-L576 HydrophobicContact CD2-CD1 4.25Å; L556-Q578 PolarHBondContact N-O 3.03Å; L556-F579 HydrophobicContact CB-CD2 4.25Å; L556-F579 HydrophobicContact CD2-CD2 4.03Å; L556-F579 HydrophobicContact CD2-CE2 3.9Å; L556-F579 HydrophobicContact CG-CD2 4.23Å; L556-F579 HydrophobicContact CG-CE2 4.42Å; L556-F579 CarbonylContact O-C 3.1Å; L556-F579 VanDerWaalsContact O-CA 3.28Å; L556-F579 WeakPolarHBondContact O-CA 3.15Å; L556-N580 PolarHBondContact O-N 3.15Å
557	D	98.1	Very high	95.7	Very high	18 Å²	18	39 Å²	39	10%	0.096	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	113.6	174.1	-163.9	-16.2	0	0	0	110.6	L532 L534 A535 Y555 S559 N580	L532-D557 PolarHBondContact O-N 3.11Å; L534-D557 PolarHBondContact N-O 3.05Å; A535-D557 HydrophobicContact CB-CB 4.44Å; A535-D557 WeakPolarHBondContact CB-OD1 3.49Å; A535-D557 PolarHBondContact N-O 2.95Å; Y555-D557 HydrophobicContact CE1-CB 3.74Å; D557-S559 VanDerWaalsContact OD1-CB 3.24Å; D557-S559 WeakPolarHBondContact OD1-CB 3.41Å; D557-S559 PolarHBondContact OD1-N 3.48Å; D557-S559 PolarHBondContact OD1-OG 3.04Å; D557-N580 HydrophobicContact CB-CB 4.49Å
558	L	98.3	Very high	95.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.			trans	-119.9	15	177.4	-55	178.6	0	0	0	111.1	L519 L534 I543 L547 L556 N561 L563 N580 V581 N584	L519-L558 HydrophobicContact CD1-CD1 4.13Å; L519-L558 HydrophobicContact CD1-CD2 4.46Å; L534-L558 HydrophobicContact CB-CD2 3.96Å; L534-L558 HydrophobicContact CD1-CD2 4.01Å; L534-L558 HydrophobicContact CG-CD2 4.24Å; I543-L558 HydrophobicContact CD1-CD1 4.25Å; I543-L558 HydrophobicContact CG1-CD1 4.21Å; I543-L558 HydrophobicContact CG2-CD1 4.19Å; L547-L558 HydrophobicContact CD1-CD1 4.48Å; L556-L558 HydrophobicContact CD1-CD1 4.1Å; L556-L558 HydrophobicContact CD1-CD2 3.97Å; L556-L558 HydrophobicContact CD1-CG 3.82Å; L556-L558 HydrophobicContact CG-CD1 4.5Å; L556-L558 HydrophobicContact CG-CG 4.3Å; L558-N561 PolarHBondContact O-ND2 3.35Å; L558-N561 VanDerWaalsContact O-ND2 3.13Å; L558-L563 HydrophobicContact CB-CD1 3.81Å; L558-L563 HydrophobicContact CD1-CD1 4.18Å; L558-N580 PolarHBondContact N-O 2.93Å; L558-V581 HydrophobicContact CB-CG1 4.32Å; L558-N584 PolarHBondContact O-ND2 3.1Å
559	S	98.1	Very high	95.5	Very high	10 Å²	10	44.1 Å²	44.1	7%	0.07	24%	0.236	C	C	.	.			trans	-66.1	158.9	-174.8	62.6	0	0	0	0	113	A535 D536 D557 N561 N580 S582	A535-S559 CarbonylContact C-O 3.21Å; A535-S559 WeakPolarHBondContact CA-O 3.4Å; D536-S559 PolarHBondContact N-O 3.26Å; D557-S559 VanDerWaalsContact OD1-CB 3.24Å; D557-S559 WeakPolarHBondContact OD1-CB 3.41Å; D557-S559 PolarHBondContact OD1-N 3.48Å; D557-S559 PolarHBondContact OD1-OG 3.04Å; S559-N561 PolarHBondContact O-N 3.46Å; S559-N561 PolarHBondContact O-ND2 3.27Å; S559-N561 VanDerWaalsContact O-ND2 3.15Å; S559-N580 PolarHBondContact N-O 3.43Å; S559-N580 PolarHBondContact OG-ND2 2.88Å; S559-S582 CarbonylContact C-O 3.53Å; S559-S582 WeakPolarHBondContact CA-O 3.3Å; S559-S582 VanDerWaalsContact CB-O 3.3Å; S559-S582 WeakPolarHBondContact CB-O 3.26Å; S559-S582 WeakPolarHBondContact CB-OG 3.5Å
560	G	97.8	Very high	95.6	Very high	20 Å²	20	43.8 Å²	43.8	21%	0.206	23%	0.232	C	C	.	.	S	Bend	trans	64.3	43.1	176.2	0	0	0	0	0	113.3	D536 N537 S582 N583	D536-G560 WeakPolarHBondContact CA-O 3.32Å; N537-G560 PolarHBondContact N-O 3.05Å; N537-G560 VanDerWaalsContact N-O 3.11Å; N537-G560 VanDerWaalsContact O-O 3.1Å; G560-S582 PolarHBondContact N-O 3.29Å; G560-N583 WeakPolarHBondContact CA-O 3.45Å; G560-N583 PolarHBondContact N-O 2.98Å
561	N	98.3	Very high	95.5	Very high	12 Å²	12	43.7 Å²	43.7	6%	0.064	23%	0.231	C	C	.	.	S	Bend	trans	-126.3	-169.2	177.9	-83.2	-76.3	0	0	0	110.6	L534 N537 G538 F539 L558 S559 L563 N583 N584	L534-N561 PolarHBondContact O-ND2 2.78Å; N537-N561 WeakPolarHBondContact CA-OD1 3.47Å; N537-N561 WeakPolarHBondContact CB-OD1 3.5Å; N537-N561 PolarHBondContact O-OD1 3.2Å; G538-N561 PolarHBondContact N-OD1 3.43Å; F539-N561 HydrophobicContact CB-CB 4.39Å; F539-N561 WeakPolarHBondContact CB-OD1 3.39Å; F539-N561 VanDerWaalsContact CD2-OD1 3.3Å; F539-N561 WeakPolarHBondContact CD2-OD1 3.12Å; F539-N561 PolarHBondContact N-OD1 3.17Å; L558-N561 PolarHBondContact O-ND2 3.35Å; L558-N561 VanDerWaalsContact O-ND2 3.13Å; S559-N561 PolarHBondContact O-N 3.46Å; S559-N561 PolarHBondContact O-ND2 3.27Å; S559-N561 VanDerWaalsContact O-ND2 3.15Å; N561-L563 HydrophobicContact CB-CD1 4.28Å; N561-L563 HydrophobicContact CB-CG 4.05Å; N561-N583 PolarHBondContact N-O 2.84Å; N561-N583 VanDerWaalsContact N-O 3.16Å; N561-N583 VanDerWaalsContact O-O 3.11Å; N561-N584 VanDerWaalsContact CA-OD1 3.3Å; N561-N584 WeakPolarHBondContact CA-OD1 3.35Å; N561-N584 WeakPolarHBondContact CB-OD1 3.26Å; N561-N584 PolarHBondContact N-OD1 2.77Å; N561-N584 PolarHBondContact O-OD1 3.08Å
562	R	97.3	Very high	95.4	Very high	157 Å²	157	41.1 Å²	41.1	59%	0.592	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	33.9	176.5	-56	178.8	-173.5	178.1	2.9	111.3	F539 T540 N584	F539-R562 CarbonylContact O-C 3.57Å; F539-R562 WeakPolarHBondContact O-CA 2.83Å; F539-R562 WeakPolarHBondContact O-CB 3.37Å; F539-R562 PolarHBondContact O-N 3.35Å; T540-R562 HydrophobicContact CG2-CB 4.03Å; R562-N584 PolarHBondContact N-OD1 2.86Å
563	L	98	Very high	95.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	140.1	-178.6	-61.8	167.6	0	0	0	110.5	L519 F539 G541 I543 L558 N561 N584 Q585 L586	L519-L563 HydrophobicContact CD1-CD1 4.23Å; L519-L563 HydrophobicContact CD1-CD2 3.74Å; L519-L563 HydrophobicContact CG-CD2 3.93Å; F539-L563 HydrophobicContact CB-CD2 4.07Å; F539-L563 PolarHBondContact O-N 3Å; G541-L563 WeakPolarHBondContact O-CA 3.44Å; I543-L563 HydrophobicContact CG1-CD1 4.1Å; L558-L563 HydrophobicContact CB-CD1 3.81Å; L558-L563 HydrophobicContact CD1-CD1 4.18Å; N561-L563 HydrophobicContact CB-CD1 4.28Å; N561-L563 HydrophobicContact CB-CG 4.05Å; L563-N584 HydrophobicContact CB-CB 4.35Å; L563-N584 VanDerWaalsContact CB-OD1 3.28Å; L563-N584 WeakPolarHBondContact CB-OD1 3.46Å; L563-N584 WeakPolarHBondContact CG-OD1 3.4Å; L563-N584 PolarHBondContact N-OD1 2.86Å; L563-Q585 CarbonylContact O-C 3.58Å; L563-Q585 WeakPolarHBondContact O-CA 3.4Å; L563-Q585 WeakPolarHBondContact O-CB 3.19Å; L563-Q585 PolarHBondContact O-N 3.28Å; L563-L586 HydrophobicContact CB-CD2 4.17Å; L563-L586 PolarHBondContact O-N 3.16Å
564	T	96.5	Very high	95	Very high	53 Å²	53	43.3 Å²	43.3	33%	0.325	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	175.4	-176.2	56.5	0	0	0	0	111.1	G541 A542 Q585	G541-T564 PolarHBondContact O-N 3.34Å; A542-T564 VanDerWaalsContact CA-O 3.3Å; A542-T564 WeakPolarHBondContact CA-O 3.43Å; T564-Q585 HydrophobicContact CG2-CB 3.87Å
565	G	94.7	Very high	94.7	Very high	28 Å²	28	49.5 Å²	49.5	29%	0.289	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	82.2	-165.7	178.9	0	0	0	0	0	113.1	S587	G565-S587 PolarHBondContact O-N 3.3Å; G565-S587 PolarHBondContact O-OG 3.45Å
566	E	93.5	Very high	94.2	Very high	131 Å²	131	47.1 Å²	47.1	61%	0.612	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-88.4	154.2	-178.1	-58.8	-173.1	162.3	0	0	111.9	P568 S587	E566-P568 WeakPolarHBondContact O-CD 3.32Å; E566-S587 VanDerWaalsContact CA-O 3.29Å; E566-S587 WeakPolarHBondContact CA-O 3.46Å
567	V	93.7	Very high	93.7	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.024	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-73.5	116.9	168.2	-179.9	0	0	0	0	107.5	M569 L571 L586 L590 P591 F603	V567-M569 PolarHBondContact O-N 3Å; V567-L571 HydrophobicContact CG1-CD1 3.95Å; V567-L586 HydrophobicContact CG2-CD1 4.01Å; V567-L590 HydrophobicContact CG2-CD2 4.45Å; V567-P591 HydrophobicContact CB-CG 4.35Å; V567-P591 HydrophobicContact CG1-CG 3.97Å; V567-F603 HydrophobicContact CG1-CE1 4.47Å; V567-F603 HydrophobicContact CG2-CE1 4.1Å
568	P	94.3	Very high	93.3	Very high	15 Å²	15	57.7 Å²	57.7	10%	0.097	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-62.1	133.6	-173.7	-22.6	32.5	0	0	0	112.5	I543 A545 E566 Q570 L571	I543-P568 HydrophobicContact CB-CG 4.02Å; I543-P568 HydrophobicContact CG2-CG 4.01Å; I543-P568 WeakPolarHBondContact O-CG 3.29Å; A545-P568 HydrophobicContact CB-CB 4.16Å; E566-P568 WeakPolarHBondContact O-CD 3.32Å; P568-Q570 PolarHBondContact O-N 3.4Å; P568-L571 HydrophobicContact CB-CG 4.46Å; P568-L571 WeakPolarHBondContact O-CB 3.5Å; P568-L571 PolarHBondContact O-N 3.41Å; P568-L571 VanDerWaalsContact O-N 3.13Å
569	M	91.9	Very high	93.1	Very high	98 Å²	98	58 Å²	58	48%	0.483	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-59.4	-26.8	175.3	-69.4	-68.4	-58.1	0	0	112.5	V567 L571 E572 P591 P592	V567-M569 PolarHBondContact O-N 3Å; M569-L571 PolarHBondContact O-N 3.3Å; M569-E572 VanDerWaalsContact O-CB 3.24Å; M569-E572 WeakPolarHBondContact O-CB 3.33Å; M569-E572 WeakPolarHBondContact O-CG 3.48Å; M569-E572 PolarHBondContact O-N 3.2Å; M569-E572 VanDerWaalsContact O-N 3.07Å; M569-P591 HydrophobicContact CE-CB 4.4Å; M569-P591 HydrophobicContact SD-CB 3.72Å; M569-P591 HydrophobicContact SD-CG 4.05Å; M569-P592 HydrophobicContact CE-CG 4.4Å
570	Q	93.9	Very high	93	Very high	79 Å²	79	59.4 Å²	59.4	37%	0.369	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-60.6	-25.4	178.2	-68.5	75.2	10.2	0	0	112.6	A545 G548 P568 E572 N573	A545-Q570 HydrophobicContact CB-CB 4.4Å; A545-Q570 HydrophobicContact CB-CG 4.07Å; A545-Q570 VanDerWaalsContact O-CB 3.29Å; A545-Q570 WeakPolarHBondContact O-CB 3.4Å; G548-Q570 VanDerWaalsContact CA-O 3.24Å; G548-Q570 WeakPolarHBondContact CA-O 3.06Å; P568-Q570 PolarHBondContact O-N 3.4Å; Q570-E572 PolarHBondContact O-N 3.43Å; Q570-E572 VanDerWaalsContact O-N 3.12Å; Q570-N573 VanDerWaalsContact O-CB 3.28Å; Q570-N573 WeakPolarHBondContact O-CB 3.04Å; Q570-N573 PolarHBondContact O-N 2.84Å; Q570-N573 PolarHBondContact O-ND2 2.93Å
571	L	92.5	Very high	92.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-62.7	-16.9	176	-63.5	-178	0	0	0	112.8	I543 L547 L556 V567 P568 M569 N573 L574 F579 Y594	I543-L571 HydrophobicContact CG2-CD1 4.4Å; L547-L571 HydrophobicContact CB-CD2 3.76Å; L556-L571 HydrophobicContact CD2-CD2 4.22Å; V567-L571 HydrophobicContact CG1-CD1 3.95Å; P568-L571 HydrophobicContact CB-CG 4.46Å; P568-L571 WeakPolarHBondContact O-CB 3.5Å; P568-L571 PolarHBondContact O-N 3.41Å; P568-L571 VanDerWaalsContact O-N 3.13Å; M569-L571 PolarHBondContact O-N 3.3Å; L571-N573 PolarHBondContact O-N 2.99Å; L571-L574 HydrophobicContact CD2-CD1 4.02Å; L571-L574 PolarHBondContact O-N 3.5Å; L571-F579 HydrophobicContact CD1-CE2 4.24Å; L571-F579 HydrophobicContact CD1-CZ 4.28Å; L571-Y594 HydrophobicContact CB-CE2 4Å; L571-Y594 PolarHBondContact O-OH 2.87Å
572	E	89.9	Confident	92.8	Very high	36 Å²	36	58.4 Å²	58.4	17%	0.168	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-66.9	-17.4	172.2	-68.3	-161	156.6	0	0	114.1	M569 Q570 L574 P591 P592 Q593 Y594	M569-E572 VanDerWaalsContact O-CB 3.24Å; M569-E572 WeakPolarHBondContact O-CB 3.33Å; M569-E572 WeakPolarHBondContact O-CG 3.48Å; M569-E572 PolarHBondContact O-N 3.2Å; M569-E572 VanDerWaalsContact O-N 3.07Å; Q570-E572 PolarHBondContact O-N 3.43Å; Q570-E572 VanDerWaalsContact O-N 3.12Å; E572-L574 PolarHBondContact O-N 3.4Å; E572-P591 HydrophobicContact CG-CB 3.66Å; E572-P591 VanDerWaalsContact OE1-C 3.22Å; E572-P591 WeakPolarHBondContact OE1-CB 2.78Å; E572-P592 WeakPolarHBondContact OE1-CD 3.41Å; E572-Q593 HydrophobicContact CB-CG 4.34Å; E572-Q593 HydrophobicContact CG-CB 4.1Å; E572-Q593 HydrophobicContact CG-CG 4.09Å; E572-Q593 PolarHBondContact O-NE2 3.21Å; E572-Q593 VanDerWaalsContact O-NE2 3.16Å; E572-Q593 PolarHBondContact O-OE1 2.7Å; E572-Q593 PolarHBondContact OE1-N 3.33Å; E572-Y594 HydrophobicContact CG-CE2 4.37Å
573	N	90	Very high	92.7	Very high	113 Å²	113	55.6 Å²	55.6	60%	0.604	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-71.9	-18.4	175.3	-65.5	-19.9	0	0	0	111.9	G548 Q570 L571	G548-N573 VanDerWaalsContact O-CB 3.3Å; G548-N573 WeakPolarHBondContact O-CB 3.2Å; Q570-N573 VanDerWaalsContact O-CB 3.28Å; Q570-N573 WeakPolarHBondContact O-CB 3.04Å; Q570-N573 PolarHBondContact O-N 2.84Å; Q570-N573 PolarHBondContact O-ND2 2.93Å; L571-N573 PolarHBondContact O-N 2.99Å
574	L	90.5	Very high	92.7	Very high	10 Å²	10	55.9 Å²	55.9	5%	0.052	29%	0.286	C	S	.	.	S	Bend	trans	-90	146.9	-175.9	-56.7	176.2	0	0	0	111.5	L547 L550 L553 L571 E572 L576	L547-L574 WeakPolarHBondContact O-CD1 3.43Å; L550-L574 WeakPolarHBondContact O-CD2 3.38Å; L553-L574 HydrophobicContact CB-CD1 4.48Å; L553-L574 HydrophobicContact CB-CD2 4.21Å; L553-L574 HydrophobicContact CD2-CD1 3.82Å; L553-L574 HydrophobicContact CG-CD1 4.41Å; L571-L574 HydrophobicContact CD2-CD1 4.02Å; L571-L574 PolarHBondContact O-N 3.5Å; E572-L574 PolarHBondContact O-N 3.4Å; L574-L576 HydrophobicContact CB-CD1 4.46Å; L574-L576 HydrophobicContact CB-CD2 4.13Å; L574-L576 HydrophobicContact CB-CG 3.88Å; L574-L576 HydrophobicContact CD1-CD1 4.35Å; L574-L576 HydrophobicContact CD1-CD2 4.12Å; L574-L576 HydrophobicContact CD1-CG 4.37Å
575	K	86	Confident	92.6	Very high	192 Å²	192	58.8 Å²	58.8	84%	0.835	30%	0.296	S	S	*	.			trans	-103.4	78.1	170.2	-65.9	-173.5	-179.7	-178.5	0	109.5
576	L	87.7	Confident	92.6	Very high	12 Å²	12	57.4 Å²	57.4	6%	0.063	28%	0.282	C	S	.	.			trans	-79.5	122	-176	-62.1	174.4	0	0	0	111.4	L553 N554 L556 L574 F579	L553-L576 HydrophobicContact CG-CD2 4.22Å; N554-L576 CarbonylContact O-C 3.21Å; N554-L576 WeakPolarHBondContact O-CA 3.49Å; L556-L576 HydrophobicContact CB-CD1 4.13Å; L556-L576 HydrophobicContact CB-CD2 4Å; L556-L576 HydrophobicContact CD2-CD1 4.25Å; L574-L576 HydrophobicContact CB-CD1 4.46Å; L574-L576 HydrophobicContact CB-CD2 4.13Å; L574-L576 HydrophobicContact CB-CG 3.88Å; L574-L576 HydrophobicContact CD1-CD1 4.35Å; L574-L576 HydrophobicContact CD1-CD2 4.12Å; L574-L576 HydrophobicContact CD1-CG 4.37Å; L576-F579 HydrophobicContact CB-CB 4.03Å; L576-F579 HydrophobicContact CD1-CB 3.75Å; L576-F579 HydrophobicContact CD1-CD2 3.46Å; L576-F579 VanDerWaalsContact CD1-CD2 3.46Å; L576-F579 HydrophobicContact CD1-CE2 4.23Å; L576-F579 HydrophobicContact CD1-CG 3.72Å
577	N	87.6	Confident	92.6	Very high	132 Å²	132	53.5 Å²	53.5	71%	0.706	27%	0.269	S	S	*	.	S	Bend	trans	-75.3	-36.1	167.2	-70.8	-18.1	0	0	0	110.9	N554	N554-N577 PolarHBondContact O-N 3.38Å
578	Q	88.8	Confident	92.4	Very high	109 Å²	109	54.1 Å²	54.1	51%	0.509	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	122.8	176.2	-68.4	-64.6	-10.5	0	0	108.8	N554 Y555 L556	N554-Q578 PolarHBondContact O-N 3.1Å; Y555-Q578 WeakPolarHBondContact CA-O 3.43Å; Y555-Q578 HydrophobicContact CD1-CB 4.41Å; Y555-Q578 HydrophobicContact CD2-CB 3.44Å; Y555-Q578 VanDerWaalsContact CD2-CB 3.44Å; Y555-Q578 HydrophobicContact CD2-CG 3.59Å; Y555-Q578 HydrophobicContact CE2-CB 3.64Å; Y555-Q578 HydrophobicContact CE2-CG 3.61Å; Y555-Q578 HydrophobicContact CG-CB 3.83Å; Y555-Q578 HydrophobicContact CG-CG 4.46Å; L556-Q578 PolarHBondContact N-O 3.03Å
579	F	94.3	Very high	92	Very high	6 Å²	6	56.3 Å²	56.3	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	122.3	177.7	178.3	-124.7	0	0	0	109.3	L556 L571 L576 V581 Y594 Y599 S602 F603	L556-F579 HydrophobicContact CB-CD2 4.25Å; L556-F579 HydrophobicContact CD2-CD2 4.03Å; L556-F579 HydrophobicContact CD2-CE2 3.9Å; L556-F579 HydrophobicContact CG-CD2 4.23Å; L556-F579 HydrophobicContact CG-CE2 4.42Å; L556-F579 CarbonylContact O-C 3.1Å; L556-F579 VanDerWaalsContact O-CA 3.28Å; L556-F579 WeakPolarHBondContact O-CA 3.15Å; L571-F579 HydrophobicContact CD1-CE2 4.24Å; L571-F579 HydrophobicContact CD1-CZ 4.28Å; L576-F579 HydrophobicContact CB-CB 4.03Å; L576-F579 HydrophobicContact CD1-CB 3.75Å; L576-F579 HydrophobicContact CD1-CD2 3.46Å; L576-F579 VanDerWaalsContact CD1-CD2 3.46Å; L576-F579 HydrophobicContact CD1-CE2 4.23Å; L576-F579 HydrophobicContact CD1-CG 3.72Å; F579-V581 HydrophobicContact CD2-CG1 4.44Å; F579-V581 HydrophobicContact CE1-CG2 4.43Å; F579-V581 HydrophobicContact CE2-CG1 3.54Å; F579-V581 HydrophobicContact CZ-CG1 3.66Å; F579-V581 HydrophobicContact CZ-CG2 4.06Å; F579-Y594 AromaticContact CD1-CD1 3.86Å; F579-Y594 HydrophobicContact CD1-CD1 3.86Å; F579-Y594 AromaticContact CD1-CE1 3.88Å; F579-Y594 HydrophobicContact CD1-CE1 3.88Å; F579-Y594 HydrophobicContact CD1-CG 4.44Å; F579-Y594 HydrophobicContact CE1-CD1 4.02Å; F579-Y594 HydrophobicContact CE1-CD2 4.42Å; F579-Y594 HydrophobicContact CE1-CE1 4.21Å; F579-Y594 HydrophobicContact CE1-CG 4.13Å; F579-Y594 HydrophobicContact CG-CE1 4.43Å; F579-Y599 HydrophobicContact CD1-CD1 4.25Å; F579-S602 WeakPolarHBondContact O-CB 3.48Å; F579-S602 PolarHBondContact O-OG 3.16Å; F579-F603 HydrophobicContact CD1-CZ 4.44Å; F579-F603 AromaticContact CE1-CE1 3.9Å; F579-F603 HydrophobicContact CE1-CE1 3.9Å; F579-F603 HydrophobicContact CE1-CE2 4.3Å; F579-F603 AromaticContact CE1-CZ 3.54Å; F579-F603 HydrophobicContact CE1-CZ 3.54Å; F579-F603 HydrophobicContact CZ-CE1 4.3Å; F579-F603 HydrophobicContact CZ-CZ 4.33Å
580	N	95.4	Very high	91.7	Very high	40 Å²	40	52.6 Å²	52.6	21%	0.214	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	122.4	179.6	-170.9	6.4	0	0	0	111.1	L556 D557 L558 S559 S582	L556-N580 PolarHBondContact O-N 3.15Å; D557-N580 HydrophobicContact CB-CB 4.49Å; L558-N580 PolarHBondContact N-O 2.93Å; S559-N580 PolarHBondContact N-O 3.43Å; S559-N580 PolarHBondContact OG-ND2 2.88Å; N580-S582 VanDerWaalsContact OD1-CB 3.29Å; N580-S582 WeakPolarHBondContact OD1-CB 3.4Å; N580-S582 PolarHBondContact OD1-N 2.91Å; N580-S582 VanDerWaalsContact OD1-N 3.11Å; N580-S582 PolarHBondContact OD1-OG 3.13Å
581	V	96.2	Very high	91.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.26	C	S	.	.			trans	-129.5	20.2	176.4	-62.3	0	0	0	0	111	I543 L558 F579 N584 L586 S602 F603 N606	I543-V581 HydrophobicContact CD1-CG1 4.21Å; L558-V581 HydrophobicContact CB-CG1 4.32Å; F579-V581 HydrophobicContact CD2-CG1 4.44Å; F579-V581 HydrophobicContact CE1-CG2 4.43Å; F579-V581 HydrophobicContact CE2-CG1 3.54Å; F579-V581 HydrophobicContact CZ-CG1 3.66Å; F579-V581 HydrophobicContact CZ-CG2 4.06Å; V581-N584 PolarHBondContact O-ND2 3.33Å; V581-N584 VanDerWaalsContact O-ND2 3.1Å; V581-L586 HydrophobicContact CB-CD1 3.83Å; V581-L586 HydrophobicContact CG2-CD1 3.85Å; V581-S602 CarbonylContact C-O 3.47Å; V581-S602 WeakPolarHBondContact CA-O 3.01Å; V581-S602 VanDerWaalsContact CG2-O 3.26Å; V581-S602 WeakPolarHBondContact CG2-O 3.44Å; V581-S602 PolarHBondContact N-O 3.28Å; V581-F603 HydrophobicContact CG2-CD1 3.42Å; V581-F603 VanDerWaalsContact CG2-CD1 3.42Å; V581-F603 HydrophobicContact CG2-CE1 3.54Å; V581-F603 HydrophobicContact CG2-CG 4.39Å; V581-N606 PolarHBondContact O-ND2 3.27Å
582	S	95.4	Very high	91	Very high	11 Å²	11	53.1 Å²	53.1	8%	0.077	29%	0.288	C	S	.	.			trans	-65.3	159.7	-177.7	60.7	0	0	0	0	111.7	S559 G560 N580 N584 S602 L604	S559-S582 CarbonylContact C-O 3.53Å; S559-S582 WeakPolarHBondContact CA-O 3.3Å; S559-S582 VanDerWaalsContact CB-O 3.3Å; S559-S582 WeakPolarHBondContact CB-O 3.26Å; S559-S582 WeakPolarHBondContact CB-OG 3.5Å; G560-S582 PolarHBondContact N-O 3.29Å; N580-S582 VanDerWaalsContact OD1-CB 3.29Å; N580-S582 WeakPolarHBondContact OD1-CB 3.4Å; N580-S582 PolarHBondContact OD1-N 2.91Å; N580-S582 VanDerWaalsContact OD1-N 3.11Å; N580-S582 PolarHBondContact OD1-OG 3.13Å; S582-N584 PolarHBondContact O-ND2 3.07Å; S582-S602 PolarHBondContact N-O 2.69Å; S582-L604 CarbonylContact C-O 3.49Å; S582-L604 WeakPolarHBondContact CA-O 3.48Å; S582-L604 WeakPolarHBondContact CB-O 3.36Å
583	N	96.2	Very high	90.6	Very high	98 Å²	98	56.4 Å²	56.4	52%	0.524	30%	0.304	S	S	.	.	S	Bend	trans	54.7	59.3	178.6	-55.1	-42.4	0	0	0	112.3	G560 N561 L604	G560-N583 WeakPolarHBondContact CA-O 3.45Å; G560-N583 PolarHBondContact N-O 2.98Å; N561-N583 PolarHBondContact N-O 2.84Å; N561-N583 VanDerWaalsContact N-O 3.16Å; N561-N583 VanDerWaalsContact O-O 3.11Å; N583-L604 PolarHBondContact N-O 3.07Å
584	N	97	Very high	90.3	Very high	7 Å²	7	51.3 Å²	51.3	4%	0.037	28%	0.276	C	S	.	.	S	Bend	trans	-133.9	-167.6	175.9	-85.8	-76.3	0	0	0	109.9	L558 N561 R562 L563 V581 S582 L586 G605 N606	L558-N584 PolarHBondContact O-ND2 3.1Å; N561-N584 VanDerWaalsContact CA-OD1 3.3Å; N561-N584 WeakPolarHBondContact CA-OD1 3.35Å; N561-N584 WeakPolarHBondContact CB-OD1 3.26Å; N561-N584 PolarHBondContact N-OD1 2.77Å; N561-N584 PolarHBondContact O-OD1 3.08Å; R562-N584 PolarHBondContact N-OD1 2.86Å; L563-N584 HydrophobicContact CB-CB 4.35Å; L563-N584 VanDerWaalsContact CB-OD1 3.28Å; L563-N584 WeakPolarHBondContact CB-OD1 3.46Å; L563-N584 WeakPolarHBondContact CG-OD1 3.4Å; L563-N584 PolarHBondContact N-OD1 2.86Å; V581-N584 PolarHBondContact O-ND2 3.33Å; V581-N584 VanDerWaalsContact O-ND2 3.1Å; S582-N584 PolarHBondContact O-ND2 3.07Å; N584-L586 HydrophobicContact CB-CD1 4.21Å; N584-L586 HydrophobicContact CB-CG 4Å; N584-G605 VanDerWaalsContact O-O 3.06Å; N584-N606 VanDerWaalsContact CA-OD1 3.27Å; N584-N606 WeakPolarHBondContact CA-OD1 3.48Å; N584-N606 WeakPolarHBondContact CB-OD1 3.33Å; N584-N606 PolarHBondContact N-OD1 2.82Å; N584-N606 PolarHBondContact O-OD1 3.16Å
585	Q	95.3	Very high	89.7	Confident	113 Å²	113	52.9 Å²	52.9	53%	0.528	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	32.9	175.7	-59.7	178.2	-3.1	0	0	111.4	L563 T564 N606	L563-Q585 CarbonylContact O-C 3.58Å; L563-Q585 WeakPolarHBondContact O-CA 3.4Å; L563-Q585 WeakPolarHBondContact O-CB 3.19Å; L563-Q585 PolarHBondContact O-N 3.28Å; T564-Q585 HydrophobicContact CG2-CB 3.87Å; Q585-N606 PolarHBondContact N-OD1 3.05Å
586	L	95.2	Very high	89.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	150.4	-178	-59.7	167.2	0	0	0	111	I543 L563 V567 V581 N584 N606 G608 L609	I543-L586 HydrophobicContact CD1-CD1 4.09Å; I543-L586 HydrophobicContact CD1-CD2 3.83Å; I543-L586 HydrophobicContact CG1-CD2 4.25Å; L563-L586 HydrophobicContact CB-CD2 4.17Å; L563-L586 PolarHBondContact O-N 3.16Å; V567-L586 HydrophobicContact CG2-CD1 4.01Å; V581-L586 HydrophobicContact CB-CD1 3.83Å; V581-L586 HydrophobicContact CG2-CD1 3.85Å; N584-L586 HydrophobicContact CB-CD1 4.21Å; N584-L586 HydrophobicContact CB-CG 4Å; L586-N606 HydrophobicContact CB-CB 4.3Å; L586-N606 VanDerWaalsContact CB-OD1 3.28Å; L586-N606 WeakPolarHBondContact CB-OD1 3.46Å; L586-N606 WeakPolarHBondContact CG-OD1 3.38Å; L586-N606 PolarHBondContact N-OD1 2.8Å; L586-G608 CarbonylContact O-C 3.57Å; L586-G608 WeakPolarHBondContact O-CA 3.28Å; L586-G608 PolarHBondContact O-N 2.79Å; L586-L609 HydrophobicContact CB-CD2 4.09Å; L586-L609 HydrophobicContact CB-CG 4.36Å
587	S	92.9	Very high	89	Confident	48 Å²	48	50 Å²	50	34%	0.336	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	165.8	-175.3	61.2	0	0	0	0	112.1	G565 E566 G608	G565-S587 PolarHBondContact O-N 3.3Å; G565-S587 PolarHBondContact O-OG 3.45Å; E566-S587 VanDerWaalsContact CA-O 3.29Å; E566-S587 WeakPolarHBondContact CA-O 3.46Å; S587-G608 VanDerWaalsContact CA-O 3.26Å; S587-G608 WeakPolarHBondContact CA-O 3.38Å
588	G	89.2	Confident	88.6	Confident	17 Å²	17	47.6 Å²	47.6	18%	0.175	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.8	-169.1	178	0	0	0	0	0	113.5	G608 C610	G588-G608 PolarHBondContact N-O 2.94Å; G588-G608 VanDerWaalsContact N-O 3.14Å; G588-C610 VanDerWaalsContact C-SG 3.53Å; G588-C610 PolarHBondContact O-N 2.69Å; G588-C610 PolarHBondContact O-SG 2.82Å
589	A	86.6	Confident	88.3	Confident	61 Å²	61	45.8 Å²	45.8	50%	0.504	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	145.1	-175.5	0	0	0	0	0	111.6
590	L	85.6	Confident	87.8	Confident	21 Å²	21	50 Å²	50	11%	0.11	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-76	141.2	171.8	-67.4	178.4	0	0	0	110.8	V567 A595 F603 L609 L616	V567-L590 HydrophobicContact CG2-CD2 4.45Å; L590-A595 HydrophobicContact CB-CB 4.21Å; L590-F603 HydrophobicContact CD1-CD2 4.14Å; L590-F603 HydrophobicContact CD1-CE2 4.28Å; L590-F603 HydrophobicContact CD1-CG 4.33Å; L590-F603 HydrophobicContact CD2-CD1 3.51Å; L590-F603 HydrophobicContact CD2-CD2 4.28Å; L590-F603 HydrophobicContact CD2-CE1 3.4Å; L590-F603 VanDerWaalsContact CD2-CE1 3.4Å; L590-F603 HydrophobicContact CD2-CE2 4.18Å; L590-F603 HydrophobicContact CD2-CG 3.95Å; L590-F603 HydrophobicContact CD2-CZ 3.72Å; L590-L609 HydrophobicContact CD2-CD1 4.08Å; L590-L609 HydrophobicContact CD2-CD2 4.02Å; L590-L616 HydrophobicContact CD1-CD1 4.49Å
591	P	86.6	Confident	87.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-57	135	169.3	-22	31.3	0	0	0	110.9	V567 M569 E572 Q593 Y594 A595	V567-P591 HydrophobicContact CB-CG 4.35Å; V567-P591 HydrophobicContact CG1-CG 3.97Å; M569-P591 HydrophobicContact CE-CB 4.4Å; M569-P591 HydrophobicContact SD-CB 3.72Å; M569-P591 HydrophobicContact SD-CG 4.05Å; E572-P591 HydrophobicContact CG-CB 3.66Å; E572-P591 VanDerWaalsContact OE1-C 3.22Å; E572-P591 WeakPolarHBondContact OE1-CB 2.78Å; P591-Q593 VanDerWaalsContact C-N 3.25Å; P591-Q593 PolarHBondContact O-N 3.05Å; P591-Q593 VanDerWaalsContact O-N 3.09Å; P591-Y594 HydrophobicContact CB-CD2 4.07Å; P591-Y594 HydrophobicContact CG-CD2 4.26Å; P591-Y594 PolarHBondContact O-N 2.69Å; P591-A595 PolarHBondContact O-N 3.1Å; P591-A595 VanDerWaalsContact O-N 3.12Å
592	P	84	Confident	87.2	Confident	89 Å²	89	52.3 Å²	52.3	58%	0.578	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.9	-40.1	-177.5	-31.8	34.1	0	0	0	116	M569 E572 Y594 A595	M569-P592 HydrophobicContact CE-CG 4.4Å; E572-P592 WeakPolarHBondContact OE1-CD 3.41Å; P592-Y594 VanDerWaalsContact C-N 3.3Å; P592-Y594 PolarHBondContact O-N 3.42Å; P592-A595 PolarHBondContact O-N 2.77Å
593	Q	82.1	Confident	87	Confident	106 Å²	106	51.9 Å²	51.9	50%	0.495	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-33.2	-179.3	-69.1	-169	34.6	0	0	113	E572 P591	E572-Q593 HydrophobicContact CB-CG 4.34Å; E572-Q593 HydrophobicContact CG-CB 4.1Å; E572-Q593 HydrophobicContact CG-CG 4.09Å; E572-Q593 PolarHBondContact O-NE2 3.21Å; E572-Q593 VanDerWaalsContact O-NE2 3.16Å; E572-Q593 PolarHBondContact O-OE1 2.7Å; E572-Q593 PolarHBondContact OE1-N 3.33Å; P591-Q593 VanDerWaalsContact C-N 3.25Å; P591-Q593 PolarHBondContact O-N 3.05Å; P591-Q593 VanDerWaalsContact O-N 3.09Å
594	Y	83.2	Confident	86.7	Confident	5 Å²	5	51 Å²	51	2%	0.02	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-9.2	-179.1	-59.1	-64.4	0	0	0	113.2	L571 E572 F579 P591 P592 T596 Y599 F603	L571-Y594 HydrophobicContact CB-CE2 4Å; L571-Y594 PolarHBondContact O-OH 2.87Å; E572-Y594 HydrophobicContact CG-CE2 4.37Å; F579-Y594 AromaticContact CD1-CD1 3.86Å; F579-Y594 HydrophobicContact CD1-CD1 3.86Å; F579-Y594 AromaticContact CD1-CE1 3.88Å; F579-Y594 HydrophobicContact CD1-CE1 3.88Å; F579-Y594 HydrophobicContact CD1-CG 4.44Å; F579-Y594 HydrophobicContact CE1-CD1 4.02Å; F579-Y594 HydrophobicContact CE1-CD2 4.42Å; F579-Y594 HydrophobicContact CE1-CE1 4.21Å; F579-Y594 HydrophobicContact CE1-CG 4.13Å; F579-Y594 HydrophobicContact CG-CE1 4.43Å; P591-Y594 HydrophobicContact CB-CD2 4.07Å; P591-Y594 HydrophobicContact CG-CD2 4.26Å; P591-Y594 PolarHBondContact O-N 2.69Å; P592-Y594 VanDerWaalsContact C-N 3.3Å; P592-Y594 PolarHBondContact O-N 3.42Å; Y594-T596 PolarHBondContact O-N 3Å; Y594-Y599 AromaticContact CD1-CD1 3.94Å; Y594-Y599 HydrophobicContact CD1-CD1 3.94Å; Y594-Y599 AromaticContact CD1-CD2 3.96Å; Y594-Y599 HydrophobicContact CD1-CD2 3.96Å; Y594-Y599 AromaticContact CD1-CE1 3.94Å; Y594-Y599 HydrophobicContact CD1-CE1 3.94Å; Y594-Y599 AromaticContact CD1-CE2 3.97Å; Y594-Y599 HydrophobicContact CD1-CE2 3.97Å; Y594-Y599 AromaticContact CD1-CG 3.95Å; Y594-Y599 HydrophobicContact CD1-CG 3.95Å; Y594-Y599 AromaticContact CD1-CZ 3.96Å; Y594-Y599 HydrophobicContact CE1-CD1 4.47Å; Y594-Y599 HydrophobicContact CE1-CE1 4.09Å; Y594-F603 HydrophobicContact CG-CZ 4.29Å
595	A	79.1	Confident	86.3	Confident	43 Å²	43	52.9 Å²	52.9	36%	0.355	33%	0.333	S	S	.	.			trans	-75.1	37.9	177.5	0	0	0	0	0	113.4	L590 P591 P592 N613	L590-A595 HydrophobicContact CB-CB 4.21Å; P591-A595 PolarHBondContact O-N 3.1Å; P591-A595 VanDerWaalsContact O-N 3.12Å; P592-A595 PolarHBondContact O-N 2.77Å; A595-N613 PolarHBondContact O-ND2 3.25Å
596	T	81.1	Confident	86.1	Confident	61 Å²	61	47.8 Å²	47.8	37%	0.374	31%	0.31	S	S	.	.	S	Bend	trans	-119	162.5	-178.7	68	0	0	0	0	111.4	Y594 A598 Y599	Y594-T596 PolarHBondContact O-N 3Å; T596-A598 PolarHBondContact O-N 3.32Å; T596-Y599 PolarHBondContact O-N 3.14Å; T596-Y599 WeakPolarHBondContact OG1-CD2 2.9Å
597	A	76.6	Confident	85.6	Confident	83 Å²	83	53.6 Å²	53.6	69%	0.686	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-61.7	-26.6	-179.7	0	0	0	0	0	113.4	Y599 R600	A597-Y599 VanDerWaalsContact C-N 3.33Å; A597-Y599 PolarHBondContact O-N 2.67Å; A597-R600 VanDerWaalsContact O-CB 3.27Å; A597-R600 WeakPolarHBondContact O-CB 3.47Å; A597-R600 PolarHBondContact O-N 3.2Å
598	A	79.1	Confident	85.3	Confident	82 Å²	82	53.1 Å²	53.1	68%	0.678	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-63.6	-35.9	-178.9	0	0	0	0	0	113	T596	T596-A598 PolarHBondContact O-N 3.32Å
599	Y	83.8	Confident	85.1	Confident	70 Å²	70	52.6 Å²	52.6	28%	0.275	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-95.4	8.4	179.9	-62.3	-78.5	0	0	0	113.2	F579 Y594 T596 A597 S601 S602 F603	F579-Y599 HydrophobicContact CD1-CD1 4.25Å; Y594-Y599 AromaticContact CD1-CD1 3.94Å; Y594-Y599 HydrophobicContact CD1-CD1 3.94Å; Y594-Y599 AromaticContact CD1-CD2 3.96Å; Y594-Y599 HydrophobicContact CD1-CD2 3.96Å; Y594-Y599 AromaticContact CD1-CE1 3.94Å; Y594-Y599 HydrophobicContact CD1-CE1 3.94Å; Y594-Y599 AromaticContact CD1-CE2 3.97Å; Y594-Y599 HydrophobicContact CD1-CE2 3.97Å; Y594-Y599 AromaticContact CD1-CG 3.95Å; Y594-Y599 HydrophobicContact CD1-CG 3.95Å; Y594-Y599 AromaticContact CD1-CZ 3.96Å; Y594-Y599 HydrophobicContact CE1-CD1 4.47Å; Y594-Y599 HydrophobicContact CE1-CE1 4.09Å; T596-Y599 PolarHBondContact O-N 3.14Å; T596-Y599 WeakPolarHBondContact OG1-CD2 2.9Å; A597-Y599 VanDerWaalsContact C-N 3.33Å; A597-Y599 PolarHBondContact O-N 2.67Å; Y599-S601 VanDerWaalsContact C-N 3.28Å; Y599-S601 PolarHBondContact O-N 3.25Å; Y599-S602 WeakPolarHBondContact O-CB 3.37Å; Y599-S602 PolarHBondContact O-N 3.16Å; Y599-S602 PolarHBondContact O-OG 3.33Å; Y599-F603 VanDerWaalsContact O-CD2 3.25Å; Y599-F603 WeakPolarHBondContact O-CD2 3.46Å
600	R	83	Confident	84.2	Confident	96 Å²	96	53 Å²	53	36%	0.362	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-54.4	-44.4	-174.4	-179.6	-176.4	174.5	86.3	-3.8	112.4	A597 S602 F603 A614	A597-R600 VanDerWaalsContact O-CB 3.27Å; A597-R600 WeakPolarHBondContact O-CB 3.47Å; A597-R600 PolarHBondContact O-N 3.2Å; R600-S602 PolarHBondContact O-N 3.42Å; R600-F603 PolarHBondContact O-N 3.16Å; R600-A614 PolarHBondContact NH1-O 3.15Å; R600-A614 PolarHBondContact NH2-O 3.46Å
601	S	87.5	Confident	83	Confident	77 Å²	77	53.5 Å²	53.5	54%	0.538	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-62.9	-30.9	179.2	46.3	0	0	0	0	112.6	Y599 F603 L604	Y599-S601 VanDerWaalsContact C-N 3.28Å; Y599-S601 PolarHBondContact O-N 3.25Å; S601-F603 PolarHBondContact O-N 3.05Å; S601-L604 PolarHBondContact O-N 3.09Å
602	S	91.6	Very high	81.5	Confident	10 Å²	10	61.9 Å²	61.9	7%	0.07	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-66.5	-15.3	-178.2	-50.6	0	0	0	0	114.1	F579 V581 S582 Y599 R600	F579-S602 WeakPolarHBondContact O-CB 3.48Å; F579-S602 PolarHBondContact O-OG 3.16Å; V581-S602 CarbonylContact C-O 3.47Å; V581-S602 WeakPolarHBondContact CA-O 3.01Å; V581-S602 VanDerWaalsContact CG2-O 3.26Å; V581-S602 WeakPolarHBondContact CG2-O 3.44Å; V581-S602 PolarHBondContact N-O 3.28Å; S582-S602 PolarHBondContact N-O 2.69Å; Y599-S602 WeakPolarHBondContact O-CB 3.37Å; Y599-S602 PolarHBondContact O-N 3.16Å; Y599-S602 PolarHBondContact O-OG 3.33Å; R600-S602 PolarHBondContact O-N 3.42Å
603	F	90.8	Very high	79.8	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.009	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-118	-2.4	-175.9	-62.6	-74.4	0	0	0	114.5	V567 F579 V581 L590 Y594 Y599 R600 S601 N606 L609	V567-F603 HydrophobicContact CG1-CE1 4.47Å; V567-F603 HydrophobicContact CG2-CE1 4.1Å; F579-F603 HydrophobicContact CD1-CZ 4.44Å; F579-F603 AromaticContact CE1-CE1 3.9Å; F579-F603 HydrophobicContact CE1-CE1 3.9Å; F579-F603 HydrophobicContact CE1-CE2 4.3Å; F579-F603 AromaticContact CE1-CZ 3.54Å; F579-F603 HydrophobicContact CE1-CZ 3.54Å; F579-F603 HydrophobicContact CZ-CE1 4.3Å; F579-F603 HydrophobicContact CZ-CZ 4.33Å; V581-F603 HydrophobicContact CG2-CD1 3.42Å; V581-F603 VanDerWaalsContact CG2-CD1 3.42Å; V581-F603 HydrophobicContact CG2-CE1 3.54Å; V581-F603 HydrophobicContact CG2-CG 4.39Å; L590-F603 HydrophobicContact CD1-CD2 4.14Å; L590-F603 HydrophobicContact CD1-CE2 4.28Å; L590-F603 HydrophobicContact CD1-CG 4.33Å; L590-F603 HydrophobicContact CD2-CD1 3.51Å; L590-F603 HydrophobicContact CD2-CD2 4.28Å; L590-F603 HydrophobicContact CD2-CE1 3.4Å; L590-F603 VanDerWaalsContact CD2-CE1 3.4Å; L590-F603 HydrophobicContact CD2-CE2 4.18Å; L590-F603 HydrophobicContact CD2-CG 3.95Å; L590-F603 HydrophobicContact CD2-CZ 3.72Å; Y594-F603 HydrophobicContact CG-CZ 4.29Å; Y599-F603 VanDerWaalsContact O-CD2 3.25Å; Y599-F603 WeakPolarHBondContact O-CD2 3.46Å; R600-F603 PolarHBondContact O-N 3.16Å; S601-F603 PolarHBondContact O-N 3.05Å; F603-N606 PolarHBondContact O-ND2 3.32Å; F603-N606 VanDerWaalsContact O-ND2 3.08Å; F603-L609 HydrophobicContact CB-CD1 3.91Å; F603-L609 HydrophobicContact CD1-CD1 4.02Å; F603-L609 HydrophobicContact CG-CD1 4.35Å
604	L	90.2	Very high	78.2	Confident	79 Å²	79	59.2 Å²	59.2	41%	0.414	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	152	-179.5	-67.1	176.7	0	0	0	111.5	S582 N583 S601 N606	S582-L604 CarbonylContact C-O 3.49Å; S582-L604 WeakPolarHBondContact CA-O 3.48Å; S582-L604 WeakPolarHBondContact CB-O 3.36Å; N583-L604 PolarHBondContact N-O 3.07Å; S601-L604 PolarHBondContact O-N 3.09Å; L604-N606 VanDerWaalsContact C-N 3.33Å; L604-N606 PolarHBondContact O-N 3Å
605	G	89.2	Confident	76.7	Confident	47 Å²	47	62.3 Å²	62.3	49%	0.485	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	15.7	178	0	0	0	0	0	115.5	N584	N584-G605 VanDerWaalsContact O-O 3.06Å
606	N	91.6	Very high	75.4	Confident	7 Å²	7	61.5 Å²	61.5	4%	0.037	42%	0.416	C	S	.	.			trans	-112.8	98.2	172.3	-72.9	-78.9	0	0	0	110.5	V581 N584 Q585 L586 F603 L604 G608 L609	V581-N606 PolarHBondContact O-ND2 3.27Å; N584-N606 VanDerWaalsContact CA-OD1 3.27Å; N584-N606 WeakPolarHBondContact CA-OD1 3.48Å; N584-N606 WeakPolarHBondContact CB-OD1 3.33Å; N584-N606 PolarHBondContact N-OD1 2.82Å; N584-N606 PolarHBondContact O-OD1 3.16Å; Q585-N606 PolarHBondContact N-OD1 3.05Å; L586-N606 HydrophobicContact CB-CB 4.3Å; L586-N606 VanDerWaalsContact CB-OD1 3.28Å; L586-N606 WeakPolarHBondContact CB-OD1 3.46Å; L586-N606 WeakPolarHBondContact CG-OD1 3.38Å; L586-N606 PolarHBondContact N-OD1 2.8Å; F603-N606 PolarHBondContact O-ND2 3.32Å; F603-N606 VanDerWaalsContact O-ND2 3.08Å; L604-N606 VanDerWaalsContact C-N 3.33Å; L604-N606 PolarHBondContact O-N 3Å; N606-G608 VanDerWaalsContact C-N 3.27Å; N606-G608 PolarHBondContact O-N 2.8Å; N606-L609 HydrophobicContact CB-CD1 3.47Å; N606-L609 VanDerWaalsContact CB-CD1 3.47Å; N606-L609 HydrophobicContact CB-CG 3.8Å
607	P	84.8	Confident	73.8	Confident	122 Å²	122	61.4 Å²	61.4	79%	0.792	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-17	-171.2	27	-34.6	0	0	0	114.6
608	G	85.6	Confident	72.1	Confident	38 Å²	38	62.1 Å²	62.1	39%	0.392	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-5.9	-177.1	0	0	0	0	0	115.1	L586 S587 G588 N606	L586-G608 CarbonylContact O-C 3.57Å; L586-G608 WeakPolarHBondContact O-CA 3.28Å; L586-G608 PolarHBondContact O-N 2.79Å; S587-G608 VanDerWaalsContact CA-O 3.26Å; S587-G608 WeakPolarHBondContact CA-O 3.38Å; G588-G608 PolarHBondContact N-O 2.94Å; G588-G608 VanDerWaalsContact N-O 3.14Å; N606-G608 VanDerWaalsContact C-N 3.27Å; N606-G608 PolarHBondContact O-N 2.8Å
609	L	84.3	Confident	69.9	Low	5 Å²	5	65.8 Å²	65.8	3%	0.026	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	135.7	-176.2	-69.6	175.6	0	0	0	111.3	L586 L590 F603 N606	L586-L609 HydrophobicContact CB-CD2 4.09Å; L586-L609 HydrophobicContact CB-CG 4.36Å; L590-L609 HydrophobicContact CD2-CD1 4.08Å; L590-L609 HydrophobicContact CD2-CD2 4.02Å; F603-L609 HydrophobicContact CB-CD1 3.91Å; F603-L609 HydrophobicContact CD1-CD1 4.02Å; F603-L609 HydrophobicContact CG-CD1 4.35Å; N606-L609 HydrophobicContact CB-CD1 3.47Å; N606-L609 VanDerWaalsContact CB-CD1 3.47Å; N606-L609 HydrophobicContact CB-CG 3.8Å
610	C	69.4	Low	67.6	Low	69 Å²	69	67.9 Å²	67.9	47%	0.466	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.4	176.4	60.3	0	0	0	0	112.4	G588 C617	G588-C610 VanDerWaalsContact C-SG 3.53Å; G588-C610 PolarHBondContact O-N 2.69Å; G588-C610 PolarHBondContact O-SG 2.82Å; C610-C617 VanDerWaalsContact CA-SG 3.52Å
611	G	59.3	Low	65.1	Low	33 Å²	33	72.5 Å²	72.5	34%	0.34	48%	0.482	S	S	.	.			trans	-176.2	155.6	178.7	0	0	0	0	0	114.5	N613 C617	G611-N613 PolarHBondContact O-N 3.43Å; G611-N613 VanDerWaalsContact O-N 3.09Å; G611-C617 PolarHBondContact N-SG 3Å; G611-C617 VanDerWaalsContact N-SG 3.35Å
612	D	54.5	Low	62.4	Low	175 Å²	175	72.6 Å²	72.6	94%	0.936	50%	0.495	S	S	*	.	S	Bend	trans	-69.8	-1.5	-172	-74	-26.5	0	0	0	115.3	A614	D612-A614 PolarHBondContact O-N 3.27Å
613	N	49.8	Very low	59.5	Low	52 Å²	52	75.4 Å²	75.4	28%	0.278	53%	0.525	S	S	.	.	S	Bend	trans	-80.4	110.4	177.7	-73.8	-13.1	0	0	0	110.2	A595 G611 G615 L616	A595-N613 PolarHBondContact O-ND2 3.25Å; G611-N613 PolarHBondContact O-N 3.43Å; G611-N613 VanDerWaalsContact O-N 3.09Å; N613-G615 PolarHBondContact O-N 3.16Å; N613-L616 HydrophobicContact CB-CD1 4.12Å; N613-L616 PolarHBondContact O-N 2.91Å
614	A	47.4	Very low	56.8	Low	88 Å²	88	81.8 Å²	81.8	73%	0.727	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-41.5	121.7	-177.3	0	0	0	0	0	113.1	R600 D612	R600-A614 PolarHBondContact NH1-O 3.15Å; R600-A614 PolarHBondContact NH2-O 3.46Å; D612-A614 PolarHBondContact O-N 3.27Å
615	G	51.9	Low	54.2	Low	69 Å²	69	89.8 Å²	89.8	71%	0.711	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	101	-2.8	177	0	0	0	0	0	116.7	N613	N613-G615 PolarHBondContact O-N 3.16Å
616	L	52.6	Low	51.9	Low	27 Å²	27	93 Å²	93	14%	0.141	61%	0.607	C	S	.	*	S	Bend	trans	-87.9	-13.2	171.5	-76.2	163.4	0	0	0	113.7	L590 N613	L590-L616 HydrophobicContact CD1-CD1 4.49Å; N613-L616 HydrophobicContact CB-CD1 4.12Å; N613-L616 PolarHBondContact O-N 2.91Å
617	C	47.7	Very low	49.8	Very low	58 Å²	58	104.4 Å²	104.4	39%	0.392	65%	0.649	S	S	.	*	S	Bend	trans	-132.5	141.9	-178	-55.3	0	0	0	0	112.6	C610 G611	C610-C617 VanDerWaalsContact CA-SG 3.52Å; G611-C617 PolarHBondContact N-SG 3Å; G611-C617 VanDerWaalsContact N-SG 3.35Å
618	A	39.8	Very low	48.1	Very low	98 Å²	98	102.4 Å²	102.4	81%	0.81	64%	0.643	S	S	*	*			trans	-73.3	123.1	159.1	0	0	0	0	0	108.5	S620	A618-S620 PolarHBondContact O-N 2.87Å
619	N	33.4	Very low	46.3	Very low	160 Å²	160	103.4 Å²	103.4	86%	0.856	65%	0.653	S	S	*	*			trans	-34.5	104.4	179.8	-73.8	-22.7	0	0	0	113.9
620	S	35.7	Very low	44.8	Very low	113 Å²	113	110.1 Å²	110.1	79%	0.79	68%	0.682	S	S	*	*			trans	-107.8	103.8	161.4	45.2	0	0	0	0	109	A618 G622	A618-S620 PolarHBondContact O-N 2.87Å; S620-G622 PolarHBondContact O-N 2.79Å
621	Q	31	Very low	44	Very low	194 Å²	194	109.9 Å²	109.9	91%	0.907	69%	0.685	S	S	*	*			trans	-67.7	111.7	173.2	-63	-143.9	-6.5	0	0	110
622	G	30.4	Very low	43.6	Very low	79 Å²	79	118.3 Å²	118.3	81%	0.814	71%	0.707	S	S	*	*			trans	-114.9	92.8	175.2	0	0	0	0	0	111.4	S620	S620-G622 PolarHBondContact O-N 2.79Å
623	G	29.7	Very low	43.6	Very low	68 Å²	68	115.9 Å²	115.9	70%	0.701	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-64	163.5	-177.9	0	0	0	0	0	116
624	P	34.7	Very low	44.4	Very low	137 Å²	137	116.6 Å²	116.6	89%	0.89	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-82.8	121.6	-169.2	32.1	-30.8	0	0	0	111.4
625	R	36.3	Very low	45.2	Very low	246 Å²	246	121.2 Å²	121.2	93%	0.928	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-92.3	136.1	170.6	-94.3	179	162.1	165.4	-4.5	111.8
626	S	39.8	Very low	46.1	Very low	115 Å²	115	120.6 Å²	120.6	80%	0.804	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-59.3	127.6	-164.9	53.6	0	0	0	0	115.5	A628	S626-A628 PolarHBondContact O-N 2.82Å
627	R	47.1	Very low	47.4	Very low	247 Å²	247	123.9 Å²	123.9	93%	0.932	69%	0.694	S	S	*	*	S	Bend	trans	-81.5	97.4	171.1	-67.8	174.5	172.4	172.9	-2.9	110.3
628	A	48.8	Very low	48.6	Very low	80 Å²	80	127.5 Å²	127.5	66%	0.661	70%	0.704	S	S	*	*	S	Bend	trans	-151.8	-39.8	161.4	0	0	0	0	0	113.2	S626	S626-A628 PolarHBondContact O-N 2.82Å
629	G	48.4	Very low	50.5	Low	59 Å²	59	128.3 Å²	128.3	61%	0.608	69%	0.693	S	S	*	*	S	Bend	trans	-75.7	-29	177.1	0	0	0	0	0	114.4	A631	G629-A631 PolarHBondContact O-N 2.95Å
630	F	53.2	Low	52.8	Low	145 Å²	145	127.7 Å²	127.7	64%	0.636	68%	0.683	S	S	*	*	H	α-helix	trans	-71.2	-28.7	-174.7	-158.2	-104	0	0	0	113.1	W632 M634	F630-W632 PolarHBondContact O-N 2.87Å; F630-M634 HydrophobicContact CD1-CG 3.52Å; F630-M634 HydrophobicContact CD1-SD 4.4Å; F630-M634 HydrophobicContact CE1-CE 3.95Å; F630-M634 HydrophobicContact CE1-CG 3.43Å; F630-M634 VanDerWaalsContact CE1-CG 3.43Å; F630-M634 HydrophobicContact CE1-SD 3.7Å; F630-M634 HydrophobicContact CG-CG 4.25Å; F630-M634 HydrophobicContact CZ-CG 4.1Å; F630-M634 HydrophobicContact CZ-SD 3.97Å; F630-M634 VanDerWaalsContact O-CB 3.25Å; F630-M634 WeakPolarHBondContact O-CB 3.34Å; F630-M634 WeakPolarHBondContact O-CG 3.48Å; F630-M634 PolarHBondContact O-N 2.92Å
631	A	52.9	Low	54.9	Low	64 Å²	64	124.7 Å²	124.7	53%	0.529	67%	0.665	S	S	.	*	H	α-helix	trans	-71.5	-31.9	-174.9	0	0	0	0	0	113.8	G629 R635	G629-A631 PolarHBondContact O-N 2.95Å; A631-R635 PolarHBondContact O-N 2.94Å
632	W	49.8	Very low	57.3	Low	211 Å²	211	117.8 Å²	117.8	80%	0.799	64%	0.641	S	S	*	*	H	α-helix	trans	-80.1	-38.7	-179.3	-153.5	82.9	0	0	0	111.7	F630 R635 S636	F630-W632 PolarHBondContact O-N 2.87Å; W632-R635 PolarHBondContact O-N 2.99Å; W632-S636 PolarHBondContact O-N 3.47Å; W632-S636 PolarHBondContact O-OG 2.8Å
633	M	55.9	Low	60	Low	124 Å²	124	118.3 Å²	118.3	61%	0.611	63%	0.628	S	S	*	*	H	α-helix	trans	-67.6	-38.5	173.9	-147.8	-179.9	-63	0	0	111.5	S636 I637	M633-S636 PolarHBondContact O-N 3.32Å; M633-S636 PolarHBondContact O-OG 3.09Å; M633-I637 HydrophobicContact CG-CD1 4.26Å; M633-I637 WeakPolarHBondContact O-CB 3.07Å; M633-I637 WeakPolarHBondContact O-CD1 3.38Å; M633-I637 WeakPolarHBondContact O-CG1 3.3Å; M633-I637 PolarHBondContact O-N 3.17Å
634	M	65.4	Low	62.7	Low	67 Å²	67	118.9 Å²	118.9	33%	0.33	62%	0.618	S	S	.	*	H	α-helix	trans	-63.6	-40.2	173.3	-74.6	-68.4	-87.8	0	0	111.9	F630 I637 F638	F630-M634 HydrophobicContact CD1-CG 3.52Å; F630-M634 HydrophobicContact CD1-SD 4.4Å; F630-M634 HydrophobicContact CE1-CE 3.95Å; F630-M634 HydrophobicContact CE1-CG 3.43Å; F630-M634 VanDerWaalsContact CE1-CG 3.43Å; F630-M634 HydrophobicContact CE1-SD 3.7Å; F630-M634 HydrophobicContact CG-CG 4.25Å; F630-M634 HydrophobicContact CZ-CG 4.1Å; F630-M634 HydrophobicContact CZ-SD 3.97Å; F630-M634 VanDerWaalsContact O-CB 3.25Å; F630-M634 WeakPolarHBondContact O-CB 3.34Å; F630-M634 WeakPolarHBondContact O-CG 3.48Å; F630-M634 PolarHBondContact O-N 2.92Å; M634-I637 PolarHBondContact O-N 2.79Å; M634-F638 HydrophobicContact CB-CD2 4.34Å; M634-F638 HydrophobicContact CE-CD2 4.44Å; M634-F638 HydrophobicContact CE-CE2 3.63Å; M634-F638 HydrophobicContact CE-CZ 4.41Å; M634-F638 VanDerWaalsContact O-CB 3.29Å; M634-F638 WeakPolarHBondContact O-CB 3.24Å; M634-F638 WeakPolarHBondContact O-CD2 3.21Å; M634-F638 PolarHBondContact O-N 3.23Å
635	R	63.7	Low	65.1	Low	185 Å²	185	118 Å²	118	70%	0.698	61%	0.605	S	S	*	*	H	α-helix	trans	-63.7	-43.1	177.9	-84.1	-178.9	177.5	-169.6	-0.4	113.1	A631 W632 F638 I639	A631-R635 PolarHBondContact O-N 2.94Å; W632-R635 PolarHBondContact O-N 2.99Å; R635-F638 PolarHBondContact O-N 3.24Å; R635-I639 WeakPolarHBondContact O-CB 3.44Å; R635-I639 WeakPolarHBondContact O-CD1 3.39Å; R635-I639 WeakPolarHBondContact O-CG1 3.49Å; R635-I639 PolarHBondContact O-N 3.09Å
636	S	72.5	Confident	67.4	Low	55 Å²	55	110.9 Å²	110.9	39%	0.385	59%	0.589	S	S	.	*	H	α-helix	trans	-70.3	-36.7	177.5	31.3	0	0	0	0	112.2	W632 M633 F640	W632-S636 PolarHBondContact O-N 3.47Å; W632-S636 PolarHBondContact O-OG 2.8Å; M633-S636 PolarHBondContact O-N 3.32Å; M633-S636 PolarHBondContact O-OG 3.09Å; S636-F640 VanDerWaalsContact O-CB 3.31Å; S636-F640 WeakPolarHBondContact O-CB 3.43Å; S636-F640 PolarHBondContact O-N 3.41Å
637	I	78.6	Confident	69.6	Low	97 Å²	97	108.1 Å²	108.1	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-63.4	-44.5	170.9	-68.7	165.8	0	0	0	110.8	M633 M634 F640 A641	M633-I637 HydrophobicContact CG-CD1 4.26Å; M633-I637 WeakPolarHBondContact O-CB 3.07Å; M633-I637 WeakPolarHBondContact O-CD1 3.38Å; M633-I637 WeakPolarHBondContact O-CG1 3.3Å; M633-I637 PolarHBondContact O-N 3.17Å; M634-I637 PolarHBondContact O-N 2.79Å; I637-F640 PolarHBondContact O-N 3.3Å; I637-A641 WeakPolarHBondContact O-CB 3.47Å; I637-A641 PolarHBondContact O-N 3.06Å
638	F	74	Confident	71.4	Confident	134 Å²	134	97.9 Å²	97.9	59%	0.588	54%	0.544	S	S	*	.	H	α-helix	trans	-65.6	-39.1	178.7	-92.6	-71.1	0	0	0	112.5	M634 R635 A642	M634-F638 HydrophobicContact CB-CD2 4.34Å; M634-F638 HydrophobicContact CE-CD2 4.44Å; M634-F638 HydrophobicContact CE-CE2 3.63Å; M634-F638 HydrophobicContact CE-CZ 4.41Å; M634-F638 VanDerWaalsContact O-CB 3.29Å; M634-F638 WeakPolarHBondContact O-CB 3.24Å; M634-F638 WeakPolarHBondContact O-CD2 3.21Å; M634-F638 PolarHBondContact O-N 3.23Å; R635-F638 PolarHBondContact O-N 3.24Å; F638-A642 WeakPolarHBondContact O-CB 3.48Å; F638-A642 PolarHBondContact O-N 3.22Å
639	I	79.6	Confident	73.1	Confident	114 Å²	114	98 Å²	98	59%	0.585	54%	0.537	S	S	*	.	H	α-helix	trans	-69.1	-44.8	176.9	-67.4	164.1	0	0	0	110.3	R635 A642 V643	R635-I639 WeakPolarHBondContact O-CB 3.44Å; R635-I639 WeakPolarHBondContact O-CD1 3.39Å; R635-I639 WeakPolarHBondContact O-CG1 3.49Å; R635-I639 PolarHBondContact O-N 3.09Å; I639-A642 PolarHBondContact O-N 2Å; I639-V643 WeakPolarHBondContact O-CG2 3.43Å; I639-V643 PolarHBondContact O-N 3.12Å
640	F	80.8	Confident	74.7	Confident	148 Å²	148	98 Å²	98	65%	0.649	53%	0.53	S	S	*	.	H	α-helix	trans	-64.4	-43.9	176.9	-172.6	-100	0	0	0	111.5	S636 I637 A642 V643 V644	S636-F640 VanDerWaalsContact O-CB 3.31Å; S636-F640 WeakPolarHBondContact O-CB 3.43Å; S636-F640 PolarHBondContact O-N 3.41Å; I637-F640 PolarHBondContact O-N 3.3Å; F640-A642 VanDerWaalsContact C-N 3.33Å; F640-A642 PolarHBondContact O-N 2.87Å; F640-V643 PolarHBondContact O-N 3.25Å; F640-V644 HydrophobicContact CD1-CG2 4.07Å; F640-V644 HydrophobicContact CE1-CG2 3.76Å; F640-V644 HydrophobicContact CZ-CG2 4.01Å; F640-V644 WeakPolarHBondContact O-CB 3.48Å; F640-V644 VanDerWaalsContact O-CG2 3.28Å; F640-V644 WeakPolarHBondContact O-CG2 3.31Å; F640-V644 PolarHBondContact O-N 2.96Å
641	A	80.8	Confident	76.2	Confident	50 Å²	50	98.9 Å²	98.9	41%	0.413	53%	0.53	S	S	.	.	H	α-helix	trans	-61.6	-40.2	173.8	0	0	0	0	0	111.7	I637 V644 L645	I637-A641 WeakPolarHBondContact O-CB 3.47Å; I637-A641 PolarHBondContact O-N 3.06Å; A641-V644 PolarHBondContact O-N 3.13Å; A641-L645 WeakPolarHBondContact O-CB 3.44Å; A641-L645 PolarHBondContact O-N 2.92Å
642	A	81.9	Confident	77.5	Confident	49 Å²	49	102 Å²	102	41%	0.405	53%	0.531	S	S	.	.	H	α-helix	trans	-66.3	-39.7	175.7	0	0	0	0	0	112	F638 I639 F640 L645 V646	F638-A642 WeakPolarHBondContact O-CB 3.48Å; F638-A642 PolarHBondContact O-N 3.22Å; I639-A642 PolarHBondContact O-N 2Å; F640-A642 VanDerWaalsContact C-N 3.33Å; F640-A642 PolarHBondContact O-N 2.87Å; A642-L645 PolarHBondContact O-N 3.49Å; A642-V646 WeakPolarHBondContact O-CB 3.26Å; A642-V646 WeakPolarHBondContact O-CG2 3.43Å; A642-V646 PolarHBondContact O-N 2.74Å
643	V	86.1	Confident	78.8	Confident	90 Å²	90	98.6 Å²	98.6	55%	0.545	52%	0.519	S	S	.	.	H	α-helix	trans	-67	-43.4	175.5	171.3	0	0	0	0	111	I639 F640 L645 V646 A647	I639-V643 WeakPolarHBondContact O-CG2 3.43Å; I639-V643 PolarHBondContact O-N 3.12Å; F640-V643 PolarHBondContact O-N 3.25Å; V643-L645 VanDerWaalsContact C-N 3.33Å; V643-V646 PolarHBondContact O-N 3.01Å; V643-A647 WeakPolarHBondContact O-CB 3.31Å; V643-A647 PolarHBondContact O-N 3.04Å
644	V	86.8	Confident	79.8	Confident	79 Å²	79	102 Å²	102	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-65.2	-37.6	175	172.1	0	0	0	0	111.1	F640 A641 G648	F640-V644 HydrophobicContact CD1-CG2 4.07Å; F640-V644 HydrophobicContact CE1-CG2 3.76Å; F640-V644 HydrophobicContact CZ-CG2 4.01Å; F640-V644 WeakPolarHBondContact O-CB 3.48Å; F640-V644 VanDerWaalsContact O-CG2 3.28Å; F640-V644 WeakPolarHBondContact O-CG2 3.31Å; F640-V644 PolarHBondContact O-N 2.96Å; A641-V644 PolarHBondContact O-N 3.13Å; V644-G648 WeakPolarHBondContact O-CA 3.43Å; V644-G648 PolarHBondContact O-N 3.42Å
645	L	84.4	Confident	80.1	Confident	118 Å²	118	106 Å²	106	62%	0.618	54%	0.537	S	S	*	.	H	α-helix	trans	-67.7	-45	175.4	-172.5	109.5	0	0	0	110.8	A641 A642 V643 G648 V649	A641-L645 WeakPolarHBondContact O-CB 3.44Å; A641-L645 PolarHBondContact O-N 2.92Å; A642-L645 PolarHBondContact O-N 3.49Å; V643-L645 VanDerWaalsContact C-N 3.33Å; L645-G648 CarbonylContact O-C 3.56Å; L645-G648 PolarHBondContact O-N 3.3Å; L645-V649 HydrophobicContact CG-CG2 4.37Å; L645-V649 VanDerWaalsContact O-CB 3.27Å; L645-V649 WeakPolarHBondContact O-CB 3.39Å; L645-V649 WeakPolarHBondContact O-CG2 3.13Å; L645-V649 PolarHBondContact O-N 3.14Å
646	V	85.7	Confident	80.5	Confident	97 Å²	97	102.7 Å²	102.7	59%	0.588	53%	0.525	S	S	*	.	H	α-helix	trans	-66.9	-42.7	177.5	170.8	0	0	0	0	110.8	A642 V643 G648 V649 A650	A642-V646 WeakPolarHBondContact O-CB 3.26Å; A642-V646 WeakPolarHBondContact O-CG2 3.43Å; A642-V646 PolarHBondContact O-N 2.74Å; V643-V646 PolarHBondContact O-N 3.01Å; V646-G648 VanDerWaalsContact C-N 3.34Å; V646-V649 PolarHBondContact O-N 3.29Å; V646-A650 WeakPolarHBondContact O-CB 3.45Å; V646-A650 PolarHBondContact O-N 3.21Å
647	A	86.1	Confident	80	Confident	57 Å²	57	107.1 Å²	107.1	47%	0.471	53%	0.534	S	S	.	.	H	α-helix	trans	-65.2	-39	174.2	0	0	0	0	0	111.6	V643 A650 W651	V643-A647 WeakPolarHBondContact O-CB 3.31Å; V643-A647 PolarHBondContact O-N 3.04Å; A647-A650 PolarHBondContact O-N 3.05Å; A647-W651 WeakPolarHBondContact O-CB 3.33Å; A647-W651 PolarHBondContact O-N 3.47Å
648	G	84.9	Confident	79.1	Confident	32 Å²	32	105.5 Å²	105.5	33%	0.33	53%	0.531	S	S	.	.	H	α-helix	trans	-67.9	-40.5	176.2	0	0	0	0	0	112.6	V644 L645 V646 F652	V644-G648 WeakPolarHBondContact O-CA 3.43Å; V644-G648 PolarHBondContact O-N 3.42Å; L645-G648 CarbonylContact O-C 3.56Å; L645-G648 PolarHBondContact O-N 3.3Å; V646-G648 VanDerWaalsContact C-N 3.34Å; G648-F652 WeakPolarHBondContact O-CA 3.48Å; G648-F652 WeakPolarHBondContact O-CB 3.35Å; G648-F652 PolarHBondContact O-N 3.44Å
649	V	83.7	Confident	77.9	Confident	84 Å²	84	104.5 Å²	104.5	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-70.6	-40.1	173.9	170.3	0	0	0	0	110.3	L645 V646 F652 Y653	L645-V649 HydrophobicContact CG-CG2 4.37Å; L645-V649 VanDerWaalsContact O-CB 3.27Å; L645-V649 WeakPolarHBondContact O-CB 3.39Å; L645-V649 WeakPolarHBondContact O-CG2 3.13Å; L645-V649 PolarHBondContact O-N 3.14Å; V646-V649 PolarHBondContact O-N 3.29Å; V649-F652 PolarHBondContact O-N 3.45Å; V649-Y653 WeakPolarHBondContact O-CA 3.21Å; V649-Y653 WeakPolarHBondContact O-CB 3.43Å; V649-Y653 PolarHBondContact O-N 3.16Å
650	A	82.4	Confident	76.2	Confident	57 Å²	57	101.3 Å²	101.3	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-66.4	-42.9	175	0	0	0	0	0	111.3	V646 A647 Y653 W654	V646-A650 WeakPolarHBondContact O-CB 3.45Å; V646-A650 PolarHBondContact O-N 3.21Å; A647-A650 PolarHBondContact O-N 3.05Å; A650-Y653 PolarHBondContact O-N 2.63Å; A650-W654 WeakPolarHBondContact O-CB 3.47Å; A650-W654 PolarHBondContact O-N 3.49Å
651	W	84.5	Confident	74.4	Confident	165 Å²	165	100.3 Å²	100.3	63%	0.625	51%	0.512	S	S	*	.	H	α-helix	trans	-65.2	-44.2	174	179.2	77.7	0	0	0	111.3	A647 W654 R655	A647-W651 WeakPolarHBondContact O-CB 3.33Å; A647-W651 PolarHBondContact O-N 3.47Å; W651-W654 PolarHBondContact O-N 3.47Å; W651-R655 WeakPolarHBondContact O-CB 3.43Å; W651-R655 PolarHBondContact O-N 2.83Å
652	F	79.9	Confident	72.6	Confident	128 Å²	128	101.2 Å²	101.2	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-63.7	-43.8	175.2	-179.8	-95.2	0	0	0	110.9	G648 V649 W654 R655 Y656	G648-F652 WeakPolarHBondContact O-CA 3.48Å; G648-F652 WeakPolarHBondContact O-CB 3.35Å; G648-F652 PolarHBondContact O-N 3.44Å; V649-F652 PolarHBondContact O-N 3.45Å; F652-W654 VanDerWaalsContact C-N 3.33Å; F652-W654 PolarHBondContact O-N 3.3Å; F652-R655 CarbonylContact O-C 3.54Å; F652-R655 PolarHBondContact O-N 3.21Å; F652-Y656 HydrophobicContact CE1-CD2 4.41Å; F652-Y656 HydrophobicContact CE1-CG 4.48Å; F652-Y656 HydrophobicContact CZ-CD2 4.38Å; F652-Y656 WeakPolarHBondContact O-CA 3.36Å; F652-Y656 WeakPolarHBondContact O-CB 3.43Å; F652-Y656 PolarHBondContact O-N 3.22Å
653	Y	78.1	Confident	70.5	Confident	140 Å²	140	104.8 Å²	104.8	55%	0.549	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-36.2	177.5	-164.9	-103.1	0	0	0	111.3	V649 A650 R657	V649-Y653 WeakPolarHBondContact O-CA 3.21Å; V649-Y653 WeakPolarHBondContact O-CB 3.43Å; V649-Y653 PolarHBondContact O-N 3.16Å; A650-Y653 PolarHBondContact O-N 2.63Å; Y653-R657 HydrophobicContact CD1-CG 4.35Å; Y653-R657 HydrophobicContact CE1-CG 4.2Å; Y653-R657 VanDerWaalsContact O-CB 3.31Å; Y653-R657 WeakPolarHBondContact O-CB 3.11Å; Y653-R657 WeakPolarHBondContact O-CG 3.42Å; Y653-R657 PolarHBondContact O-N 2.86Å
654	W	77	Confident	68.4	Low	195 Å²	195	105 Å²	105	74%	0.739	52%	0.519	S	S	*	.	H	α-helix	trans	-72	-39.9	174.8	-163.2	40.3	0	0	0	111.7	A650 W651 F652 R657 S658	A650-W654 WeakPolarHBondContact O-CB 3.47Å; A650-W654 PolarHBondContact O-N 3.49Å; W651-W654 PolarHBondContact O-N 3.47Å; F652-W654 VanDerWaalsContact C-N 3.33Å; F652-W654 PolarHBondContact O-N 3.3Å; W654-R657 PolarHBondContact O-N 2.88Å; W654-S658 WeakPolarHBondContact O-CB 3.36Å; W654-S658 PolarHBondContact O-N 2.84Å
655	R	71.1	Confident	66.1	Low	153 Å²	153	105.4 Å²	105.4	58%	0.577	53%	0.526	S	S	*	.	H	α-helix	trans	-67.7	-40.4	173.5	-157.3	76.1	-179.6	139.9	-2.3	111	W651 F652 S658 F659	W651-R655 WeakPolarHBondContact O-CB 3.43Å; W651-R655 PolarHBondContact O-N 2.83Å; F652-R655 CarbonylContact O-C 3.54Å; F652-R655 PolarHBondContact O-N 3.21Å; R655-S658 CarbonylContact O-C 3.36Å; R655-S658 PolarHBondContact O-N 2.91Å; R655-F659 WeakPolarHBondContact O-CA 3.28Å; R655-F659 WeakPolarHBondContact O-CB 3.45Å; R655-F659 PolarHBondContact O-N 2.82Å
656	Y	71.4	Confident	64.1	Low	115 Å²	115	103.3 Å²	103.3	45%	0.451	53%	0.525	S	S	.	.	H	α-helix	trans	-68.5	-39.2	176.3	-175.6	-98.5	0	0	0	110.7	F652 F659 N660	F652-Y656 HydrophobicContact CE1-CD2 4.41Å; F652-Y656 HydrophobicContact CE1-CG 4.48Å; F652-Y656 HydrophobicContact CZ-CD2 4.38Å; F652-Y656 WeakPolarHBondContact O-CA 3.36Å; F652-Y656 WeakPolarHBondContact O-CB 3.43Å; F652-Y656 PolarHBondContact O-N 3.22Å; Y656-F659 PolarHBondContact O-N 3.44Å; Y656-N660 WeakPolarHBondContact CE1-ND2 3.27Å; Y656-N660 VanDerWaalsContact CZ-ND2 3.26Å; Y656-N660 WeakPolarHBondContact O-CA 3.48Å; Y656-N660 WeakPolarHBondContact O-CB 3.39Å; Y656-N660 PolarHBondContact O-N 3.46Å; Y656-N660 PolarHBondContact OH-ND2 3.4Å
657	R	61.7	Low	62.2	Low	147 Å²	147	102.6 Å²	102.6	56%	0.555	52%	0.518	S	S	*	.	H	α-helix	trans	-69.4	-39	170.2	-78.2	-175.6	95.5	177.7	8.6	112.4	Y653 W654 F659 N661	Y653-R657 HydrophobicContact CD1-CG 4.35Å; Y653-R657 HydrophobicContact CE1-CG 4.2Å; Y653-R657 VanDerWaalsContact O-CB 3.31Å; Y653-R657 WeakPolarHBondContact O-CB 3.11Å; Y653-R657 WeakPolarHBondContact O-CG 3.42Å; Y653-R657 PolarHBondContact O-N 2.86Å; W654-R657 PolarHBondContact O-N 2.88Å; R657-F659 VanDerWaalsContact C-N 3.3Å; R657-N661 VanDerWaalsContact O-CB 3.28Å; R657-N661 WeakPolarHBondContact O-CB 3.31Å; R657-N661 PolarHBondContact O-N 2.99Å
658	S	60.6	Low	60.4	Low	64 Å²	64	106.7 Å²	106.7	45%	0.448	52%	0.522	S	S	.	.	H	α-helix	trans	-67.1	-33.1	175.4	176.2	0	0	0	0	111.7	W654 R655 S662	W654-S658 WeakPolarHBondContact O-CB 3.36Å; W654-S658 PolarHBondContact O-N 2.84Å; R655-S658 CarbonylContact O-C 3.36Å; R655-S658 PolarHBondContact O-N 2.91Å; S658-S662 PolarHBondContact O-OG 3.39Å
659	F	48.5	Very low	58.7	Low	112 Å²	112	110.2 Å²	110.2	49%	0.491	54%	0.541	S	S	.	.	H	α-helix	trans	-85.7	-40.3	-180	-164.3	-104.8	0	0	0	111.5	R655 Y656 R657 S662 K663	R655-F659 WeakPolarHBondContact O-CA 3.28Å; R655-F659 WeakPolarHBondContact O-CB 3.45Å; R655-F659 PolarHBondContact O-N 2.82Å; Y656-F659 PolarHBondContact O-N 3.44Å; R657-F659 VanDerWaalsContact C-N 3.3Å; F659-S662 PolarHBondContact O-N 3.15Å; F659-S662 PolarHBondContact O-OG 3.39Å; F659-K663 HydrophobicContact CD1-CD 4.25Å; F659-K663 HydrophobicContact CE1-CD 3.51Å; F659-K663 HydrophobicContact CE2-CD 4.42Å; F659-K663 HydrophobicContact CZ-CD 3.62Å; F659-K663 VanDerWaalsContact O-CB 3.25Å; F659-K663 WeakPolarHBondContact O-CB 3.29Å; F659-K663 PolarHBondContact O-N 3.45Å
660	N	44.2	Very low	57.7	Low	48 Å²	48	113.3 Å²	113.3	26%	0.257	55%	0.548	S	S	.	.	H	α-helix	trans	-63.5	-46.1	171.3	-92.9	6.9	0	0	0	110.7	Y656 S662 K663 L664	Y656-N660 WeakPolarHBondContact CE1-ND2 3.27Å; Y656-N660 VanDerWaalsContact CZ-ND2 3.26Å; Y656-N660 WeakPolarHBondContact O-CA 3.48Å; Y656-N660 WeakPolarHBondContact O-CB 3.39Å; Y656-N660 PolarHBondContact O-N 3.46Å; Y656-N660 PolarHBondContact OH-ND2 3.4Å; N660-S662 PolarHBondContact O-N 3.34Å; N660-S662 VanDerWaalsContact O-N 3.15Å; N660-K663 PolarHBondContact O-N 3.21Å; N660-L664 VanDerWaalsContact O-CB 3.23Å; N660-L664 WeakPolarHBondContact O-CB 3.36Å; N660-L664 PolarHBondContact O-N 3.17Å
661	N	43.4	Very low	57.1	Low	127 Å²	127	113 Å²	113	68%	0.679	53%	0.534	S	S	*	.	H	α-helix	trans	-67.2	-19.8	-179.5	-78.7	4.7	0	0	0	113.8	R657	R657-N661 VanDerWaalsContact O-CB 3.28Å; R657-N661 WeakPolarHBondContact O-CB 3.31Å; R657-N661 PolarHBondContact O-N 2.99Å
662	S	41.6	Very low	56.7	Low	68 Å²	68	108.1 Å²	108.1	48%	0.476	53%	0.526	S	S	.	.	H	α-helix	trans	-97.4	-24.3	176.9	52.1	0	0	0	0	114.1	S658 F659 N660	S658-S662 PolarHBondContact O-OG 3.39Å; F659-S662 PolarHBondContact O-N 3.15Å; F659-S662 PolarHBondContact O-OG 3.39Å; N660-S662 PolarHBondContact O-N 3.34Å; N660-S662 VanDerWaalsContact O-N 3.15Å
663	K	38.6	Very low	56.8	Low	125 Å²	125	104.7 Å²	104.7	54%	0.543	51%	0.513	S	S	.	.	H	α-helix	trans	-99.7	-26.3	-179.9	-136.6	179.6	-172.9	-170.9	0	113.9	F659 N660 S665	F659-K663 HydrophobicContact CD1-CD 4.25Å; F659-K663 HydrophobicContact CE1-CD 3.51Å; F659-K663 HydrophobicContact CE2-CD 4.42Å; F659-K663 HydrophobicContact CZ-CD 3.62Å; F659-K663 VanDerWaalsContact O-CB 3.25Å; F659-K663 WeakPolarHBondContact O-CB 3.29Å; F659-K663 PolarHBondContact O-N 3.45Å; N660-K663 PolarHBondContact O-N 3.21Å; K663-S665 VanDerWaalsContact C-N 3.29Å; K663-S665 PolarHBondContact O-N 3.17Å
664	L	41.4	Very low	57.1	Low	94 Å²	94	101.1 Å²	101.1	49%	0.492	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.4	178.5	-127.1	83.9	0	0	0	113.2	N660 R668	N660-L664 VanDerWaalsContact O-CB 3.23Å; N660-L664 WeakPolarHBondContact O-CB 3.36Å; N660-L664 PolarHBondContact O-N 3.17Å; L664-R668 WeakPolarHBondContact O-CD 3.48Å; L664-R668 VanDerWaalsContact O-CG 3.31Å; L664-R668 WeakPolarHBondContact O-CG 3.44Å; L664-R668 PolarHBondContact O-NE 3.39Å; L664-R668 VanDerWaalsContact O-NE 3.07Å
665	S	38.7	Very low	57.4	Low	87 Å²	87	95.2 Å²	95.2	61%	0.608	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-22.4	-178.6	56.1	0	0	0	0	113.7	K663	K663-S665 VanDerWaalsContact C-N 3.29Å; K663-S665 PolarHBondContact O-N 3.17Å
666	A	43.8	Very low	58	Low	74 Å²	74	90.1 Å²	90.1	61%	0.612	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-17.7	-171.1	0	0	0	0	0	115.2
667	D	45.5	Very low	58.5	Low	83 Å²	83	86.6 Å²	86.6	44%	0.444	46%	0.464	S	S	.	.	S	Bend	trans	-114.9	10.6	-174.9	-134.7	11.5	0	0	0	113.9	S669 H766	D667-S669 VanDerWaalsContact C-N 3.35Å; D667-S669 PolarHBondContact O-N 3.32Å; D667-H766 IonicContact OD1-CE1 3Å; D667-H766 IonicContact OD1-NE2 3.65Å; D667-H766 IonicContact OD2-CE1 3.76Å
668	R	48.4	Very low	59.3	Low	142 Å²	142	89.2 Å²	89.2	54%	0.536	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-10.7	-175.2	-84.6	-179.7	173.4	-170	-4.5	115.2	L664 Y684	L664-R668 WeakPolarHBondContact O-CD 3.48Å; L664-R668 VanDerWaalsContact O-CG 3.31Å; L664-R668 WeakPolarHBondContact O-CG 3.44Å; L664-R668 PolarHBondContact O-NE 3.39Å; L664-R668 VanDerWaalsContact O-NE 3.07Å; R668-Y684 HydrophobicContact CB-CE1 4.36Å; R668-Y684 HydrophobicContact CG-CE1 4.34Å; R668-Y684 WeakPolarHBondContact O-CE1 3.42Å; R668-Y684 PolarHBondContact O-OH 2.82Å
669	S	47.8	Very low	60.2	Low	107 Å²	107	88.2 Å²	88.2	75%	0.748	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	16.4	-165.8	57.9	0	0	0	0	116.9	D667	D667-S669 VanDerWaalsContact C-N 3.35Å; D667-S669 PolarHBondContact O-N 3.32Å
670	K	64.4	Low	61.5	Low	149 Å²	149	86.1 Å²	86.1	65%	0.648	47%	0.468	S	S	*	.			trans	-126.5	1.1	-174	-79.6	-175.2	179.2	178.3	0	117.6	S672 H766	K670-S672 PolarHBondContact O-N 3.4Å; K670-H766 WeakPolarHBondContact CB-NE2 3.47Å; K670-H766 PolarHBondContact O-CD2 3.01Å
671	W	69.2	Low	63.2	Low	49 Å²	49	84.6 Å²	84.6	19%	0.186	46%	0.46	C	S	.	.			trans	-68.3	123.8	175.2	-73.6	80.8	0	0	0	110.2	L687 C764 H766 T769 L771	W671-L687 HydrophobicContact CD2-CD1 4.28Å; W671-L687 HydrophobicContact CH2-CD2 3.69Å; W671-L687 HydrophobicContact CZ2-CD1 4.11Å; W671-L687 HydrophobicContact CZ2-CD2 3.59Å; W671-L687 HydrophobicContact CZ3-CD2 4.24Å; W671-C764 HydrophobicContact CE3-CB 3.89Å; W671-C764 HydrophobicContact CZ3-CB 4.21Å; W671-H766 HydrophobicContact CD2-CB 3.26Å; W671-H766 AromaticContact CD2-CG 3.93Å; W671-H766 AromaticContact CE2-CG 3.71Å; W671-H766 AromaticContact CE2-ND1 3.8Å; W671-H766 HydrophobicContact CE3-CB 3.4Å; W671-H766 VanDerWaalsContact CE3-CB 3.4Å; W671-H766 HydrophobicContact CG-CB 3.78Å; W671-H766 HydrophobicContact CH2-CB 3.86Å; W671-H766 HydrophobicContact CZ2-CB 3.72Å; W671-H766 AromaticContact CZ2-ND1 3.99Å; W671-H766 HydrophobicContact CZ3-CB 3.7Å; W671-H766 AromaticContact NE1-CG 3.76Å; W671-H766 AromaticContact NE1-ND1 3.72Å; W671-T769 HydrophobicContact CH2-CG2 3.97Å; W671-L771 HydrophobicContact CH2-CD1 4.11Å; W671-L771 HydrophobicContact CZ3-CD1 3.78Å; W671-L771 HydrophobicContact CZ3-CG 4.12Å
672	S	76.3	Confident	64.7	Low	64 Å²	64	80.6 Å²	80.6	45%	0.448	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	114.5	170.9	-178.9	0	0	0	0	108.5	K670 C764 T765	K670-S672 PolarHBondContact O-N 3.4Å; S672-C764 WeakPolarHBondContact O-CA 3.38Å; S672-T765 PolarHBondContact N-O 2.88Å; S672-T765 PolarHBondContact O-N 2.93Å
673	L	82.3	Confident	66.1	Low	55 Å²	55	79.5 Å²	79.5	29%	0.288	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.3	175.8	-178.5	71.8	0	0	0	109.3	L679 E683 C762 C764	L673-L679 HydrophobicContact CD1-CD1 4.46Å; L673-L679 HydrophobicContact CD2-CD1 3.77Å; L673-L679 HydrophobicContact CG-CD1 4.38Å; L673-E683 HydrophobicContact CD1-CB 4.38Å; L673-C762 HydrophobicContact CD1-CB 3.82Å; L673-C764 WeakPolarHBondContact CD1-SG 3.26Å
674	T	84	Confident	67.7	Low	65 Å²	65	78 Å²	78	40%	0.399	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	111.9	168.7	-54.6	0	0	0	0	108.5	F676 C762 S763	T674-F676 HydrophobicContact CG2-CE1 3.76Å; T674-F676 HydrophobicContact CG2-CZ 3.69Å; T674-C762 CarbonylContact O-C 3.59Å; T674-C762 WeakPolarHBondContact O-CA 3.21Å; T674-C762 VanDerWaalsContact O-CB 3.26Å; T674-C762 WeakPolarHBondContact O-CB 3.18Å; T674-S763 PolarHBondContact N-O 2.82Å; T674-S763 PolarHBondContact O-N 2.73Å
675	S	82.6	Confident	69.4	Low	71 Å²	71	75.7 Å²	75.7	50%	0.497	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	131.7	178.8	63.5	0	0	0	0	111.4
676	F	84.8	Confident	71.5	Confident	46 Å²	46	71.5 Å²	71.5	20%	0.202	38%	0.378	C	S	.	.	S	Bend	trans	-102.7	-12.9	173.9	-51.4	-72.6	0	0	0	112.2	T674 V746 G750 R753 L760 W761	T674-F676 HydrophobicContact CG2-CE1 3.76Å; T674-F676 HydrophobicContact CG2-CZ 3.69Å; F676-V746 HydrophobicContact CE1-CG1 4.22Å; F676-V746 HydrophobicContact CZ-CG1 3.68Å; F676-G750 VanDerWaalsContact CD1-CA 3.47Å; F676-R753 PolarHBondContact O-NH2 3.29Å; F676-L760 HydrophobicContact CD2-CD2 3.75Å; F676-L760 HydrophobicContact CD2-CG 3.85Å; F676-L760 HydrophobicContact CE2-CD2 3.55Å; F676-L760 HydrophobicContact CE2-CG 4.04Å; F676-L760 HydrophobicContact CZ-CD2 4.37Å; F676-W761 PolarHBondContact N-O 2.83Å
677	H	80.8	Confident	73.1	Confident	42 Å²	42	70.3 Å²	70.3	19%	0.194	36%	0.361	C	S	.	.	S	Bend	trans	-133.3	164.3	177.2	-68.5	88.1	0	0	0	110.2	L679 R753 L760 W761	H677-L679 PolarHBondContact O-N 3.4Å; H677-L679 VanDerWaalsContact O-N 3.15Å; H677-R753 PolarHBondContact CE1-NE 3.28Å; H677-R753 PolarHBondContact CE1-NH1 2.82Å; H677-R753 PolarHBondContact CE1-NH2 2.89Å; H677-R753 WeakPolarHBondContact NE2-CD 3.49Å; H677-R753 VanDerWaalsContact NE2-CZ 3.34Å; H677-R753 PolarHBondContact NE2-NE 3.46Å; H677-L760 PolarHBondContact CE1-O 3.38Å; H677-L760 VanDerWaalsContact CE1-O 3.31Å; H677-L760 PolarHBondContact ND1-O 2.92Å; H677-W761 HydrophobicContact CB-CD2 4.43Å; H677-W761 HydrophobicContact CB-CE3 3.55Å; H677-W761 HydrophobicContact CB-CZ3 3.87Å; H677-W761 PolarHBondContact N-O 2.92Å
678	K	78.6	Confident	74.6	Confident	201 Å²	201	73.2 Å²	73.2	87%	0.874	38%	0.377	S	S	*	.			trans	-65.2	114.7	171.6	-173.7	179.8	-179.1	-177.3	0	108.6
679	L	79.7	Confident	76.1	Confident	43 Å²	43	67.5 Å²	67.5	23%	0.225	36%	0.358	C	S	.	.			trans	-86.7	136.9	-179.8	-56.8	176.4	0	0	0	110.5	L673 H677 F681 W761 C762	L673-L679 HydrophobicContact CD1-CD1 4.46Å; L673-L679 HydrophobicContact CD2-CD1 3.77Å; L673-L679 HydrophobicContact CG-CD1 4.38Å; H677-L679 PolarHBondContact O-N 3.4Å; H677-L679 VanDerWaalsContact O-N 3.15Å; L679-F681 HydrophobicContact CD2-CE1 4.03Å; L679-F681 HydrophobicContact CD2-CE2 4.22Å; L679-F681 HydrophobicContact CD2-CZ 3.68Å; L679-W761 HydrophobicContact CD2-CB 4.1Å; L679-W761 HydrophobicContact CD2-CE3 4.24Å; L679-C762 HydrophobicContact CD1-CB 3.98Å; L679-C762 HydrophobicContact CD2-CB 4.15Å
680	S	76.1	Confident	77.7	Confident	69 Å²	69	64.1 Å²	64.1	48%	0.483	33%	0.331	S	S	.	.	S	Bend	trans	-96.9	-8.2	173.8	49.8	0	0	0	0	112.6	N711 E713	S680-N711 WeakPolarHBondContact CB-ND2 3.34Å; S680-N711 PolarHBondContact OG-ND2 3.22Å; S680-N711 VanDerWaalsContact OG-ND2 3.12Å; S680-E713 PolarHBondContact OG-OE2 2.78Å
681	F	79.3	Confident	78.4	Confident	16 Å²	16	61.2 Å²	61.2	7%	0.07	32%	0.323	C	S	.	.	S	Bend	trans	-128.3	160.2	-172.7	57.5	-94.2	0	0	0	111.3	L679 I686 L709 V715 W761 V773	L679-F681 HydrophobicContact CD2-CE1 4.03Å; L679-F681 HydrophobicContact CD2-CE2 4.22Å; L679-F681 HydrophobicContact CD2-CZ 3.68Å; F681-I686 HydrophobicContact CD2-CD1 4.01Å; F681-I686 HydrophobicContact CD2-CG1 4.28Å; F681-I686 HydrophobicContact CE2-CD1 3.47Å; F681-I686 VanDerWaalsContact CE2-CD1 3.47Å; F681-I686 HydrophobicContact CE2-CG1 4.21Å; F681-I686 HydrophobicContact CZ-CD1 4.29Å; F681-L709 HydrophobicContact CB-CD1 3.94Å; F681-L709 HydrophobicContact CB-CD2 4.05Å; F681-L709 HydrophobicContact CB-CG 4.44Å; F681-L709 HydrophobicContact CD1-CD1 3.23Å; F681-L709 HydrophobicContact CD1-CG 4.45Å; F681-L709 HydrophobicContact CD2-CD1 4.39Å; F681-L709 HydrophobicContact CD2-CD2 4.29Å; F681-L709 HydrophobicContact CE1-CD1 3.72Å; F681-L709 HydrophobicContact CG-CD1 3.59Å; F681-L709 HydrophobicContact CG-CD2 4.03Å; F681-L709 HydrophobicContact CG-CG 4.41Å; F681-L709 HydrophobicContact CZ-CD1 4.49Å; F681-V715 HydrophobicContact CE1-CG1 4.44Å; F681-W761 HydrophobicContact CZ-CB 4.48Å; F681-V773 HydrophobicContact CZ-CG1 4.28Å
682	S	75.6	Confident	79.1	Confident	43 Å²	43	64.2 Å²	64.2	30%	0.301	34%	0.339	S	S	.	.			trans	-94.1	155.8	172.9	68.8	0	0	0	0	112.5	Y684 E685	S682-Y684 PolarHBondContact O-N 3.38Å; S682-Y684 VanDerWaalsContact O-N 3.11Å; S682-E685 PolarHBondContact N-OE1 3.43Å; S682-E685 PolarHBondContact O-N 3.38Å; S682-E685 PolarHBondContact OG-OE1 3.36Å
683	E	70.6	Confident	79.3	Confident	44 Å²	44	68.4 Å²	68.4	21%	0.206	36%	0.356	C	S	.	.	H	α-helix	trans	-57.7	-24.1	176.3	60.5	-89	-153.5	0	0	113.6	L673 I686	L673-E683 HydrophobicContact CD1-CB 4.38Å; E683-I686 PolarHBondContact O-N 2.89Å
684	Y	71.7	Confident	79.6	Confident	94 Å²	94	68.7 Å²	68.7	37%	0.369	36%	0.358	S	S	.	.	H	α-helix	trans	-71.7	-35	179.8	-58.2	-74.3	0	0	0	112.8	R668 S682 I686 L687 D688	R668-Y684 HydrophobicContact CB-CE1 4.36Å; R668-Y684 HydrophobicContact CG-CE1 4.34Å; R668-Y684 WeakPolarHBondContact O-CE1 3.42Å; R668-Y684 PolarHBondContact O-OH 2.82Å; S682-Y684 PolarHBondContact O-N 3.38Å; S682-Y684 VanDerWaalsContact O-N 3.11Å; Y684-I686 PolarHBondContact O-N 3.16Å; Y684-L687 PolarHBondContact O-N 3.42Å; Y684-D688 PolarHBondContact O-N 3.38Å
685	E	78.4	Confident	79.8	Confident	45 Å²	45	67.7 Å²	67.7	21%	0.21	35%	0.352	C	S	.	.	H	α-helix	trans	-62.6	-31.1	177.8	-69.6	172.2	-111.8	0	0	112	S682 C689 L709 S710	S682-E685 PolarHBondContact N-OE1 3.43Å; S682-E685 PolarHBondContact O-N 3.38Å; S682-E685 PolarHBondContact OG-OE1 3.36Å; E685-C689 PolarHBondContact O-SG 2.73Å; E685-L709 HydrophobicContact CB-CD2 4.09Å; E685-S710 VanDerWaalsContact OE2-CB 3.3Å; E685-S710 WeakPolarHBondContact OE2-CB 3.44Å; E685-S710 PolarHBondContact OE2-N 3.25Å; E685-S710 VanDerWaalsContact OE2-N 3.17Å; E685-S710 PolarHBondContact OE2-OG 3.26Å
686	I	81.7	Confident	80	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-71.1	-43.9	177.7	-67.9	-177.5	0	0	0	111.2	F681 E683 Y684 D688 C689 L709 V717 L771 V773	F681-I686 HydrophobicContact CD2-CD1 4.01Å; F681-I686 HydrophobicContact CD2-CG1 4.28Å; F681-I686 HydrophobicContact CE2-CD1 3.47Å; F681-I686 VanDerWaalsContact CE2-CD1 3.47Å; F681-I686 HydrophobicContact CE2-CG1 4.21Å; F681-I686 HydrophobicContact CZ-CD1 4.29Å; E683-I686 PolarHBondContact O-N 2.89Å; Y684-I686 PolarHBondContact O-N 3.16Å; I686-D688 VanDerWaalsContact C-N 3.32Å; I686-D688 PolarHBondContact O-N 3.07Å; I686-C689 PolarHBondContact O-N 2.75Å; I686-C689 VanDerWaalsContact O-N 3.1Å; I686-L709 HydrophobicContact CG1-CD2 4.27Å; I686-V717 HydrophobicContact CG2-CB 4.42Å; I686-V717 HydrophobicContact CG2-CG1 3.77Å; I686-V717 HydrophobicContact CG2-CG2 3.82Å; I686-L771 HydrophobicContact CG2-CD1 4.49Å; I686-V773 HydrophobicContact CD1-CB 4.33Å; I686-V773 HydrophobicContact CD1-CG1 3.85Å; I686-V773 HydrophobicContact CD1-CG2 3.57Å
687	L	78.3	Confident	79.9	Confident	49 Å²	49	67.6 Å²	67.6	26%	0.257	35%	0.354	S	S	.	.	H	α-helix	trans	-64.2	-37.5	-175.3	-68.1	173.8	0	0	0	112.2	W671 Y684 C689 L690 L771	W671-L687 HydrophobicContact CD2-CD1 4.28Å; W671-L687 HydrophobicContact CH2-CD2 3.69Å; W671-L687 HydrophobicContact CZ2-CD1 4.11Å; W671-L687 HydrophobicContact CZ2-CD2 3.59Å; W671-L687 HydrophobicContact CZ3-CD2 4.24Å; Y684-L687 PolarHBondContact O-N 3.42Å; L687-C689 PolarHBondContact O-N 3.48Å; L687-L690 HydrophobicContact CD2-CD1 3.93Å; L687-L690 PolarHBondContact O-N 2.93Å; L687-L771 HydrophobicContact CD2-CD1 3.98Å
688	D	76.5	Confident	79.8	Confident	144 Å²	144	69.7 Å²	69.7	77%	0.77	37%	0.373	S	S	*	.	H	α-helix	trans	-66	-21.5	177.1	-71.2	-15.2	0	0	0	112.3	Y684 I686	Y684-D688 PolarHBondContact O-N 3.38Å; I686-D688 VanDerWaalsContact C-N 3.32Å; I686-D688 PolarHBondContact O-N 3.07Å
689	C	79.1	Confident	79.5	Confident	21 Å²	21	62 Å²	62	14%	0.142	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.8	178.5	-63.2	0	0	0	0	114.2	E685 I686 L687 D691 N694 A707	E685-C689 PolarHBondContact O-SG 2.73Å; I686-C689 PolarHBondContact O-N 2.75Å; I686-C689 VanDerWaalsContact O-N 3.1Å; L687-C689 PolarHBondContact O-N 3.48Å; C689-D691 PolarHBondContact O-N 3.12Å; C689-N694 PolarHBondContact O-ND2 2.77Å; C689-A707 HydrophobicContact CB-CB 3.49Å; C689-A707 VanDerWaalsContact CB-CB 3.49Å
690	L	81.6	Confident	78.9	Confident	36 Å²	36	65 Å²	65	19%	0.188	38%	0.382	C	S	.	.			trans	-78.7	52.7	-178.4	-62.9	179.8	0	0	0	112.6	L687 Y705 V717 L771	L687-L690 HydrophobicContact CD2-CD1 3.93Å; L687-L690 PolarHBondContact O-N 2.93Å; L690-Y705 HydrophobicContact CD2-CD1 4.32Å; L690-Y705 HydrophobicContact CD2-CD2 3.66Å; L690-Y705 HydrophobicContact CD2-CE2 4.18Å; L690-Y705 HydrophobicContact CD2-CG 3.77Å; L690-V717 HydrophobicContact CD2-CB 4.22Å; L690-V717 HydrophobicContact CD2-CG1 3.82Å; L690-L771 HydrophobicContact CD1-CD1 3.92Å; L690-L771 HydrophobicContact CD1-CD2 4.16Å
691	D	80.3	Confident	78.8	Confident	89 Å²	89	63.5 Å²	63.5	48%	0.476	37%	0.371	S	S	.	.			trans	-97.7	151.6	174.8	-155.2	-34	0	0	0	110.7	C689 D693 N694 Y705	C689-D691 PolarHBondContact O-N 3.12Å; D691-D693 PolarHBondContact O-N 2.9Å; D691-N694 PolarHBondContact O-N 2.85Å; D691-Y705 WeakPolarHBondContact O-CD1 3.35Å; D691-Y705 VanDerWaalsContact O-CE1 3.31Å; D691-Y705 WeakPolarHBondContact O-CE1 3.18Å
692	E	82.4	Confident	78.9	Confident	112 Å²	112	62.8 Å²	62.8	52%	0.523	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-60.2	-33.1	178.3	-70.2	-67.2	156	0	0	112.2	N694 V695 K703	E692-N694 PolarHBondContact O-N 3.25Å; E692-N694 VanDerWaalsContact O-N 3.15Å; E692-V695 WeakPolarHBondContact O-CB 3.46Å; E692-V695 WeakPolarHBondContact O-CG2 3.3Å; E692-V695 PolarHBondContact O-N 2.84Å; E692-V695 VanDerWaalsContact O-N 3.11Å; E692-K703 IonicContact OE1-NZ 2.69Å; E692-K703 PolarHBondContact OE1-NZ 2.73Å; E692-K703 IonicContact OE2-NZ 2.94Å; E692-K703 PolarHBondContact OE2-NZ 3.22Å
693	D	82.1	Confident	79.5	Confident	151 Å²	151	62.8 Å²	62.8	81%	0.807	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-63	-20.6	176.6	-71.8	-20.4	0	0	0	113.1	D691	D691-D693 PolarHBondContact O-N 2.9Å
694	N	87.2	Confident	80.5	Confident	61 Å²	61	62.4 Å²	62.4	33%	0.326	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-95	1.2	179.9	-68.1	-33	0	0	0	113.2	C689 D691 E692 I696 Y705 K706	C689-N694 PolarHBondContact O-ND2 2.77Å; D691-N694 PolarHBondContact O-N 2.85Å; E692-N694 PolarHBondContact O-N 3.25Å; E692-N694 VanDerWaalsContact O-N 3.15Å; N694-I696 PolarHBondContact O-N 3.5Å; N694-Y705 HydrophobicContact CB-CD1 4.46Å; N694-Y705 CarbonylContact O-C 3.54Å; N694-Y705 VanDerWaalsContact O-CA 3.28Å; N694-Y705 WeakPolarHBondContact O-CA 3.45Å; N694-K706 WeakPolarHBondContact CB-O 3.27Å; N694-K706 PolarHBondContact O-N 2.8Å
695	V	88.5	Confident	81.5	Confident	45 Å²	45	58.3 Å²	58.3	27%	0.273	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	120.7	-179.6	176.6	0	0	0	0	110.1	E692 K703 V704 Y705	E692-V695 WeakPolarHBondContact O-CB 3.46Å; E692-V695 WeakPolarHBondContact O-CG2 3.3Å; E692-V695 PolarHBondContact O-N 2.84Å; E692-V695 VanDerWaalsContact O-N 3.11Å; V695-K703 HydrophobicContact CG2-CD 4.24Å; V695-V704 WeakPolarHBondContact CA-O 3.48Å; V695-Y705 HydrophobicContact CG2-CD1 3.68Å; V695-Y705 HydrophobicContact CG2-CE1 3.37Å; V695-Y705 HydrophobicContact CG2-CG 4.49Å
696	I	86.7	Confident	82.2	Confident	87 Å²	87	59.5 Å²	59.5	45%	0.446	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	-13.1	176.1	57.8	172	0	0	0	113	N694 V704 K706 A716 Y776	N694-I696 PolarHBondContact O-N 3.5Å; I696-V704 HydrophobicContact CD1-CG1 3.93Å; I696-V704 HydrophobicContact CG1-CB 4.17Å; I696-V704 HydrophobicContact CG1-CG1 3.88Å; I696-V704 WeakPolarHBondContact CG1-O 3.27Å; I696-V704 PolarHBondContact N-O 2.58Å; I696-K706 HydrophobicContact CD1-CB 4.29Å; I696-K706 HydrophobicContact CG2-CB 3.63Å; I696-K706 HydrophobicContact CG2-CD 4.5Å; I696-A716 HydrophobicContact CD1-CB 4.45Å; I696-Y776 HydrophobicContact CD1-CD2 4.13Å; I696-Y776 HydrophobicContact CD1-CE2 3.8Å
697	G	82.3	Confident	82.6	Confident	28 Å²	28	59.6 Å²	59.6	29%	0.289	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165	153.3	177.6	0	0	0	0	0	112.3	V704	G697-V704 PolarHBondContact N-O 2.91Å; G697-V704 PolarHBondContact O-N 2.79Å
698	S	80.4	Confident	83.1	Confident	86 Å²	86	61.4 Å²	61.4	60%	0.601	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.6	134.1	176.1	-179.1	0	0	0	0	109.3
699	G	71.3	Confident	83.6	Confident	38 Å²	38	54.8 Å²	54.8	39%	0.392	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	-173.7	-177.3	0	0	0	0	0	113.3	S701 G702 W721	G699-S701 PolarHBondContact O-N 2.79Å; G699-G702 PolarHBondContact N-O 2.99Å; G699-G702 PolarHBondContact O-N 3.34Å; G699-G702 VanDerWaalsContact O-N 3.13Å; G699-W721 PolarHBondContact O-NE1 3.48Å
700	A	66.9	Low	83.7	Confident	108 Å²	108	58.8 Å²	58.8	89%	0.893	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-29.4	-174.8	0	0	0	0	0	113.7
701	S	73.3	Confident	83.8	Confident	36 Å²	36	60.6 Å²	60.6	25%	0.252	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-22.4	179.1	51.6	0	0	0	0	113.6	G699 K718 L720 W721	G699-S701 PolarHBondContact O-N 2.79Å; S701-K718 WeakPolarHBondContact OG-CE 3.21Å; S701-L720 VanDerWaalsContact O-CA 3.26Å; S701-L720 WeakPolarHBondContact O-CA 3.48Å; S701-L720 VanDerWaalsContact O-CD2 3.24Å; S701-L720 WeakPolarHBondContact O-CD2 3.06Å; S701-W721 VanDerWaalsContact C-CD1 3.45Å; S701-W721 PolarHBondContact O-N 3.01Å
702	G	82.6	Confident	83.9	Confident	2 Å²	2	59 Å²	59	2%	0.021	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.2	-167.5	-175.5	0	0	0	0	0	115	G699 K719	G699-G702 PolarHBondContact N-O 2.99Å; G699-G702 PolarHBondContact O-N 3.34Å; G699-G702 VanDerWaalsContact O-N 3.13Å; G702-K719 CarbonylContact C-O 3.58Å; G702-K719 WeakPolarHBondContact CA-O 3.31Å
703	K	88.3	Confident	84.1	Confident	42 Å²	42	57.5 Å²	57.5	18%	0.183	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	144.5	173	-71.9	-174.5	178	-172.1	0	110.6	E692 V695 Y705 K718 K719 W721	E692-K703 IonicContact OE1-NZ 2.69Å; E692-K703 PolarHBondContact OE1-NZ 2.73Å; E692-K703 IonicContact OE2-NZ 2.94Å; E692-K703 PolarHBondContact OE2-NZ 3.22Å; V695-K703 HydrophobicContact CG2-CD 4.24Å; K703-Y705 HydrophobicContact CB-CD2 4.42Å; K703-Y705 HydrophobicContact CB-CE2 3.55Å; K703-Y705 WeakPolarHBondContact CD-OH 3.3Å; K703-K718 CarbonylContact O-C 3.21Å; K703-K718 WeakPolarHBondContact O-CA 3.35Å; K703-K719 PolarHBondContact N-O 3.42Å; K703-K719 PolarHBondContact O-N 2.98Å; K703-W721 HydrophobicContact CG-CH2 4.43Å
704	V	90.6	Very high	84.6	Confident	37 Å²	37	52.6 Å²	52.6	22%	0.224	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128	175.2	-171.8	0	0	0	0	109.1	V695 I696 G697 A716 V717 K718	V695-V704 WeakPolarHBondContact CA-O 3.48Å; I696-V704 HydrophobicContact CD1-CG1 3.93Å; I696-V704 HydrophobicContact CG1-CB 4.17Å; I696-V704 HydrophobicContact CG1-CG1 3.88Å; I696-V704 WeakPolarHBondContact CG1-O 3.27Å; I696-V704 PolarHBondContact N-O 2.58Å; G697-V704 PolarHBondContact N-O 2.91Å; G697-V704 PolarHBondContact O-N 2.79Å; V704-A716 HydrophobicContact CG1-CB 4.17Å; V704-V717 CarbonylContact C-O 3.57Å; V704-V717 VanDerWaalsContact CA-O 3.31Å; V704-V717 WeakPolarHBondContact CA-O 3.49Å; V704-K718 HydrophobicContact CG2-CB 4.17Å; V704-K718 HydrophobicContact CG2-CG 4.05Å
705	Y	92.4	Very high	84.8	Confident	8 Å²	8	49.9 Å²	49.9	3%	0.031	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144	-178.1	-57.4	-103.2	0	0	0	109.8	L690 D691 N694 V695 K703 A716 V717 K719	L690-Y705 HydrophobicContact CD2-CD1 4.32Å; L690-Y705 HydrophobicContact CD2-CD2 3.66Å; L690-Y705 HydrophobicContact CD2-CE2 4.18Å; L690-Y705 HydrophobicContact CD2-CG 3.77Å; D691-Y705 WeakPolarHBondContact O-CD1 3.35Å; D691-Y705 VanDerWaalsContact O-CE1 3.31Å; D691-Y705 WeakPolarHBondContact O-CE1 3.18Å; N694-Y705 HydrophobicContact CB-CD1 4.46Å; N694-Y705 CarbonylContact O-C 3.54Å; N694-Y705 VanDerWaalsContact O-CA 3.28Å; N694-Y705 WeakPolarHBondContact O-CA 3.45Å; V695-Y705 HydrophobicContact CG2-CD1 3.68Å; V695-Y705 HydrophobicContact CG2-CE1 3.37Å; V695-Y705 HydrophobicContact CG2-CG 4.49Å; K703-Y705 HydrophobicContact CB-CD2 4.42Å; K703-Y705 HydrophobicContact CB-CE2 3.55Å; K703-Y705 WeakPolarHBondContact CD-OH 3.3Å; Y705-A716 CarbonylContact O-C 3.38Å; Y705-A716 WeakPolarHBondContact O-CA 3.49Å; Y705-V717 WeakPolarHBondContact CD2-O 3.27Å; Y705-V717 PolarHBondContact N-O 3.15Å; Y705-V717 PolarHBondContact O-N 3.47Å; Y705-K719 HydrophobicContact CD2-CB 4.4Å; Y705-K719 HydrophobicContact CE2-CB 3.81Å; Y705-K719 HydrophobicContact CE2-CD 4.31Å
706	K	93	Very high	85.1	Confident	70 Å²	70	48.2 Å²	48.2	30%	0.304	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	114.2	166.6	-179.8	-177.7	-176.7	174.3	0	108.6	N694 I696 V714 Y776	N694-K706 WeakPolarHBondContact CB-O 3.27Å; N694-K706 PolarHBondContact O-N 2.8Å; I696-K706 HydrophobicContact CD1-CB 4.29Å; I696-K706 HydrophobicContact CG2-CB 3.63Å; I696-K706 HydrophobicContact CG2-CD 4.5Å; K706-V714 HydrophobicContact CD-CG1 4.28Å; K706-V714 HydrophobicContact CG-CG1 3.66Å; K706-Y776 HydrophobicContact CB-CE2 4.28Å; K706-Y776 HydrophobicContact CD-CE1 4.37Å; K706-Y776 HydrophobicContact CD-CE2 3.9Å; K706-Y776 HydrophobicContact CG-CD2 4.2Å; K706-Y776 HydrophobicContact CG-CE2 3.88Å; K706-Y776 PolarHBondContact NZ-OH 2.89Å
707	A	91	Very high	85.4	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.008	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.6	175	0	0	0	0	0	109.7	C689 V714 V715 V717	C689-A707 HydrophobicContact CB-CB 3.49Å; C689-A707 VanDerWaalsContact CB-CB 3.49Å; A707-V714 WeakPolarHBondContact O-CA 3.42Å; A707-V715 HydrophobicContact CB-CG2 3.82Å; A707-V715 PolarHBondContact N-O 3.15Å; A707-V715 PolarHBondContact O-N 3.29Å; A707-V717 HydrophobicContact CB-CG2 3.89Å
708	V	89.1	Confident	85.8	Confident	87 Å²	87	43.4 Å²	43.4	53%	0.527	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	114.2	172.2	-176.8	0	0	0	0	107.2	V714	V708-V714 HydrophobicContact CG2-CG1 4.43Å; V708-V714 HydrophobicContact CG2-CG2 4.28Å
709	L	86.8	Confident	86.2	Confident	6 Å²	6	43 Å²	43	3%	0.031	27%	0.273	C	S	.	.			trans	-80.3	162.2	-175.9	-60.2	170.8	0	0	0	111	F681 E685 I686 N711 G712 E713 V715	F681-L709 HydrophobicContact CB-CD1 3.94Å; F681-L709 HydrophobicContact CB-CD2 4.05Å; F681-L709 HydrophobicContact CB-CG 4.44Å; F681-L709 HydrophobicContact CD1-CD1 3.23Å; F681-L709 HydrophobicContact CD1-CG 4.45Å; F681-L709 HydrophobicContact CD2-CD1 4.39Å; F681-L709 HydrophobicContact CD2-CD2 4.29Å; F681-L709 HydrophobicContact CE1-CD1 3.72Å; F681-L709 HydrophobicContact CG-CD1 3.59Å; F681-L709 HydrophobicContact CG-CD2 4.03Å; F681-L709 HydrophobicContact CG-CG 4.41Å; F681-L709 HydrophobicContact CZ-CD1 4.49Å; E685-L709 HydrophobicContact CB-CD2 4.09Å; I686-L709 HydrophobicContact CG1-CD2 4.27Å; L709-N711 VanDerWaalsContact CB-OD1 3.28Å; L709-N711 WeakPolarHBondContact CB-OD1 3.23Å; L709-N711 PolarHBondContact O-N 3.29Å; L709-N711 VanDerWaalsContact O-N 3.16Å; L709-G712 PolarHBondContact O-N 3.26Å; L709-E713 WeakPolarHBondContact CB-O 3.36Å; L709-E713 HydrophobicContact CD1-CB 4.09Å; L709-E713 PolarHBondContact N-O 3.06Å; L709-V715 HydrophobicContact CD1-CG1 3.79Å; L709-V715 HydrophobicContact CD1-CG2 4.2Å; L709-V715 HydrophobicContact CD2-CG2 4.3Å; L709-V715 HydrophobicContact CG-CG2 4.23Å
710	S	81.4	Confident	86.9	Confident	105 Å²	105	41.4 Å²	41.4	73%	0.734	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.4	-176.8	61.5	0	0	0	0	113.9	E685 G712	E685-S710 VanDerWaalsContact OE2-CB 3.3Å; E685-S710 WeakPolarHBondContact OE2-CB 3.44Å; E685-S710 PolarHBondContact OE2-N 3.25Å; E685-S710 VanDerWaalsContact OE2-N 3.17Å; E685-S710 PolarHBondContact OE2-OG 3.26Å; S710-G712 VanDerWaalsContact C-N 3.27Å; S710-G712 PolarHBondContact O-N 2.82Å
711	N	83.3	Confident	87.4	Confident	73 Å²	73	43 Å²	43	39%	0.39	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-1.2	176	67	-2.9	0	0	0	113.9	S680 L709 E713	S680-N711 WeakPolarHBondContact CB-ND2 3.34Å; S680-N711 PolarHBondContact OG-ND2 3.22Å; S680-N711 VanDerWaalsContact OG-ND2 3.12Å; L709-N711 VanDerWaalsContact CB-OD1 3.28Å; L709-N711 WeakPolarHBondContact CB-OD1 3.23Å; L709-N711 PolarHBondContact O-N 3.29Å; L709-N711 VanDerWaalsContact O-N 3.16Å; N711-E713 VanDerWaalsContact C-N 3.34Å; N711-E713 VanDerWaalsContact ND2-CD 3.3Å; N711-E713 PolarHBondContact ND2-OE2 2.93Å; N711-E713 VanDerWaalsContact OD1-CB 3.27Å; N711-E713 WeakPolarHBondContact OD1-CB 3.27Å; N711-E713 PolarHBondContact OD1-N 3.28Å
712	G	82.5	Confident	86.8	Confident	55 Å²	55	43.3 Å²	43.3	57%	0.567	25%	0.248	S	C	*	.	S	Bend	trans	86	-3.6	-176.9	0	0	0	0	0	114.9	L709 S710	L709-G712 PolarHBondContact O-N 3.26Å; S710-G712 VanDerWaalsContact C-N 3.27Å; S710-G712 PolarHBondContact O-N 2.82Å
713	E	87.6	Confident	85.3	Confident	81 Å²	81	48.4 Å²	48.4	38%	0.379	27%	0.274	S	S	.	.			trans	-69	146.4	172	-67.9	179.9	149.2	0	0	110.4	S680 L709 N711	S680-E713 PolarHBondContact OG-OE2 2.78Å; L709-E713 WeakPolarHBondContact CB-O 3.36Å; L709-E713 HydrophobicContact CD1-CB 4.09Å; L709-E713 PolarHBondContact N-O 3.06Å; N711-E713 VanDerWaalsContact C-N 3.34Å; N711-E713 VanDerWaalsContact ND2-CD 3.3Å; N711-E713 PolarHBondContact ND2-OE2 2.93Å; N711-E713 VanDerWaalsContact OD1-CB 3.27Å; N711-E713 WeakPolarHBondContact OD1-CB 3.27Å; N711-E713 PolarHBondContact OD1-N 3.28Å
714	V	91.2	Very high	83	Confident	49 Å²	49	55.5 Å²	55.5	30%	0.297	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.1	178.5	-170.3	0	0	0	0	108.8	K706 A707 V708 Y776	K706-V714 HydrophobicContact CD-CG1 4.28Å; K706-V714 HydrophobicContact CG-CG1 3.66Å; A707-V714 WeakPolarHBondContact O-CA 3.42Å; V708-V714 HydrophobicContact CG2-CG1 4.43Å; V708-V714 HydrophobicContact CG2-CG2 4.28Å; V714-Y776 HydrophobicContact CB-CD1 3.97Å; V714-Y776 HydrophobicContact CB-CG 4.2Å; V714-Y776 HydrophobicContact CG1-CD1 3.5Å; V714-Y776 HydrophobicContact CG1-CD2 4.16Å; V714-Y776 HydrophobicContact CG1-CE1 4.06Å; V714-Y776 HydrophobicContact CG1-CG 3.54Å; V714-Y776 WeakPolarHBondContact O-CB 3.41Å
715	V	92.7	Very high	80.2	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.018	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152.2	178.8	-61	0	0	0	0	110.8	F681 A707 L709 V717 V773 Y774	F681-V715 HydrophobicContact CE1-CG1 4.44Å; A707-V715 HydrophobicContact CB-CG2 3.82Å; A707-V715 PolarHBondContact N-O 3.15Å; A707-V715 PolarHBondContact O-N 3.29Å; L709-V715 HydrophobicContact CD1-CG1 3.79Å; L709-V715 HydrophobicContact CD1-CG2 4.2Å; L709-V715 HydrophobicContact CD2-CG2 4.3Å; L709-V715 HydrophobicContact CG-CG2 4.23Å; V715-V717 HydrophobicContact CG2-CG2 4.05Å; V715-V773 HydrophobicContact CB-CG1 3.96Å; V715-V773 HydrophobicContact CG1-CG1 4.43Å; V715-V773 HydrophobicContact CG2-CG1 3.95Å; V715-Y774 WeakPolarHBondContact CA-O 3.46Å; V715-Y774 WeakPolarHBondContact CB-O 3.32Å
716	A	93.6	Very high	77.4	Confident	11 Å²	11	65.9 Å²	65.9	9%	0.091	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.6	173.2	0	0	0	0	0	109.2	I696 V704 Y705 Y774 Y776	I696-A716 HydrophobicContact CD1-CB 4.45Å; V704-A716 HydrophobicContact CG1-CB 4.17Å; Y705-A716 CarbonylContact O-C 3.38Å; Y705-A716 WeakPolarHBondContact O-CA 3.49Å; A716-Y774 PolarHBondContact N-O 3.3Å; A716-Y774 PolarHBondContact O-N 2.98Å; A716-Y776 HydrophobicContact CB-CD2 4.4Å
717	V	92.6	Very high	74.4	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	110.1	-174.2	-173.4	0	0	0	0	108.9	I686 L690 V704 Y705 A707 V715 L771 L772 V773	I686-V717 HydrophobicContact CG2-CB 4.42Å; I686-V717 HydrophobicContact CG2-CG1 3.77Å; I686-V717 HydrophobicContact CG2-CG2 3.82Å; L690-V717 HydrophobicContact CD2-CB 4.22Å; L690-V717 HydrophobicContact CD2-CG1 3.82Å; V704-V717 CarbonylContact C-O 3.57Å; V704-V717 VanDerWaalsContact CA-O 3.31Å; V704-V717 WeakPolarHBondContact CA-O 3.49Å; Y705-V717 WeakPolarHBondContact CD2-O 3.27Å; Y705-V717 PolarHBondContact N-O 3.15Å; Y705-V717 PolarHBondContact O-N 3.47Å; A707-V717 HydrophobicContact CB-CG2 3.89Å; V715-V717 HydrophobicContact CG2-CG2 4.05Å; V717-L771 HydrophobicContact CG1-CB 4.4Å; V717-L772 CarbonylContact C-O 3.14Å; V717-L772 WeakPolarHBondContact CA-O 3.49Å; V717-V773 HydrophobicContact CG1-CG2 4.4Å; V717-V773 HydrophobicContact CG2-CG1 4.42Å
718	K	92	Very high	71.4	Confident	13 Å²	13	76.1 Å²	76.1	6%	0.057	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	112.1	175.5	-172	177.5	-176.2	-177.5	0	109.1	S701 K703 V704 L720 E745 L771 L772 Y774 D843	S701-K718 WeakPolarHBondContact OG-CE 3.21Å; K703-K718 CarbonylContact O-C 3.21Å; K703-K718 WeakPolarHBondContact O-CA 3.35Å; V704-K718 HydrophobicContact CG2-CB 4.17Å; V704-K718 HydrophobicContact CG2-CG 4.05Å; K718-L720 HydrophobicContact CD-CD2 4.33Å; K718-L720 HydrophobicContact CG-CD2 4.2Å; K718-E745 IonicContact NZ-OE1 3.65Å; K718-E745 PolarHBondContact NZ-OE1 2.84Å; K718-L771 CarbonylContact O-C 3.24Å; K718-L771 WeakPolarHBondContact O-CA 3.17Å; K718-L772 HydrophobicContact CB-CB 4.37Å; K718-L772 PolarHBondContact N-O 2.92Å; K718-L772 PolarHBondContact O-N 3.4Å; K718-Y774 HydrophobicContact CB-CE2 3.73Å; K718-Y774 HydrophobicContact CD-CE2 4.2Å; K718-D843 IonicContact NZ-OD1 3.71Å; K718-D843 PolarHBondContact NZ-OD1 3.12Å
719	K	88.8	Confident	68.6	Low	77 Å²	77	77.4 Å²	77.4	34%	0.335	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	113.3	171.8	-178.9	176.6	-179.1	179.7	0	109.2	G702 K703 Y705 L771	G702-K719 CarbonylContact C-O 3.58Å; G702-K719 WeakPolarHBondContact CA-O 3.31Å; K703-K719 PolarHBondContact N-O 3.42Å; K703-K719 PolarHBondContact O-N 2.98Å; Y705-K719 HydrophobicContact CD2-CB 4.4Å; Y705-K719 HydrophobicContact CE2-CB 3.81Å; Y705-K719 HydrophobicContact CE2-CD 4.31Å; K719-L771 HydrophobicContact CB-CD2 3.56Å; K719-L771 HydrophobicContact CD-CD2 4.28Å; K719-L771 HydrophobicContact CG-CD2 3.6Å
720	L	84.3	Confident	65.9	Low	6 Å²	6	86.4 Å²	86.4	3%	0.031	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	148.5	177.6	-57.9	178.9	0	0	0	110.9	S701 K718 G722 F742 K770	S701-L720 VanDerWaalsContact O-CA 3.26Å; S701-L720 WeakPolarHBondContact O-CA 3.48Å; S701-L720 VanDerWaalsContact O-CD2 3.24Å; S701-L720 WeakPolarHBondContact O-CD2 3.06Å; K718-L720 HydrophobicContact CD-CD2 4.33Å; K718-L720 HydrophobicContact CG-CD2 4.2Å; L720-G722 PolarHBondContact O-N 3.13Å; L720-F742 HydrophobicContact CD1-CB 3.56Å; L720-F742 HydrophobicContact CD1-CD2 3.56Å; L720-F742 HydrophobicContact CD1-CG 3.99Å; L720-K770 HydrophobicContact CB-CB 4.35Å; L720-K770 HydrophobicContact CD1-CB 4.05Å; L720-K770 HydrophobicContact CG-CB 4.5Å; L720-K770 PolarHBondContact N-O 3Å
721	W	77.4	Confident	63.3	Low	142 Å²	142	88 Å²	88	54%	0.538	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-61.1	123.6	173.6	-61.6	112.1	0	0	0	110.1	G699 S701 K703	G699-W721 PolarHBondContact O-NE1 3.48Å; S701-W721 VanDerWaalsContact C-CD1 3.45Å; S701-W721 PolarHBondContact O-N 3.01Å; K703-W721 HydrophobicContact CG-CH2 4.43Å
722	G	60.8	Low	60.7	Low	42 Å²	42	89.1 Å²	89.1	43%	0.433	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-86.4	148.8	175.4	0	0	0	0	0	112.3	L720 K724 D768	L720-G722 PolarHBondContact O-N 3.13Å; G722-K724 PolarHBondContact O-N 2.97Å; G722-D768 WeakPolarHBondContact CA-O 3.29Å
723	L	51.1	Low	58.1	Low	109 Å²	109	89.3 Å²	89.3	57%	0.571	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-60.5	123.7	172.2	-78.9	112.6	0	0	0	110.1	K725	L723-K725 PolarHBondContact O-N 3.11Å
724	K	40.3	Very low	55.4	Low	190 Å²	190	94.2 Å²	94.2	83%	0.826	53%	0.532	S	S	*	.			trans	-71.7	108.4	162.7	-75.1	-176.5	179.2	176.5	0	107.5	G722 G726	G722-K724 PolarHBondContact O-N 2.97Å; K724-G726 PolarHBondContact O-N 3.11Å
725	K	32.2	Very low	52.8	Low	197 Å²	197	94.2 Å²	94.2	86%	0.857	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	109	164	-88.6	-178.4	175.2	174.1	0	108.7	L723	L723-K725 PolarHBondContact O-N 3.11Å
726	G	33.9	Very low	50.7	Low	66 Å²	66	95.9 Å²	95.9	68%	0.68	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	159.8	-2.5	177.2	0	0	0	0	0	117.1	K724	K724-G726 PolarHBondContact O-N 3.11Å
727	T	30.8	Very low	48.6	Very low	130 Å²	130	101.4 Å²	101.4	80%	0.798	59%	0.586	S	S	*	*			trans	-109.6	100.2	170.5	41.2	0	0	0	0	109.7	V729	T727-V729 PolarHBondContact O-N 2.76Å
728	D	27.9	Very low	46.7	Very low	156 Å²	156	103.1 Å²	103.1	83%	0.834	60%	0.6	S	S	*	*			trans	-58.9	113.5	173.4	-58.3	-47.4	0	0	0	110.6
729	V	30	Very low	45.1	Very low	115 Å²	115	105 Å²	105	70%	0.697	61%	0.611	S	S	*	*			trans	-145.7	110.6	156.4	-172.3	0	0	0	0	109.7	T727 N731	T727-V729 PolarHBondContact O-N 2.76Å; V729-N731 HydrophobicContact CG1-CB 4.18Å; V729-N731 PolarHBondContact O-N 3.44Å
730	E	29.7	Very low	44.1	Very low	194 Å²	194	105.6 Å²	105.6	91%	0.907	62%	0.618	S	S	*	*			trans	-73.2	33.4	177.2	-64.7	-174.3	134	0	0	114.7
731	N	26.4	Very low	43.6	Very low	140 Å²	140	106.1 Å²	106.1	75%	0.749	62%	0.622	S	S	*	*			trans	-107.6	106.9	174.6	-77.4	-26.6	0	0	0	109.9	V729 G733	V729-N731 HydrophobicContact CG1-CB 4.18Å; V729-N731 PolarHBondContact O-N 3.44Å; N731-G733 PolarHBondContact O-N 2.85Å
732	G	29.7	Very low	43.9	Very low	96 Å²	96	100.4 Å²	100.4	99%	0.99	60%	0.601	S	S	*	*			trans	-66.3	51.9	174.2	0	0	0	0	0	114.4
733	G	26.6	Very low	44.9	Very low	59 Å²	59	104.1 Å²	104.1	61%	0.608	61%	0.607	S	S	*	*			trans	-103.5	113.1	173.8	0	0	0	0	0	111.1	N731	N731-G733 PolarHBondContact O-N 2.85Å
734	E	31	Very low	46.3	Very low	184 Å²	184	99.9 Å²	99.9	86%	0.86	59%	0.588	S	S	*	*			trans	42.9	125.1	154	-63	-176.4	160.3	0	0	119.4
735	G	36.2	Very low	48.6	Very low	48 Å²	48	90.9 Å²	90.9	50%	0.495	55%	0.549	S	S	.	.			trans	-44.5	138.5	-176.9	0	0	0	0	0	114.7	N740	G735-N740 PolarHBondContact O-ND2 3.3Å
736	S	49	Very low	51.2	Low	39 Å²	39	83.1 Å²	83.1	27%	0.273	52%	0.518	S	S	.	.			trans	-54.2	153.2	-174.2	76.8	0	0	0	0	113	A738 D739 N740	S736-A738 PolarHBondContact O-N 3.28Å; S736-D739 PolarHBondContact O-N 3.08Å; S736-D739 PolarHBondContact OG-N 3.11Å; S736-D739 PolarHBondContact OG-OD2 3.36Å; S736-N740 PolarHBondContact O-N 3.19Å
737	T	50.7	Low	53.6	Low	127 Å²	127	85.9 Å²	85.9	78%	0.779	51%	0.511	S	S	*	.	H	α-helix	trans	-56.3	-35.6	-179.9	-22.9	0	0	0	0	112.6	S741	T737-S741 WeakPolarHBondContact O-CB 3.41Å; T737-S741 PolarHBondContact O-N 3.18Å
738	A	51.7	Low	56.1	Low	35 Å²	35	80 Å²	80	29%	0.289	47%	0.474	S	S	.	.	H	α-helix	trans	-69	-41.5	177	0	0	0	0	0	112.1	S736 S741 F742	S736-A738 PolarHBondContact O-N 3.28Å; A738-S741 PolarHBondContact O-N 3.31Å; A738-S741 PolarHBondContact O-OG 2.82Å; A738-F742 PolarHBondContact O-N 2.98Å
739	D	59	Low	58.9	Low	53 Å²	53	72.7 Å²	72.7	28%	0.283	44%	0.436	S	S	.	.	H	α-helix	trans	-63.4	-44.8	176.4	-67.2	-35.6	0	0	0	111.7	S736 S741 F742 E743 K770	S736-D739 PolarHBondContact O-N 3.08Å; S736-D739 PolarHBondContact OG-N 3.11Å; S736-D739 PolarHBondContact OG-OD2 3.36Å; D739-S741 VanDerWaalsContact C-N 3.3Å; D739-S741 PolarHBondContact O-N 3.23Å; D739-F742 PolarHBondContact O-N 3.41Å; D739-E743 PolarHBondContact O-N 2.67Å; D739-K770 IonicContact OD1-NZ 3.85Å; D739-K770 PolarHBondContact OD1-NZ 3.16Å
740	N	68.6	Low	61.5	Low	89 Å²	89	67.6 Å²	67.6	48%	0.476	41%	0.406	S	S	.	.	H	α-helix	trans	-62	-39.6	176.8	-68.8	-24.6	0	0	0	111.5	G735 S736 A744	G735-N740 PolarHBondContact O-ND2 3.3Å; S736-N740 PolarHBondContact O-N 3.19Å; N740-A744 VanDerWaalsContact O-CB 3.27Å; N740-A744 WeakPolarHBondContact O-CB 3.41Å; N740-A744 PolarHBondContact O-N 2.99Å
741	S	73.8	Confident	64	Low	17 Å²	17	65.5 Å²	65.5	12%	0.119	39%	0.394	C	S	.	.	H	α-helix	trans	-67.8	-43.2	179	73.9	0	0	0	0	113	T737 A738 D739 E743 A744 E745 G845	T737-S741 WeakPolarHBondContact O-CB 3.41Å; T737-S741 PolarHBondContact O-N 3.18Å; A738-S741 PolarHBondContact O-N 3.31Å; A738-S741 PolarHBondContact O-OG 2.82Å; D739-S741 VanDerWaalsContact C-N 3.3Å; D739-S741 PolarHBondContact O-N 3.23Å; S741-E743 PolarHBondContact O-N 2.65Å; S741-A744 PolarHBondContact O-N 2.73Å; S741-E745 WeakPolarHBondContact O-CG 3.49Å; S741-E745 PolarHBondContact O-N 3.25Å; S741-G845 VanDerWaalsContact CA-O 3.22Å; S741-G845 WeakPolarHBondContact CA-O 3.08Å; S741-G845 WeakPolarHBondContact CB-O 3.26Å
742	F	83.3	Confident	66.8	Low	22 Å²	22	59.1 Å²	59.1	10%	0.096	36%	0.36	C	S	.	.	H	α-helix	trans	-60.7	-47.2	176.5	179.2	-99.5	0	0	0	111.4	L720 A738 D739 E745 V746 T765 K770 L772	L720-F742 HydrophobicContact CD1-CB 3.56Å; L720-F742 HydrophobicContact CD1-CD2 3.56Å; L720-F742 HydrophobicContact CD1-CG 3.99Å; A738-F742 PolarHBondContact O-N 2.98Å; D739-F742 PolarHBondContact O-N 3.41Å; F742-E745 PolarHBondContact O-N 3.31Å; F742-V746 HydrophobicContact CD1-CG2 4.33Å; F742-V746 HydrophobicContact CD2-CG2 4.49Å; F742-V746 HydrophobicContact CE1-CG2 3.97Å; F742-V746 HydrophobicContact CE2-CG2 4.16Å; F742-V746 HydrophobicContact CZ-CG2 3.88Å; F742-V746 WeakPolarHBondContact O-CB 3.48Å; F742-V746 WeakPolarHBondContact O-CG2 3.21Å; F742-V746 PolarHBondContact O-N 3.12Å; F742-T765 HydrophobicContact CE1-CG2 3.89Å; F742-T765 HydrophobicContact CE2-CG2 4.26Å; F742-T765 HydrophobicContact CZ-CG2 3.43Å; F742-T765 VanDerWaalsContact CZ-CG2 3.43Å; F742-K770 HydrophobicContact CB-CD 3.98Å; F742-K770 HydrophobicContact CD1-CD 3.83Å; F742-K770 HydrophobicContact CD2-CB 3.77Å; F742-K770 HydrophobicContact CD2-CD 4Å; F742-K770 HydrophobicContact CD2-CG 4.35Å; F742-K770 HydrophobicContact CE1-CD 4.28Å; F742-K770 HydrophobicContact CE2-CB 3.81Å; F742-K770 HydrophobicContact CE2-CD 4.43Å; F742-K770 HydrophobicContact CE2-CG 4.39Å; F742-K770 HydrophobicContact CG-CB 4.32Å; F742-K770 HydrophobicContact CG-CD 3.66Å; F742-K770 HydrophobicContact CG-CG 4.46Å; F742-K770 HydrophobicContact CZ-CB 4.42Å; F742-L772 HydrophobicContact CD2-CD1 4.07Å; F742-L772 HydrophobicContact CD2-CD2 3.85Å; F742-L772 HydrophobicContact CD2-CG 3.9Å; F742-L772 HydrophobicContact CE2-CD2 3.53Å; F742-L772 HydrophobicContact CE2-CG 3.88Å; F742-L772 HydrophobicContact CZ-CD2 4.38Å
743	E	81.3	Confident	69.5	Low	121 Å²	121	59.3 Å²	59.3	57%	0.565	33%	0.331	S	S	*	.	H	α-helix	trans	-65.3	-40.7	179.6	-168.9	-176.9	163.2	0	0	111.6	D739 S741 V746 K747	D739-E743 PolarHBondContact O-N 2.67Å; S741-E743 PolarHBondContact O-N 2.65Å; E743-V746 PolarHBondContact O-N 3.35Å; E743-K747 WeakPolarHBondContact O-CB 3.41Å; E743-K747 PolarHBondContact O-N 3.36Å
744	A	81	Confident	72.7	Confident	20 Å²	20	58.5 Å²	58.5	17%	0.165	31%	0.311	C	S	.	.	H	α-helix	trans	-59.3	-47.3	175.8	0	0	0	0	0	111.7	N740 S741 K747 T748	N740-A744 VanDerWaalsContact O-CB 3.27Å; N740-A744 WeakPolarHBondContact O-CB 3.41Å; N740-A744 PolarHBondContact O-N 2.99Å; S741-A744 PolarHBondContact O-N 2.73Å; A744-K747 PolarHBondContact O-N 3.33Å; A744-T748 WeakPolarHBondContact O-CB 3.14Å; A744-T748 VanDerWaalsContact O-CG2 3.23Å; A744-T748 WeakPolarHBondContact O-CG2 3.35Å; A744-T748 PolarHBondContact O-N 3.3Å; A744-T748 PolarHBondContact O-OG1 2.68Å
745	E	87.9	Confident	75.7	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-48	177.8	-69.6	-151.9	-131.4	0	0	112.3	K718 S741 F742 K747 T748 L749 L772 Y774 F844 G845	K718-E745 IonicContact NZ-OE1 3.65Å; K718-E745 PolarHBondContact NZ-OE1 2.84Å; S741-E745 WeakPolarHBondContact O-CG 3.49Å; S741-E745 PolarHBondContact O-N 3.25Å; F742-E745 PolarHBondContact O-N 3.31Å; E745-K747 VanDerWaalsContact C-N 3.34Å; E745-K747 PolarHBondContact O-N 2.84Å; E745-T748 PolarHBondContact O-N 2.73Å; E745-T748 PolarHBondContact O-OG1 3Å; E745-T748 VanDerWaalsContact O-OG1 3.14Å; E745-L749 WeakPolarHBondContact O-CB 3.26Å; E745-L749 PolarHBondContact O-N 3.22Å; E745-L772 HydrophobicContact CB-CD1 3.88Å; E745-L772 HydrophobicContact CG-CD1 4.25Å; E745-Y774 VanDerWaalsContact CD-OH 3.28Å; E745-Y774 PolarHBondContact OE2-OH 3.32Å; E745-F844 HydrophobicContact CG-CB 4.27Å; E745-G845 VanDerWaalsContact CG-CA 3.47Å; E745-G845 VanDerWaalsContact CG-N 3.34Å
746	V	86.6	Confident	78.6	Confident	33 Å²	33	53.6 Å²	53.6	20%	0.2	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-43.3	179	167.4	0	0	0	0	111.2	F676 F742 E743 T748 G750 L772	F676-V746 HydrophobicContact CE1-CG1 4.22Å; F676-V746 HydrophobicContact CZ-CG1 3.68Å; F742-V746 HydrophobicContact CD1-CG2 4.33Å; F742-V746 HydrophobicContact CD2-CG2 4.49Å; F742-V746 HydrophobicContact CE1-CG2 3.97Å; F742-V746 HydrophobicContact CE2-CG2 4.16Å; F742-V746 HydrophobicContact CZ-CG2 3.88Å; F742-V746 WeakPolarHBondContact O-CB 3.48Å; F742-V746 WeakPolarHBondContact O-CG2 3.21Å; F742-V746 PolarHBondContact O-N 3.12Å; E743-V746 PolarHBondContact O-N 3.35Å; V746-T748 PolarHBondContact O-N 3.26Å; V746-G750 WeakPolarHBondContact O-CA 3.48Å; V746-G750 PolarHBondContact O-N 3.19Å; V746-G750 VanDerWaalsContact O-N 3.07Å; V746-L772 HydrophobicContact CG2-CD2 3.68Å
747	K	84.1	Confident	80.8	Confident	125 Å²	125	51.9 Å²	51.9	54%	0.543	26%	0.261	S	S	.	.	H	α-helix	trans	-68.6	-33.8	-178.9	-173.9	176.4	-179	177	0	112.8	E743 A744 E745	E743-K747 WeakPolarHBondContact O-CB 3.41Å; E743-K747 PolarHBondContact O-N 3.36Å; A744-K747 PolarHBondContact O-N 3.33Å; E745-K747 VanDerWaalsContact C-N 3.34Å; E745-K747 PolarHBondContact O-N 2.84Å
748	T	84.5	Confident	82.9	Confident	5 Å²	5	46 Å²	46	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-84.5	-68.3	179.8	54.2	0	0	0	0	110.9	A744 E745 V746 G750 K751 I752 I821 F844 A847	A744-T748 WeakPolarHBondContact O-CB 3.14Å; A744-T748 VanDerWaalsContact O-CG2 3.23Å; A744-T748 WeakPolarHBondContact O-CG2 3.35Å; A744-T748 PolarHBondContact O-N 3.3Å; A744-T748 PolarHBondContact O-OG1 2.68Å; E745-T748 PolarHBondContact O-N 2.73Å; E745-T748 PolarHBondContact O-OG1 3Å; E745-T748 VanDerWaalsContact O-OG1 3.14Å; V746-T748 PolarHBondContact O-N 3.26Å; T748-G750 VanDerWaalsContact C-N 3.31Å; T748-G750 PolarHBondContact O-N 3.27Å; T748-K751 PolarHBondContact O-N 3.43Å; T748-I752 VanDerWaalsContact O-CD1 3.31Å; T748-I752 WeakPolarHBondContact O-CD1 3.43Å; T748-I752 VanDerWaalsContact O-CG1 3.27Å; T748-I752 WeakPolarHBondContact O-CG1 3.17Å; T748-I752 PolarHBondContact O-N 3.46Å; T748-I821 HydrophobicContact CG2-CD1 4.04Å; T748-I821 HydrophobicContact CG2-CG2 4.44Å; T748-F844 WeakPolarHBondContact OG1-CB 3.24Å; T748-A847 HydrophobicContact CG2-CB 4.14Å
749	L	85.9	Confident	84.8	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-25.5	-174.8	-71.2	178.2	0	0	0	114	E745 K751 R753 I757 V758 L760 Y774 F844	E745-L749 WeakPolarHBondContact O-CB 3.26Å; E745-L749 PolarHBondContact O-N 3.22Å; L749-K751 PolarHBondContact O-N 2.95Å; L749-K751 VanDerWaalsContact O-N 3.14Å; L749-R753 PolarHBondContact O-NH1 2.97Å; L749-I757 HydrophobicContact CD2-CG2 3.69Å; L749-V758 WeakPolarHBondContact CD2-O 3.36Å; L749-L760 HydrophobicContact CB-CB 3.81Å; L749-L760 HydrophobicContact CB-CD2 4.08Å; L749-L760 HydrophobicContact CD1-CB 4.48Å; L749-Y774 HydrophobicContact CD1-CD1 4.35Å; L749-Y774 HydrophobicContact CD1-CE1 3.71Å; L749-F844 HydrophobicContact CD1-CB 4.36Å; L749-F844 HydrophobicContact CD1-CD2 3.72Å; L749-F844 HydrophobicContact CD1-CE2 4.41Å; L749-F844 HydrophobicContact CD1-CG 4.26Å; L749-F844 HydrophobicContact CD2-CD1 4.49Å; L749-F844 HydrophobicContact CD2-CD2 3.55Å; L749-F844 HydrophobicContact CD2-CE1 4.46Å; L749-F844 HydrophobicContact CD2-CE2 3.53Å; L749-F844 HydrophobicContact CD2-CG 4.06Å; L749-F844 HydrophobicContact CD2-CZ 4.01Å; L749-F844 HydrophobicContact CG-CB 4.2Å; L749-F844 HydrophobicContact CG-CD2 3.68Å; L749-F844 HydrophobicContact CG-CE2 4.2Å; L749-F844 HydrophobicContact CG-CG 3.91Å
750	G	83.7	Confident	86.4	Confident	8 Å²	8	45.6 Å²	45.6	8%	0.082	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.5	175.6	0	0	0	0	0	112.9	F676 V746 T748 R753	F676-G750 VanDerWaalsContact CD1-CA 3.47Å; V746-G750 WeakPolarHBondContact O-CA 3.48Å; V746-G750 PolarHBondContact O-N 3.19Å; V746-G750 VanDerWaalsContact O-N 3.07Å; T748-G750 VanDerWaalsContact C-N 3.31Å; T748-G750 PolarHBondContact O-N 3.27Å; G750-R753 PolarHBondContact O-NH1 2.9Å; G750-R753 PolarHBondContact O-NH2 3.01Å; G750-R753 VanDerWaalsContact O-NH2 3.12Å
751	K	82.2	Confident	87.3	Confident	150 Å²	150	44 Å²	44	65%	0.652	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-26.6	-176.2	-63.7	-177.7	179.1	-175.6	0	114.5	T748 L749 Y817	T748-K751 PolarHBondContact O-N 3.43Å; L749-K751 PolarHBondContact O-N 2.95Å; L749-K751 VanDerWaalsContact O-N 3.14Å; K751-Y817 WeakPolarHBondContact CB-OH 3.16Å
752	I	87	Confident	88.1	Confident	7 Å²	7	43.2 Å²	43.2	4%	0.036	20%	0.197	C	C	.	.			trans	-74.1	135.6	-174.5	-68.9	161.6	0	0	0	111.4	T748 I757 Y812 L813 Y817 I821 F844	T748-I752 VanDerWaalsContact O-CD1 3.31Å; T748-I752 WeakPolarHBondContact O-CD1 3.43Å; T748-I752 VanDerWaalsContact O-CG1 3.27Å; T748-I752 WeakPolarHBondContact O-CG1 3.17Å; T748-I752 PolarHBondContact O-N 3.46Å; I752-I757 HydrophobicContact CG2-CB 4.24Å; I752-I757 HydrophobicContact CG2-CD1 3.62Å; I752-I757 HydrophobicContact CG2-CG2 3.91Å; I752-Y812 HydrophobicContact CG2-CD1 4.5Å; I752-Y812 HydrophobicContact CG2-CE1 3.88Å; I752-L813 HydrophobicContact CD1-CD2 3.73Å; I752-Y817 HydrophobicContact CG1-CD2 3.78Å; I752-Y817 HydrophobicContact CG1-CE2 3.5Å; I752-Y817 VanDerWaalsContact CG1-CE2 3.5Å; I752-Y817 HydrophobicContact CG1-CG 4.47Å; I752-I821 HydrophobicContact CD1-CD1 3.63Å; I752-I821 HydrophobicContact CG1-CD1 4.32Å; I752-F844 HydrophobicContact CD1-CE1 4.35Å
753	R	84.9	Confident	88.4	Confident	99 Å²	99	42.4 Å²	42.4	37%	0.374	19%	0.193	S	C	.	.			trans	-134.8	104.3	173.6	-60.1	-66.8	177.5	-93.6	-1.5	109.3	F676 H677 L749 G750	F676-R753 PolarHBondContact O-NH2 3.29Å; H677-R753 PolarHBondContact CE1-NE 3.28Å; H677-R753 PolarHBondContact CE1-NH1 2.82Å; H677-R753 PolarHBondContact CE1-NH2 2.89Å; H677-R753 WeakPolarHBondContact NE2-CD 3.49Å; H677-R753 VanDerWaalsContact NE2-CZ 3.34Å; H677-R753 PolarHBondContact NE2-NE 3.46Å; L749-R753 PolarHBondContact O-NH1 2.97Å; G750-R753 PolarHBondContact O-NH1 2.9Å; G750-R753 PolarHBondContact O-NH2 3.01Å; G750-R753 VanDerWaalsContact O-NH2 3.12Å
754	H	94	Very high	88.6	Confident	42 Å²	42	36.8 Å²	36.8	19%	0.194	17%	0.167	C	C	.	.			trans	-148.5	148.6	178	-168.7	-103.2	0	0	0	110.4	N756 I757 Y812	H754-N756 VanDerWaalsContact C-N 3.28Å; H754-N756 PolarHBondContact CE1-OD1 3.25Å; H754-N756 VanDerWaalsContact CE1-OD1 3.26Å; H754-N756 PolarHBondContact ND1-N 3.5Å; H754-N756 VanDerWaalsContact ND1-N 3.15Å; H754-N756 PolarHBondContact O-N 3.3Å; H754-I757 HydrophobicContact CB-CB 4.13Å; H754-I757 HydrophobicContact CB-CD1 3.77Å; H754-I757 HydrophobicContact CB-CG1 3.94Å; H754-I757 PolarHBondContact O-N 2.96Å; H754-Y812 HydrophobicContact CB-CD1 4.05Å; H754-Y812 HydrophobicContact CB-CE1 4.24Å; H754-Y812 HydrophobicContact CB-CG 4.24Å; H754-Y812 AromaticContact CD2-CD2 3.66Å; H754-Y812 AromaticContact CD2-CG 3.7Å; H754-Y812 AromaticContact CG-CG 3.94Å
755	K	94.3	Very high	88.7	Confident	124 Å²	124	37.7 Å²	37.7	54%	0.539	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-31.1	-178.2	68.4	-179.5	179.4	165.5	0	112.6	E808 R840	K755-E808 WeakPolarHBondContact CE-OE2 3.29Å; K755-E808 IonicContact NZ-OE2 3.63Å; K755-E808 PolarHBondContact NZ-OE2 3.27Å; K755-R840 WeakPolarHBondContact O-CD 3.41Å; K755-R840 PolarHBondContact O-NE 3.03Å
756	N	97.3	Very high	88.3	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.027	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	23.5	-179.7	-51.5	104.8	0	0	0	113.8	H754 D805 A839 R840 V841	H754-N756 VanDerWaalsContact C-N 3.28Å; H754-N756 PolarHBondContact CE1-OD1 3.25Å; H754-N756 VanDerWaalsContact CE1-OD1 3.26Å; H754-N756 PolarHBondContact ND1-N 3.5Å; H754-N756 VanDerWaalsContact ND1-N 3.15Å; H754-N756 PolarHBondContact O-N 3.3Å; N756-D805 WeakPolarHBondContact CB-O 3.29Å; N756-D805 WeakPolarHBondContact ND2-CA 3.09Å; N756-D805 WeakPolarHBondContact ND2-CB 3.11Å; N756-D805 PolarHBondContact ND2-OD1 2.89Å; N756-A839 WeakPolarHBondContact CA-O 3.5Å; N756-A839 WeakPolarHBondContact CB-O 3.43Å; N756-A839 PolarHBondContact ND2-O 2.95Å; N756-A839 VanDerWaalsContact ND2-O 3.1Å; N756-R840 WeakPolarHBondContact O-CA 3.17Å; N756-V841 PolarHBondContact O-N 2.98Å
757	I	95.6	Very high	87.7	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.015	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-129.8	134.3	173.5	-60.8	174.8	0	0	0	107.5	L749 I752 H754 K759 Y812 L813 F844	L749-I757 HydrophobicContact CD2-CG2 3.69Å; I752-I757 HydrophobicContact CG2-CB 4.24Å; I752-I757 HydrophobicContact CG2-CD1 3.62Å; I752-I757 HydrophobicContact CG2-CG2 3.91Å; H754-I757 HydrophobicContact CB-CB 4.13Å; H754-I757 HydrophobicContact CB-CD1 3.77Å; H754-I757 HydrophobicContact CB-CG1 3.94Å; H754-I757 PolarHBondContact O-N 2.96Å; I757-K759 PolarHBondContact O-N 3.09Å; I757-Y812 HydrophobicContact CD1-CD1 3.64Å; I757-Y812 HydrophobicContact CD1-CE1 4.26Å; I757-L813 HydrophobicContact CD1-CD1 4.36Å; I757-L813 HydrophobicContact CD1-CD2 3.69Å; I757-L813 HydrophobicContact CD1-CG 3.78Å; I757-F844 HydrophobicContact CG2-CE2 3.87Å; I757-F844 HydrophobicContact CG2-CZ 3.67Å
758	V	94.3	Very high	87.1	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.03	19%	0.19	C	C	.	.			trans	-61.4	132.6	-178.6	172.1	0	0	0	0	110.8	L749 Y774 E775 L832 R840 V841 A842	L749-V758 WeakPolarHBondContact CD2-O 3.36Å; V758-Y774 HydrophobicContact CG1-CD1 3.81Å; V758-Y774 HydrophobicContact CG1-CG 4.19Å; V758-E775 WeakPolarHBondContact CA-OE1 3.12Å; V758-E775 HydrophobicContact CG1-CG 4.13Å; V758-L832 HydrophobicContact CG2-CD1 4.11Å; V758-R840 HydrophobicContact CG2-CB 3.76Å; V758-V841 PolarHBondContact N-O 2.94Å; V758-A842 HydrophobicContact CB-CB 4.24Å; V758-A842 HydrophobicContact CG2-CB 3.63Å
759	K	92	Very high	86.9	Confident	79 Å²	79	42.4 Å²	42.4	34%	0.343	20%	0.202	S	C	.	.			trans	-81.3	125.8	178.5	-64.1	173.5	-170.5	169.8	0	111.3	I757 Y774 E775	I757-K759 PolarHBondContact O-N 3.09Å; K759-Y774 VanDerWaalsContact O-CA 3.29Å; K759-Y774 WeakPolarHBondContact O-CA 3.4Å; K759-E775 HydrophobicContact CB-CG 4.19Å; K759-E775 WeakPolarHBondContact CG-OE1 3.33Å; K759-E775 PolarHBondContact N-OE1 3.24Å; K759-E775 PolarHBondContact O-N 3.24Å; K759-E775 VanDerWaalsContact O-N 3.09Å
760	L	92.6	Very high	86.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	115.8	165.6	-177.2	69.6	0	0	0	109.5	F676 H677 L749 L772 V773 Y774	F676-L760 HydrophobicContact CD2-CD2 3.75Å; F676-L760 HydrophobicContact CD2-CG 3.85Å; F676-L760 HydrophobicContact CE2-CD2 3.55Å; F676-L760 HydrophobicContact CE2-CG 4.04Å; F676-L760 HydrophobicContact CZ-CD2 4.37Å; H677-L760 PolarHBondContact CE1-O 3.38Å; H677-L760 VanDerWaalsContact CE1-O 3.31Å; H677-L760 PolarHBondContact ND1-O 2.92Å; L749-L760 HydrophobicContact CB-CB 3.81Å; L749-L760 HydrophobicContact CB-CD2 4.08Å; L749-L760 HydrophobicContact CD1-CB 4.48Å; L760-L772 HydrophobicContact CD1-CB 4Å; L760-L772 HydrophobicContact CD1-CD2 4.02Å; L760-L772 HydrophobicContact CD2-CD2 4.34Å; L760-V773 WeakPolarHBondContact CD1-O 3.27Å; L760-Y774 HydrophobicContact CB-CD1 4.36Å; L760-Y774 HydrophobicContact CD1-CD1 3.9Å; L760-Y774 HydrophobicContact CD1-CE1 3.72Å; L760-Y774 HydrophobicContact CD1-CG 4.43Å
761	W	87.9	Confident	87.3	Confident	56 Å²	56	44 Å²	44	21%	0.212	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-52.8	178.7	-73.6	94.3	0	0	0	111.5	F676 H677 L679 F681 V773	F676-W761 PolarHBondContact N-O 2.83Å; H677-W761 HydrophobicContact CB-CD2 4.43Å; H677-W761 HydrophobicContact CB-CE3 3.55Å; H677-W761 HydrophobicContact CB-CZ3 3.87Å; H677-W761 PolarHBondContact N-O 2.92Å; L679-W761 HydrophobicContact CD2-CB 4.1Å; L679-W761 HydrophobicContact CD2-CE3 4.24Å; F681-W761 HydrophobicContact CZ-CB 4.48Å; W761-V773 HydrophobicContact CB-CG1 4.46Å; W761-V773 PolarHBondContact N-O 2.91Å
762	C	89.1	Confident	87.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	166.8	-179.1	60.3	0	0	0	0	111.9	L673 T674 L679 V773	L673-C762 HydrophobicContact CD1-CB 3.82Å; T674-C762 CarbonylContact O-C 3.59Å; T674-C762 WeakPolarHBondContact O-CA 3.21Å; T674-C762 VanDerWaalsContact O-CB 3.26Å; T674-C762 WeakPolarHBondContact O-CB 3.18Å; L679-C762 HydrophobicContact CD1-CB 3.98Å; L679-C762 HydrophobicContact CD2-CB 4.15Å; C762-V773 PolarHBondContact O-N 3.47Å
763	S	89.4	Confident	87.9	Confident	4 Å²	4	36.5 Å²	36.5	3%	0.028	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.6	167.8	64.5	0	0	0	0	109.8	T674 L771	T674-S763 PolarHBondContact N-O 2.82Å; T674-S763 PolarHBondContact O-N 2.73Å; S763-L771 CarbonylContact C-O 3.52Å; S763-L771 VanDerWaalsContact CA-O 3.29Å; S763-L771 WeakPolarHBondContact CA-O 3.14Å
764	C	86.2	Confident	88.3	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.02	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.2	176.9	-44.8	0	0	0	0	109.4	W671 S672 L673 L771	W671-C764 HydrophobicContact CE3-CB 3.89Å; W671-C764 HydrophobicContact CZ3-CB 4.21Å; S672-C764 WeakPolarHBondContact O-CA 3.38Å; L673-C764 WeakPolarHBondContact CD1-SG 3.26Å; C764-L771 HydrophobicContact CB-CB 4.08Å; C764-L771 HydrophobicContact CB-CD1 4.21Å; C764-L771 HydrophobicContact CB-CG 4.48Å; C764-L771 PolarHBondContact N-O 3.14Å; C764-L771 PolarHBondContact O-N 2.97Å
765	T	83.4	Confident	88.3	Confident	39 Å²	39	32 Å²	32	24%	0.239	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.9	176.9	60.8	0	0	0	0	110.9	S672 F742 T769 K770	S672-T765 PolarHBondContact N-O 2.88Å; S672-T765 PolarHBondContact O-N 2.93Å; F742-T765 HydrophobicContact CE1-CG2 3.89Å; F742-T765 HydrophobicContact CE2-CG2 4.26Å; F742-T765 HydrophobicContact CZ-CG2 3.43Å; F742-T765 VanDerWaalsContact CZ-CG2 3.43Å; T765-T769 WeakPolarHBondContact CA-O 3.21Å; T765-K770 HydrophobicContact CG2-CG 4.14Å
766	H	79.2	Confident	88.2	Confident	15 Å²	15	28.9 Å²	28.9	7%	0.069	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	123	173.2	-179.6	-118.1	0	0	0	110.4	D667 K670 W671 D768 T769	D667-H766 IonicContact OD1-CE1 3Å; D667-H766 IonicContact OD1-NE2 3.65Å; D667-H766 IonicContact OD2-CE1 3.76Å; K670-H766 WeakPolarHBondContact CB-NE2 3.47Å; K670-H766 PolarHBondContact O-CD2 3.01Å; W671-H766 HydrophobicContact CD2-CB 3.26Å; W671-H766 AromaticContact CD2-CG 3.93Å; W671-H766 AromaticContact CE2-CG 3.71Å; W671-H766 AromaticContact CE2-ND1 3.8Å; W671-H766 HydrophobicContact CE3-CB 3.4Å; W671-H766 VanDerWaalsContact CE3-CB 3.4Å; W671-H766 HydrophobicContact CG-CB 3.78Å; W671-H766 HydrophobicContact CH2-CB 3.86Å; W671-H766 HydrophobicContact CZ2-CB 3.72Å; W671-H766 AromaticContact CZ2-ND1 3.99Å; W671-H766 HydrophobicContact CZ3-CB 3.7Å; W671-H766 AromaticContact NE1-CG 3.76Å; W671-H766 AromaticContact NE1-ND1 3.72Å; H766-D768 PolarHBondContact O-N 2.85Å; H766-D768 VanDerWaalsContact O-N 3.14Å; H766-T769 PolarHBondContact N-O 2.96Å; H766-T769 PolarHBondContact O-N 3.18Å
767	N	73.8	Confident	88.1	Confident	124 Å²	124	29.1 Å²	29.1	66%	0.663	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	-116.6	-169.8	-58.6	-39.6	0	0	0	110.1
768	D	72.2	Confident	87.9	Confident	77 Å²	77	32 Å²	32	41%	0.412	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	8.6	179.7	-56.1	-42.9	0	0	0	113	G722 H766	G722-D768 WeakPolarHBondContact CA-O 3.29Å; H766-D768 PolarHBondContact O-N 2.85Å; H766-D768 VanDerWaalsContact O-N 3.14Å
769	T	80.2	Confident	87.9	Confident	47 Å²	47	34.3 Å²	34.3	29%	0.288	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127.4	177.4	-56.8	0	0	0	0	110.5	W671 T765 H766 L771	W671-T769 HydrophobicContact CH2-CG2 3.97Å; T765-T769 WeakPolarHBondContact CA-O 3.21Å; H766-T769 PolarHBondContact N-O 2.96Å; H766-T769 PolarHBondContact O-N 3.18Å; T769-L771 HydrophobicContact CG2-CD2 4.29Å
770	K	86.9	Confident	87.9	Confident	44 Å²	44	32 Å²	32	19%	0.191	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	128.1	-178.7	-63	179.8	174.4	-178.2	0	110.2	L720 D739 F742 T765	L720-K770 HydrophobicContact CB-CB 4.35Å; L720-K770 HydrophobicContact CD1-CB 4.05Å; L720-K770 HydrophobicContact CG-CB 4.5Å; L720-K770 PolarHBondContact N-O 3Å; D739-K770 IonicContact OD1-NZ 3.85Å; D739-K770 PolarHBondContact OD1-NZ 3.16Å; F742-K770 HydrophobicContact CB-CD 3.98Å; F742-K770 HydrophobicContact CD1-CD 3.83Å; F742-K770 HydrophobicContact CD2-CB 3.77Å; F742-K770 HydrophobicContact CD2-CD 4Å; F742-K770 HydrophobicContact CD2-CG 4.35Å; F742-K770 HydrophobicContact CE1-CD 4.28Å; F742-K770 HydrophobicContact CE2-CB 3.81Å; F742-K770 HydrophobicContact CE2-CD 4.43Å; F742-K770 HydrophobicContact CE2-CG 4.39Å; F742-K770 HydrophobicContact CG-CB 4.32Å; F742-K770 HydrophobicContact CG-CD 3.66Å; F742-K770 HydrophobicContact CG-CG 4.46Å; F742-K770 HydrophobicContact CZ-CB 4.42Å; T765-K770 HydrophobicContact CG2-CG 4.14Å
771	L	90.4	Very high	88	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.1	179.4	-53.1	179.1	0	0	0	109.8	W671 I686 L687 L690 V717 K718 K719 S763 C764 T769	W671-L771 HydrophobicContact CH2-CD1 4.11Å; W671-L771 HydrophobicContact CZ3-CD1 3.78Å; W671-L771 HydrophobicContact CZ3-CG 4.12Å; I686-L771 HydrophobicContact CG2-CD1 4.49Å; L687-L771 HydrophobicContact CD2-CD1 3.98Å; L690-L771 HydrophobicContact CD1-CD1 3.92Å; L690-L771 HydrophobicContact CD1-CD2 4.16Å; V717-L771 HydrophobicContact CG1-CB 4.4Å; K718-L771 CarbonylContact O-C 3.24Å; K718-L771 WeakPolarHBondContact O-CA 3.17Å; K719-L771 HydrophobicContact CB-CD2 3.56Å; K719-L771 HydrophobicContact CD-CD2 4.28Å; K719-L771 HydrophobicContact CG-CD2 3.6Å; S763-L771 CarbonylContact C-O 3.52Å; S763-L771 VanDerWaalsContact CA-O 3.29Å; S763-L771 WeakPolarHBondContact CA-O 3.14Å; C764-L771 HydrophobicContact CB-CB 4.08Å; C764-L771 HydrophobicContact CB-CD1 4.21Å; C764-L771 HydrophobicContact CB-CG 4.48Å; C764-L771 PolarHBondContact N-O 3.14Å; C764-L771 PolarHBondContact O-N 2.97Å; T769-L771 HydrophobicContact CG2-CD2 4.29Å
772	L	91.6	Very high	88.4	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129	169.7	-65.3	169.4	0	0	0	108.7	V717 K718 F742 E745 V746 L760 Y774	V717-L772 CarbonylContact C-O 3.14Å; V717-L772 WeakPolarHBondContact CA-O 3.49Å; K718-L772 HydrophobicContact CB-CB 4.37Å; K718-L772 PolarHBondContact N-O 2.92Å; K718-L772 PolarHBondContact O-N 3.4Å; F742-L772 HydrophobicContact CD2-CD1 4.07Å; F742-L772 HydrophobicContact CD2-CD2 3.85Å; F742-L772 HydrophobicContact CD2-CG 3.9Å; F742-L772 HydrophobicContact CE2-CD2 3.53Å; F742-L772 HydrophobicContact CE2-CG 3.88Å; F742-L772 HydrophobicContact CZ-CD2 4.38Å; E745-L772 HydrophobicContact CB-CD1 3.88Å; E745-L772 HydrophobicContact CG-CD1 4.25Å; V746-L772 HydrophobicContact CG2-CD2 3.68Å; L760-L772 HydrophobicContact CD1-CB 4Å; L760-L772 HydrophobicContact CD1-CD2 4.02Å; L760-L772 HydrophobicContact CD2-CD2 4.34Å; L772-Y774 HydrophobicContact CB-CD2 4.48Å; L772-Y774 HydrophobicContact CB-CE2 3.5Å; L772-Y774 VanDerWaalsContact CB-CE2 3.5Å; L772-Y774 VanDerWaalsContact CB-OH 3.27Å; L772-Y774 WeakPolarHBondContact CB-OH 3.45Å; L772-Y774 WeakPolarHBondContact CD1-OH 3.43Å
773	V	91.9	Very high	88.6	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	113.1	-172.9	-173.9	0	0	0	0	109	F681 I686 V715 V717 L760 W761 C762	F681-V773 HydrophobicContact CZ-CG1 4.28Å; I686-V773 HydrophobicContact CD1-CB 4.33Å; I686-V773 HydrophobicContact CD1-CG1 3.85Å; I686-V773 HydrophobicContact CD1-CG2 3.57Å; V715-V773 HydrophobicContact CB-CG1 3.96Å; V715-V773 HydrophobicContact CG1-CG1 4.43Å; V715-V773 HydrophobicContact CG2-CG1 3.95Å; V717-V773 HydrophobicContact CG1-CG2 4.4Å; V717-V773 HydrophobicContact CG2-CG1 4.42Å; L760-V773 WeakPolarHBondContact CD1-O 3.27Å; W761-V773 HydrophobicContact CB-CG1 4.46Å; W761-V773 PolarHBondContact N-O 2.91Å; C762-V773 PolarHBondContact O-N 3.47Å
774	Y	93	Very high	88.7	Confident	21 Å²	21	34.4 Å²	34.4	8%	0.082	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	163.8	-177.6	-49.1	-94.8	0	0	0	111.1	V715 A716 K718 E745 L749 V758 K759 L760 L772	V715-Y774 WeakPolarHBondContact CA-O 3.46Å; V715-Y774 WeakPolarHBondContact CB-O 3.32Å; A716-Y774 PolarHBondContact N-O 3.3Å; A716-Y774 PolarHBondContact O-N 2.98Å; K718-Y774 HydrophobicContact CB-CE2 3.73Å; K718-Y774 HydrophobicContact CD-CE2 4.2Å; E745-Y774 VanDerWaalsContact CD-OH 3.28Å; E745-Y774 PolarHBondContact OE2-OH 3.32Å; L749-Y774 HydrophobicContact CD1-CD1 4.35Å; L749-Y774 HydrophobicContact CD1-CE1 3.71Å; V758-Y774 HydrophobicContact CG1-CD1 3.81Å; V758-Y774 HydrophobicContact CG1-CG 4.19Å; K759-Y774 VanDerWaalsContact O-CA 3.29Å; K759-Y774 WeakPolarHBondContact O-CA 3.4Å; L760-Y774 HydrophobicContact CB-CD1 4.36Å; L760-Y774 HydrophobicContact CD1-CD1 3.9Å; L760-Y774 HydrophobicContact CD1-CE1 3.72Å; L760-Y774 HydrophobicContact CD1-CG 4.43Å; L772-Y774 HydrophobicContact CB-CD2 4.48Å; L772-Y774 HydrophobicContact CB-CE2 3.5Å; L772-Y774 VanDerWaalsContact CB-CE2 3.5Å; L772-Y774 VanDerWaalsContact CB-OH 3.27Å; L772-Y774 WeakPolarHBondContact CB-OH 3.45Å; L772-Y774 WeakPolarHBondContact CD1-OH 3.43Å
775	E	92.7	Very high	89	Confident	26 Å²	26	34.6 Å²	34.6	12%	0.121	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	143.1	162.1	64.1	-174	151.9	0	0	111	V758 K759 M777 R840	V758-E775 WeakPolarHBondContact CA-OE1 3.12Å; V758-E775 HydrophobicContact CG1-CG 4.13Å; K759-E775 HydrophobicContact CB-CG 4.19Å; K759-E775 WeakPolarHBondContact CG-OE1 3.33Å; K759-E775 PolarHBondContact N-OE1 3.24Å; K759-E775 PolarHBondContact O-N 3.24Å; K759-E775 VanDerWaalsContact O-N 3.09Å; E775-M777 HydrophobicContact CG-SD 4.2Å; E775-R840 IonicContact OE1-CZ 2.65Å; E775-R840 IonicContact OE1-NH1 2.7Å; E775-R840 PolarHBondContact OE1-NH1 2.95Å; E775-R840 IonicContact OE2-CZ 2.69Å; E775-R840 IonicContact OE2-NH1 3.4Å; E775-R840 PolarHBondContact OE2-NH1 3.04Å
776	Y	93.7	Very high	89.4	Confident	57 Å²	57	33 Å²	33	22%	0.224	18%	0.18	C	C	.	.			trans	-82.3	131.2	177.6	177.6	-111.2	0	0	0	111	I696 K706 V714 A716 P778	I696-Y776 HydrophobicContact CD1-CD2 4.13Å; I696-Y776 HydrophobicContact CD1-CE2 3.8Å; K706-Y776 HydrophobicContact CB-CE2 4.28Å; K706-Y776 HydrophobicContact CD-CE1 4.37Å; K706-Y776 HydrophobicContact CD-CE2 3.9Å; K706-Y776 HydrophobicContact CG-CD2 4.2Å; K706-Y776 HydrophobicContact CG-CE2 3.88Å; K706-Y776 PolarHBondContact NZ-OH 2.89Å; V714-Y776 HydrophobicContact CB-CD1 3.97Å; V714-Y776 HydrophobicContact CB-CG 4.2Å; V714-Y776 HydrophobicContact CG1-CD1 3.5Å; V714-Y776 HydrophobicContact CG1-CD2 4.16Å; V714-Y776 HydrophobicContact CG1-CE1 4.06Å; V714-Y776 HydrophobicContact CG1-CG 3.54Å; V714-Y776 WeakPolarHBondContact O-CB 3.41Å; A716-Y776 HydrophobicContact CB-CD2 4.4Å; Y776-P778 HydrophobicContact CD1-CB 4.46Å; Y776-P778 HydrophobicContact CE1-CB 3.97Å; Y776-P778 WeakPolarHBondContact O-CD 3.27Å
777	M	94.4	Very high	90	Very high	11 Å²	11	35.6 Å²	35.6	5%	0.054	19%	0.193	C	C	.	.			trans	-105.7	101.3	179.5	-59.5	-62.5	-72.7	0	0	108.8	E775 N779 G780 L832 L833 D834 R840	E775-M777 HydrophobicContact CG-SD 4.2Å; M777-N779 VanDerWaalsContact C-N 3.33Å; M777-N779 PolarHBondContact O-N 3.12Å; M777-G780 PolarHBondContact O-N 2.86Å; M777-L832 HydrophobicContact CB-CB 3.81Å; M777-L832 HydrophobicContact CB-CD1 4.17Å; M777-L832 HydrophobicContact CE-CB 3.94Å; M777-L832 WeakPolarHBondContact CE-O 3.22Å; M777-L832 HydrophobicContact CG-CB 3.64Å; M777-L832 HydrophobicContact CG-CD1 3.77Å; M777-L832 HydrophobicContact CG-CG 4.37Å; M777-L833 VanDerWaalsContact CE-C 3.49Å; M777-D834 HydrophobicContact CE-CB 3.9Å; M777-D834 VanDerWaalsContact CE-N 3.34Å; M777-D834 HydrophobicContact SD-CB 4.47Å; M777-R840 HydrophobicContact CE-CB 3.93Å; M777-R840 HydrophobicContact CE-CG 3.66Å
778	P	92.2	Very high	90.6	Very high	62 Å²	62	31.9 Å²	31.9	40%	0.403	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-27.9	-166.7	24.3	-35.8	0	0	0	114.8	Y776 G780 A835	Y776-P778 HydrophobicContact CD1-CB 4.46Å; Y776-P778 HydrophobicContact CE1-CB 3.97Å; Y776-P778 WeakPolarHBondContact O-CD 3.27Å; P778-G780 VanDerWaalsContact C-N 3.33Å; P778-A835 HydrophobicContact CG-CB 3.98Å
779	N	93.2	Very high	91	Very high	55 Å²	55	34.4 Å²	34.4	29%	0.294	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	2.5	179.6	-75.8	-40.5	0	0	0	113.2	M777 V785 L833 D834 A835	M777-N779 VanDerWaalsContact C-N 3.33Å; M777-N779 PolarHBondContact O-N 3.12Å; N779-V785 WeakPolarHBondContact O-CG2 3.19Å; N779-L833 HydrophobicContact CB-CB 3.72Å; N779-L833 PolarHBondContact N-O 3.21Å; N779-D834 PolarHBondContact ND2-O 3.34Å; N779-A835 PolarHBondContact ND2-O 2.75Å
780	G	92.8	Very high	91	Very high	29 Å²	29	38.1 Å²	38.1	30%	0.299	21%	0.212	S	C	.	.			trans	70.2	-149.4	177.1	0	0	0	0	0	112.8	M777 P778 L832 L833	M777-G780 PolarHBondContact O-N 2.86Å; P778-G780 VanDerWaalsContact C-N 3.33Å; G780-L832 CarbonylContact O-C 3.38Å; G780-L832 WeakPolarHBondContact O-CA 3.28Å; G780-L833 PolarHBondContact O-N 2.82Å
781	S	94.8	Very high	90.7	Very high	6 Å²	6	36.1 Å²	36.1	4%	0.042	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-89.9	151.8	-178.8	82	0	0	0	0	112.7	G783 D784 V785 N829 I831	S781-G783 VanDerWaalsContact C-N 3.32Å; S781-G783 PolarHBondContact O-N 2.81Å; S781-D784 PolarHBondContact O-N 3.42Å; S781-D784 WeakPolarHBondContact OG-CB 3.15Å; S781-D784 PolarHBondContact OG-N 3.45Å; S781-D784 PolarHBondContact OG-OD2 2.9Å; S781-V785 WeakPolarHBondContact O-CG2 3.25Å; S781-V785 PolarHBondContact O-N 3Å; S781-N829 VanDerWaalsContact CB-O 3.3Å; S781-N829 WeakPolarHBondContact CB-O 3.42Å; S781-N829 PolarHBondContact OG-OD1 2.91Å; S781-I831 CarbonylContact C-O 3.57Å; S781-I831 WeakPolarHBondContact CA-O 3.47Å
782	L	96.6	Very high	90.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59	-43.3	175.8	166.9	64.6	0	0	0	111.3	D784 V785 L786 L794 I802 S828 I831 L833 V892 L896	L782-D784 PolarHBondContact O-N 2.98Å; L782-V785 PolarHBondContact O-N 3.47Å; L782-L786 HydrophobicContact CD1-CB 4.25Å; L782-L786 WeakPolarHBondContact O-CB 3.28Å; L782-L786 PolarHBondContact O-N 3.09Å; L782-L794 HydrophobicContact CD1-CD1 3.82Å; L782-I802 HydrophobicContact CD1-CD1 4.21Å; L782-I802 HydrophobicContact CD1-CG2 4.21Å; L782-I802 HydrophobicContact CD2-CG2 3.85Å; L782-S828 WeakPolarHBondContact CB-O 3.4Å; L782-S828 PolarHBondContact N-O 3.25Å; L782-I831 HydrophobicContact CB-CB 4.25Å; L782-I831 HydrophobicContact CB-CG2 4.3Å; L782-I831 HydrophobicContact CD2-CD1 4.43Å; L782-I831 HydrophobicContact CD2-CG2 4.47Å; L782-I831 PolarHBondContact N-O 3.32Å; L782-L833 HydrophobicContact CB-CD1 4.47Å; L782-V892 HydrophobicContact CD2-CG1 4.01Å; L782-L896 HydrophobicContact CD1-CD2 3.85Å; L782-L896 HydrophobicContact CD2-CD2 4.03Å; L782-L896 HydrophobicContact CD2-CG 4.37Å
783	G	92.6	Very high	89.7	Confident	2 Å²	2	44.4 Å²	44.4	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-40.1	-178.7	0	0	0	0	0	112.8	S781 V785 L786 H787 S828 N829	S781-G783 VanDerWaalsContact C-N 3.32Å; S781-G783 PolarHBondContact O-N 2.81Å; G783-V785 VanDerWaalsContact C-N 3.33Å; G783-V785 PolarHBondContact O-N 3.33Å; G783-L786 PolarHBondContact O-N 3.01Å; G783-H787 WeakPolarHBondContact O-CB 3.49Å; G783-H787 PolarHBondContact O-CD2 3.31Å; G783-H787 PolarHBondContact O-N 2.92Å; G783-S828 PolarHBondContact N-O 3.27Å; G783-N829 VanDerWaalsContact CA-OD1 3.28Å; G783-N829 WeakPolarHBondContact CA-OD1 3.48Å
784	D	90.6	Very high	89.7	Confident	103 Å²	103	44.5 Å²	44.5	55%	0.551	26%	0.264	S	S	*	.	H	α-helix	trans	-64	-37.6	175	-66	-42.3	0	0	0	112.2	S781 L782 S788	S781-D784 PolarHBondContact O-N 3.42Å; S781-D784 WeakPolarHBondContact OG-CB 3.15Å; S781-D784 PolarHBondContact OG-N 3.45Å; S781-D784 PolarHBondContact OG-OD2 2.9Å; L782-D784 PolarHBondContact O-N 2.98Å; D784-S788 WeakPolarHBondContact O-CB 3.29Å; D784-S788 PolarHBondContact O-N 3.23Å; D784-S788 PolarHBondContact O-OG 3.42Å
785	V	92.5	Very high	89.7	Confident	8 Å²	8	47.5 Å²	47.5	5%	0.048	28%	0.282	C	S	.	.	H	α-helix	trans	-75.2	-44	179.1	-179.2	0	0	0	0	111	N779 S781 L782 G783 K790 A791 L794 L833	N779-V785 WeakPolarHBondContact O-CG2 3.19Å; S781-V785 WeakPolarHBondContact O-CG2 3.25Å; S781-V785 PolarHBondContact O-N 3Å; L782-V785 PolarHBondContact O-N 3.47Å; G783-V785 VanDerWaalsContact C-N 3.33Å; G783-V785 PolarHBondContact O-N 3.33Å; V785-K790 HydrophobicContact CG1-CB 4.36Å; V785-K790 CarbonylContact O-C 3.12Å; V785-A791 WeakPolarHBondContact O-CA 3.09Å; V785-A791 PolarHBondContact O-N 3.49Å; V785-L794 HydrophobicContact CB-CD1 4.2Å; V785-L794 HydrophobicContact CG1-CD1 3.68Å; V785-L794 HydrophobicContact CG1-CD2 4.08Å; V785-L794 HydrophobicContact CG1-CG 3.71Å; V785-L833 HydrophobicContact CG2-CD1 4.27Å
786	L	93.1	Very high	89.8	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-72.2	-37	-174	-174.4	63.3	0	0	0	113	L782 G783 A791 L794 E895 L896	L782-L786 HydrophobicContact CD1-CB 4.25Å; L782-L786 WeakPolarHBondContact O-CB 3.28Å; L782-L786 PolarHBondContact O-N 3.09Å; G783-L786 PolarHBondContact O-N 3.01Å; L786-A791 WeakPolarHBondContact O-CB 3.26Å; L786-L794 HydrophobicContact CB-CD1 4.2Å; L786-L794 HydrophobicContact CD1-CD1 4.15Å; L786-E895 HydrophobicContact CD2-CB 3.9Å; L786-L896 HydrophobicContact CD2-CD2 4.37Å
787	H	90.5	Very high	89.8	Confident	71 Å²	71	45.7 Å²	45.7	33%	0.329	28%	0.28	S	S	.	.	S	Bend	trans	-100.4	2.5	-175.4	-57.5	-47.8	0	0	0	114	G783 E895 K900	G783-H787 WeakPolarHBondContact O-CB 3.49Å; G783-H787 PolarHBondContact O-CD2 3.31Å; G783-H787 PolarHBondContact O-N 2.92Å; H787-E895 IonicContact CD2-OE1 2.85Å; H787-E895 IonicContact CE1-OE1 3.81Å; H787-E895 IonicContact NE2-OE1 2.82Å; H787-E895 PolarHBondContact NE2-OE1 2.82Å; H787-K900 PolarHBondContact CE1-O 3.12Å
788	S	87.5	Confident	89.9	Confident	46 Å²	46	46.6 Å²	46.6	32%	0.322	29%	0.286	S	S	.	.	S	Bend	trans	-100.3	-178.4	174.9	71.9	0	0	0	0	112.7	D784 K790 A791	D784-S788 WeakPolarHBondContact O-CB 3.29Å; D784-S788 PolarHBondContact O-N 3.23Å; D784-S788 PolarHBondContact O-OG 3.42Å; S788-K790 PolarHBondContact O-N 2.76Å; S788-K790 WeakPolarHBondContact OG-CB 3.49Å; S788-K790 PolarHBondContact OG-N 3.25Å; S788-A791 WeakPolarHBondContact O-CB 3.43Å; S788-A791 PolarHBondContact O-N 3.31Å; S788-A791 VanDerWaalsContact O-N 3.11Å
789	S	79.4	Confident	90.1	Very high	129 Å²	129	43.8 Å²	43.8	90%	0.902	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-59.4	-13.8	170.3	57.4	0	0	0	0	113.8	A791	S789-A791 VanDerWaalsContact C-N 3.3Å
790	K	81	Confident	90.2	Very high	126 Å²	126	41.7 Å²	41.7	55%	0.548	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-82.1	-2.3	176.6	-63.1	-177.1	-178.2	177.4	0	113.8	V785 S788 G792 L793	V785-K790 HydrophobicContact CG1-CB 4.36Å; V785-K790 CarbonylContact O-C 3.12Å; S788-K790 PolarHBondContact O-N 2.76Å; S788-K790 WeakPolarHBondContact OG-CB 3.49Å; S788-K790 PolarHBondContact OG-N 3.25Å; K790-G792 PolarHBondContact O-N 3.38Å; K790-L793 HydrophobicContact CB-CD1 4.07Å; K790-L793 HydrophobicContact CG-CD1 4.46Å; K790-L793 VanDerWaalsContact O-CB 3.3Å; K790-L793 WeakPolarHBondContact O-CB 3.16Å; K790-L793 WeakPolarHBondContact O-CG 3.44Å; K790-L793 PolarHBondContact O-N 2.5Å
791	A	80.1	Confident	90.4	Very high	2 Å²	2	44.2 Å²	44.2	2%	0.017	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-53	-30.6	-177.7	0	0	0	0	0	114	V785 L786 S788 S789 L793 L794	V785-A791 WeakPolarHBondContact O-CA 3.09Å; V785-A791 PolarHBondContact O-N 3.49Å; L786-A791 WeakPolarHBondContact O-CB 3.26Å; S788-A791 WeakPolarHBondContact O-CB 3.43Å; S788-A791 PolarHBondContact O-N 3.31Å; S788-A791 VanDerWaalsContact O-N 3.11Å; S789-A791 VanDerWaalsContact C-N 3.3Å; A791-L793 PolarHBondContact O-N 2.85Å; A791-L794 PolarHBondContact O-N 3.14Å; A791-L794 VanDerWaalsContact O-N 3.13Å
792	G	78.9	Confident	90.6	Very high	69 Å²	69	44 Å²	44	71%	0.711	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-66.6	-11	176.9	0	0	0	0	0	115	K790 L794	K790-G792 PolarHBondContact O-N 3.38Å; G792-L794 VanDerWaalsContact C-N 3.31Å
793	L	82.6	Confident	90.6	Very high	105 Å²	105	44.1 Å²	44.1	55%	0.55	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-75.9	-21	172.3	-63.3	175.8	0	0	0	112.5	K790 A791 D795	K790-L793 HydrophobicContact CB-CD1 4.07Å; K790-L793 HydrophobicContact CG-CD1 4.46Å; K790-L793 VanDerWaalsContact O-CB 3.3Å; K790-L793 WeakPolarHBondContact O-CB 3.16Å; K790-L793 WeakPolarHBondContact O-CG 3.44Å; K790-L793 PolarHBondContact O-N 2.5Å; A791-L793 PolarHBondContact O-N 2.85Å; L793-D795 PolarHBondContact O-N 3.5Å
794	L	91.8	Very high	90.9	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.016	26%	0.264	C	S	.	.			trans	-97.4	81.7	-178.2	-59.6	-178.9	0	0	0	110	L782 V785 L786 A791 G792 T798 R799 I802 F837	L782-L794 HydrophobicContact CD1-CD1 3.82Å; V785-L794 HydrophobicContact CB-CD1 4.2Å; V785-L794 HydrophobicContact CG1-CD1 3.68Å; V785-L794 HydrophobicContact CG1-CD2 4.08Å; V785-L794 HydrophobicContact CG1-CG 3.71Å; L786-L794 HydrophobicContact CB-CD1 4.2Å; L786-L794 HydrophobicContact CD1-CD1 4.15Å; A791-L794 PolarHBondContact O-N 3.14Å; A791-L794 VanDerWaalsContact O-N 3.13Å; G792-L794 VanDerWaalsContact C-N 3.31Å; L794-T798 HydrophobicContact CD2-CG2 3.68Å; L794-R799 HydrophobicContact CB-CG 3.86Å; L794-R799 PolarHBondContact O-NE 3.07Å; L794-I802 HydrophobicContact CD2-CD1 3.89Å; L794-F837 HydrophobicContact CD2-CD1 3.78Å; L794-F837 HydrophobicContact CD2-CE1 3.9Å
795	D	92.5	Very high	91.3	Very high	83 Å²	83	41.7 Å²	41.7	44%	0.444	24%	0.243	S	C	.	.			trans	-63.7	169.1	166.8	76.9	-18.1	0	0	0	111.3	L793 S797 T798 R799	L793-D795 PolarHBondContact O-N 3.5Å; D795-S797 VanDerWaalsContact C-N 3.26Å; D795-S797 PolarHBondContact O-N 3.14Å; D795-T798 PolarHBondContact O-N 3.22Å; D795-T798 WeakPolarHBondContact OD1-CB 3.42Å; D795-T798 PolarHBondContact OD1-N 3.43Å; D795-T798 PolarHBondContact OD1-OG1 3.49Å; D795-R799 WeakPolarHBondContact O-CG 3.29Å; D795-R799 PolarHBondContact O-N 2.77Å
796	W	94.9	Very high	91.5	Very high	6 Å²	6	41.3 Å²	41.3	2%	0.023	24%	0.241	C	C	.	.	H	α-helix	trans	-57.7	-40.7	-177.7	177.7	-111.5	0	0	0	112.5	T798 R799 Y800 V897 L933 F937 E940 I941 V944	W796-T798 VanDerWaalsContact C-N 3.32Å; W796-T798 PolarHBondContact O-N 2.76Å; W796-R799 HydrophobicContact CE3-CB 4.39Å; W796-R799 PolarHBondContact O-N 2.99Å; W796-Y800 HydrophobicContact CZ2-CD2 4.38Å; W796-Y800 VanDerWaalsContact O-CB 3.31Å; W796-Y800 WeakPolarHBondContact O-CB 3.24Å; W796-Y800 PolarHBondContact O-N 3.04Å; W796-V897 HydrophobicContact CH2-CG2 4.31Å; W796-V897 HydrophobicContact CZ3-CG2 4.31Å; W796-L933 HydrophobicContact CB-CD2 4.15Å; W796-L933 HydrophobicContact CE3-CD1 3.97Å; W796-L933 HydrophobicContact CE3-CD2 4.26Å; W796-L933 HydrophobicContact CZ3-CD1 4.34Å; W796-F937 HydrophobicContact CB-CB 4.29Å; W796-F937 HydrophobicContact CB-CD2 3.94Å; W796-F937 HydrophobicContact CB-CG 4.16Å; W796-F937 AromaticContact CD1-CD1 3.53Å; W796-F937 AromaticContact CD1-CD2 3.97Å; W796-F937 AromaticContact CD1-CG 3.32Å; W796-F937 HydrophobicContact CG-CB 3.78Å; W796-F937 HydrophobicContact CG-CD2 4.25Å; W796-F937 AromaticContact CG-CG 3.95Å; W796-F937 HydrophobicContact CG-CG 3.95Å; W796-E940 HydrophobicContact CZ2-CB 4.1Å; W796-E940 PolarHBondContact NE1-OE2 3.15Å; W796-I941 HydrophobicContact CD2-CD1 4.21Å; W796-I941 HydrophobicContact CD2-CG1 3.52Å; W796-I941 HydrophobicContact CE3-CD1 4.23Å; W796-I941 HydrophobicContact CE3-CG1 3.58Å; W796-I941 HydrophobicContact CG-CG1 4.21Å; W796-I941 HydrophobicContact CH2-CB 4.08Å; W796-I941 HydrophobicContact CH2-CG1 3.76Å; W796-I941 HydrophobicContact CH2-CG2 4.29Å; W796-I941 HydrophobicContact CZ2-CB 4.2Å; W796-I941 HydrophobicContact CZ2-CG1 3.71Å; W796-I941 HydrophobicContact CZ3-CB 4.31Å; W796-I941 HydrophobicContact CZ3-CG1 3.7Å; W796-I941 HydrophobicContact CZ3-CG2 4.25Å; W796-V944 HydrophobicContact CH2-CB 3.82Å; W796-V944 HydrophobicContact CH2-CG1 4.12Å; W796-V944 HydrophobicContact CH2-CG2 3.83Å; W796-V944 HydrophobicContact CZ2-CB 4.23Å; W796-V944 HydrophobicContact CZ2-CG2 3.77Å
797	S	94.2	Very high	91.8	Very high	40 Å²	40	41.1 Å²	41.1	28%	0.28	24%	0.24	S	C	.	.	H	α-helix	trans	-62	-40	179.9	-77.2	0	0	0	0	112.7	D795 K801 R973	D795-S797 VanDerWaalsContact C-N 3.26Å; D795-S797 PolarHBondContact O-N 3.14Å; S797-K801 WeakPolarHBondContact O-CB 3.48Å; S797-K801 PolarHBondContact O-N 2.68Å; S797-R973 PolarHBondContact OG-NH2 3.36Å
798	T	95.7	Very high	92.1	Very high	30 Å²	30	39.5 Å²	39.5	18%	0.184	23%	0.233	C	C	.	.	H	α-helix	trans	-69.9	-43.8	175.8	-54	0	0	0	0	111.1	L794 D795 W796 Y800 K801 I802 F837	L794-T798 HydrophobicContact CD2-CG2 3.68Å; D795-T798 PolarHBondContact O-N 3.22Å; D795-T798 WeakPolarHBondContact OD1-CB 3.42Å; D795-T798 PolarHBondContact OD1-N 3.43Å; D795-T798 PolarHBondContact OD1-OG1 3.49Å; W796-T798 VanDerWaalsContact C-N 3.32Å; W796-T798 PolarHBondContact O-N 2.76Å; T798-Y800 PolarHBondContact O-N 3.42Å; T798-K801 PolarHBondContact O-N 3.01Å; T798-I802 HydrophobicContact CG2-CD1 3.97Å; T798-I802 VanDerWaalsContact O-CG1 3.27Å; T798-I802 WeakPolarHBondContact O-CG1 3.49Å; T798-I802 PolarHBondContact O-N 3.01Å; T798-F837 HydrophobicContact CG2-CB 3.62Å; T798-F837 HydrophobicContact CG2-CD1 4.05Å; T798-F837 HydrophobicContact CG2-CG 3.84Å
799	R	96.5	Very high	92.6	Very high	3 Å²	3	37.3 Å²	37.3	1%	0.011	22%	0.218	C	C	.	.	H	α-helix	trans	-59.9	-43.6	175.6	-68.2	-166.5	-161.7	-169.8	1.6	112.3	L794 D795 W796 I802 A803 L896 D930	L794-R799 HydrophobicContact CB-CG 3.86Å; L794-R799 PolarHBondContact O-NE 3.07Å; D795-R799 WeakPolarHBondContact O-CG 3.29Å; D795-R799 PolarHBondContact O-N 2.77Å; W796-R799 HydrophobicContact CE3-CB 4.39Å; W796-R799 PolarHBondContact O-N 2.99Å; R799-I802 PolarHBondContact O-N 2.88Å; R799-A803 PolarHBondContact O-N 3.23Å; R799-L896 HydrophobicContact CB-CD2 3.95Å; R799-L896 WeakPolarHBondContact CD-O 3.29Å; R799-L896 HydrophobicContact CG-CD2 3.96Å; R799-L896 PolarHBondContact NH1-O 3.01Å; R799-D930 IonicContact CZ-OD2 2.73Å; R799-D930 VanDerWaalsContact CZ-OD2 3.25Å; R799-D930 IonicContact NH1-OD2 3.59Å; R799-D930 PolarHBondContact NH1-OD2 3.05Å; R799-D930 IonicContact NH2-OD2 2.73Å; R799-D930 PolarHBondContact NH2-OD2 2.99Å
800	Y	96.7	Very high	93.4	Very high	11 Å²	11	31.2 Å²	31.2	4%	0.043	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-42.9	176.6	177.1	-88.8	0	0	0	112	W796 T798 I802 A803 L804 V944 L969 V972 R973	W796-Y800 HydrophobicContact CZ2-CD2 4.38Å; W796-Y800 VanDerWaalsContact O-CB 3.31Å; W796-Y800 WeakPolarHBondContact O-CB 3.24Å; W796-Y800 PolarHBondContact O-N 3.04Å; T798-Y800 PolarHBondContact O-N 3.42Å; Y800-I802 VanDerWaalsContact C-N 3.35Å; Y800-I802 PolarHBondContact O-N 3.37Å; Y800-A803 WeakPolarHBondContact O-CB 3.35Å; Y800-A803 PolarHBondContact O-N 3.39Å; Y800-L804 PolarHBondContact O-N 2.96Å; Y800-V944 HydrophobicContact CD2-CG2 4.16Å; Y800-V944 HydrophobicContact CE2-CG2 4.41Å; Y800-L969 PolarHBondContact OH-O 3.35Å; Y800-V972 HydrophobicContact CE2-CB 4.04Å; Y800-V972 HydrophobicContact CE2-CG1 4.23Å; Y800-R973 VanDerWaalsContact CD1-CZ 3.44Å; Y800-R973 VanDerWaalsContact CE1-CD 3.43Å; Y800-R973 HydrophobicContact CE1-CG 4.02Å; Y800-R973 HydrophobicContact CE2-CG 4.38Å
801	K	96.6	Very high	94.1	Very high	82 Å²	82	25.6 Å²	25.6	36%	0.357	15%	0.152	S	C	.	.	H	α-helix	trans	-58.2	-47.5	173.9	180	-172	172	-172.4	0	111.1	S797 T798 A803 L804 D805 E836	S797-K801 WeakPolarHBondContact O-CB 3.48Å; S797-K801 PolarHBondContact O-N 2.68Å; T798-K801 PolarHBondContact O-N 3.01Å; K801-A803 VanDerWaalsContact C-N 3.35Å; K801-A803 PolarHBondContact O-N 3.36Å; K801-L804 PolarHBondContact O-N 3.49Å; K801-D805 WeakPolarHBondContact O-CB 3.34Å; K801-D805 PolarHBondContact O-N 2.82Å; K801-E836 PolarHBondContact NZ-O 3.25Å
802	I	98	Very high	94.8	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-59.9	-44.6	178.4	-70.9	166.8	0	0	0	111.2	L782 L794 T798 R799 Y800 L804 D805 A806 I831 L833 F837 A839	L782-I802 HydrophobicContact CD1-CD1 4.21Å; L782-I802 HydrophobicContact CD1-CG2 4.21Å; L782-I802 HydrophobicContact CD2-CG2 3.85Å; L794-I802 HydrophobicContact CD2-CD1 3.89Å; T798-I802 HydrophobicContact CG2-CD1 3.97Å; T798-I802 VanDerWaalsContact O-CG1 3.27Å; T798-I802 WeakPolarHBondContact O-CG1 3.49Å; T798-I802 PolarHBondContact O-N 3.01Å; R799-I802 PolarHBondContact O-N 2.88Å; Y800-I802 VanDerWaalsContact C-N 3.35Å; Y800-I802 PolarHBondContact O-N 3.37Å; I802-L804 PolarHBondContact O-N 3.41Å; I802-D805 PolarHBondContact O-N 2.95Å; I802-A806 WeakPolarHBondContact O-CB 3.43Å; I802-A806 PolarHBondContact O-N 2.79Å; I802-I831 HydrophobicContact CG2-CG2 4.47Å; I802-L833 HydrophobicContact CD1-CD1 4.11Å; I802-L833 HydrophobicContact CD1-CD2 3.72Å; I802-L833 HydrophobicContact CG1-CD2 3.77Å; I802-L833 HydrophobicContact CG2-CD2 4.31Å; I802-F837 WeakPolarHBondContact CG1-O 3.39Å; I802-A839 HydrophobicContact CB-CB 4.27Å; I802-A839 HydrophobicContact CG1-CB 4.39Å; I802-A839 HydrophobicContact CG2-CB 3.91Å
803	A	97.8	Very high	95.5	Very high	2 Å²	2	24.4 Å²	24.4	2%	0.017	13%	0.125	C	C	.	.	H	α-helix	trans	-57.6	-48	175.8	0	0	0	0	0	111.7	R799 Y800 K801 A807 F889 L893 L896	R799-A803 PolarHBondContact O-N 3.23Å; Y800-A803 WeakPolarHBondContact O-CB 3.35Å; Y800-A803 PolarHBondContact O-N 3.39Å; K801-A803 VanDerWaalsContact C-N 3.35Å; K801-A803 PolarHBondContact O-N 3.36Å; A803-A807 VanDerWaalsContact O-CB 3.27Å; A803-A807 WeakPolarHBondContact O-CB 3.46Å; A803-A807 PolarHBondContact O-N 3.19Å; A803-F889 WeakPolarHBondContact O-CZ 3.32Å; A803-L893 HydrophobicContact CB-CD2 3.59Å; A803-L896 HydrophobicContact CB-CD1 3.87Å
804	L	97.8	Very high	95.8	Very high	32 Å²	32	19.9 Å²	19.9	17%	0.168	10%	0.102	C	C	.	.	H	α-helix	trans	-65.9	-46.5	-179.7	-177	60.1	0	0	0	112	Y800 K801 I802 A806 A807 E808 V966 L969 Q970	Y800-L804 PolarHBondContact O-N 2.96Å; K801-L804 PolarHBondContact O-N 3.49Å; I802-L804 PolarHBondContact O-N 3.41Å; L804-A806 PolarHBondContact O-N 2.63Å; L804-A807 PolarHBondContact O-N 2.87Å; L804-E808 HydrophobicContact CD1-CG 4.47Å; L804-E808 WeakPolarHBondContact O-CG 3.3Å; L804-E808 PolarHBondContact O-N 3.03Å; L804-V966 HydrophobicContact CD1-CG1 4.16Å; L804-L969 HydrophobicContact CD1-CB 4.12Å; L804-Q970 HydrophobicContact CD1-CG 3.77Å; L804-Q970 HydrophobicContact CD2-CG 4.31Å
805	D	98.3	Very high	95.5	Very high	22 Å²	22	22 Å²	22	12%	0.118	11%	0.111	C	C	.	.	H	α-helix	trans	-59.1	-47.9	178.1	-86.2	-23.4	0	0	0	111.8	N756 K801 I802 A807 E808 G809 G838 A839	N756-D805 WeakPolarHBondContact CB-O 3.29Å; N756-D805 WeakPolarHBondContact ND2-CA 3.09Å; N756-D805 WeakPolarHBondContact ND2-CB 3.11Å; N756-D805 PolarHBondContact ND2-OD1 2.89Å; K801-D805 WeakPolarHBondContact O-CB 3.34Å; K801-D805 PolarHBondContact O-N 2.82Å; I802-D805 PolarHBondContact O-N 2.95Å; D805-A807 VanDerWaalsContact C-N 3.34Å; D805-A807 PolarHBondContact O-N 3.24Å; D805-E808 PolarHBondContact O-N 3.44Å; D805-G809 PolarHBondContact O-N 2.75Å; D805-G838 WeakPolarHBondContact OD2-CA 3.44Å; D805-A839 HydrophobicContact CB-CB 3.64Å; D805-A839 PolarHBondContact OD2-N 3.01Å
806	A	98.3	Very high	94.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.5	-38.9	177.1	0	0	0	0	0	112	I802 L804 G809 L810 I831 A839 F889	I802-A806 WeakPolarHBondContact O-CB 3.43Å; I802-A806 PolarHBondContact O-N 2.79Å; L804-A806 PolarHBondContact O-N 2.63Å; A806-G809 PolarHBondContact O-N 2.85Å; A806-L810 WeakPolarHBondContact O-CG 3.46Å; A806-L810 PolarHBondContact O-N 2.67Å; A806-I831 HydrophobicContact CB-CD1 3.99Å; A806-I831 HydrophobicContact CB-CG1 4.49Å; A806-I831 HydrophobicContact CB-CG2 4.38Å; A806-A839 HydrophobicContact CB-CB 4.46Å; A806-F889 HydrophobicContact CB-CE2 3.88Å
807	A	98	Very high	94.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.3	-42.1	175.7	0	0	0	0	0	112.2	A803 L804 D805 L810 S811 F889 M962 V966 L969	A803-A807 VanDerWaalsContact O-CB 3.27Å; A803-A807 WeakPolarHBondContact O-CB 3.46Å; A803-A807 PolarHBondContact O-N 3.19Å; L804-A807 PolarHBondContact O-N 2.87Å; D805-A807 VanDerWaalsContact C-N 3.34Å; D805-A807 PolarHBondContact O-N 3.24Å; A807-L810 PolarHBondContact O-N 3.11Å; A807-S811 VanDerWaalsContact O-CB 3.25Å; A807-S811 WeakPolarHBondContact O-CB 3.35Å; A807-S811 PolarHBondContact O-N 3.4Å; A807-F889 HydrophobicContact CB-CE1 3.96Å; A807-F889 HydrophobicContact CB-CE2 4.36Å; A807-F889 HydrophobicContact CB-CZ 3.62Å; A807-M962 HydrophobicContact CB-CE 3.7Å; A807-V966 VanDerWaalsContact C-CG2 3.43Å; A807-V966 HydrophobicContact CB-CG2 3.68Å; A807-V966 WeakPolarHBondContact O-CG2 3.39Å; A807-L969 HydrophobicContact CB-CD1 3.75Å
808	E	97.6	Very high	93.1	Very high	38 Å²	38	25.4 Å²	25.4	18%	0.178	13%	0.128	C	C	.	.	H	α-helix	trans	-62.8	-42.4	175.7	-75	-178.1	-174.9	0	0	111.1	K755 L804 D805 S811 Y812 V966	K755-E808 WeakPolarHBondContact CE-OE2 3.29Å; K755-E808 IonicContact NZ-OE2 3.63Å; K755-E808 PolarHBondContact NZ-OE2 3.27Å; L804-E808 HydrophobicContact CD1-CG 4.47Å; L804-E808 WeakPolarHBondContact O-CG 3.3Å; L804-E808 PolarHBondContact O-N 3.03Å; D805-E808 PolarHBondContact O-N 3.44Å; E808-S811 PolarHBondContact O-N 2.95Å; E808-Y812 PolarHBondContact O-N 3.33Å; E808-V966 HydrophobicContact CG-CG1 3.91Å; E808-V966 HydrophobicContact CG-CG2 4.18Å
809	G	97	Very high	92.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.2	-46.8	174.8	0	0	0	0	0	113.4	D805 A806 Y812 L813	D805-G809 PolarHBondContact O-N 2.75Å; A806-G809 PolarHBondContact O-N 2.85Å; G809-Y812 PolarHBondContact O-N 2.85Å; G809-L813 WeakPolarHBondContact O-CG 3.42Å; G809-L813 PolarHBondContact O-N 2.83Å
810	L	97.2	Very high	91.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69.5	-38.3	177.1	-69.7	173	0	0	0	112.3	A806 A807 Y812 L813 H814 H823 V826 V841 F889 M962	A806-L810 WeakPolarHBondContact O-CG 3.46Å; A806-L810 PolarHBondContact O-N 2.67Å; A807-L810 PolarHBondContact O-N 3.11Å; L810-Y812 VanDerWaalsContact C-N 3.28Å; L810-Y812 PolarHBondContact O-N 3.13Å; L810-L813 HydrophobicContact CD2-CD1 4.34Å; L810-L813 PolarHBondContact O-N 2.73Å; L810-H814 PolarHBondContact O-N 2.95Å; L810-H823 HydrophobicContact CD2-CB 4.47Å; L810-V826 HydrophobicContact CD1-CG1 4.04Å; L810-V826 HydrophobicContact CD1-CG2 4.31Å; L810-V826 HydrophobicContact CD2-CG2 3.67Å; L810-V841 HydrophobicContact CD2-CG1 4.32Å; L810-V841 HydrophobicContact CD2-CG2 4.35Å; L810-V841 HydrophobicContact CG-CG2 4.22Å; L810-F889 HydrophobicContact CD1-CB 3.85Å; L810-F889 HydrophobicContact CD1-CD2 3.56Å; L810-F889 HydrophobicContact CD1-CE2 4.37Å; L810-F889 HydrophobicContact CD1-CG 3.83Å; L810-M962 HydrophobicContact CB-CE 3.99Å; L810-M962 HydrophobicContact CB-CG 4.07Å; L810-M962 HydrophobicContact CB-SD 4.43Å; L810-M962 HydrophobicContact CD1-CE 4.3Å
811	S	95.8	Very high	91	Very high	9 Å²	9	27.7 Å²	27.7	6%	0.063	15%	0.147	C	C	.	.	H	α-helix	trans	-59	-42.1	175	-178	0	0	0	0	111.4	A807 E808 L813 H814 H815 R963	A807-S811 VanDerWaalsContact O-CB 3.25Å; A807-S811 WeakPolarHBondContact O-CB 3.35Å; A807-S811 PolarHBondContact O-N 3.4Å; E808-S811 PolarHBondContact O-N 2.95Å; S811-L813 PolarHBondContact O-N 3.32Å; S811-H814 PolarHBondContact O-N 2.63Å; S811-H815 WeakPolarHBondContact O-CB 3.2Å; S811-H815 PolarHBondContact O-CD2 2.88Å; S811-H815 PolarHBondContact O-N 2.96Å; S811-R963 WeakPolarHBondContact OG-CA 3.31Å; S811-R963 PolarHBondContact OG-N 2.92Å
812	Y	94.9	Very high	90.6	Very high	45 Å²	45	23.9 Å²	23.9	18%	0.176	13%	0.131	C	C	.	.	I	π-helix	trans	-59.7	-46.4	175.5	175.6	-91.7	0	0	0	111.8	I752 H754 I757 E808 G809 L810 H814 D816 Y817	I752-Y812 HydrophobicContact CG2-CD1 4.5Å; I752-Y812 HydrophobicContact CG2-CE1 3.88Å; H754-Y812 HydrophobicContact CB-CD1 4.05Å; H754-Y812 HydrophobicContact CB-CE1 4.24Å; H754-Y812 HydrophobicContact CB-CG 4.24Å; H754-Y812 AromaticContact CD2-CD2 3.66Å; H754-Y812 AromaticContact CD2-CG 3.7Å; H754-Y812 AromaticContact CG-CG 3.94Å; I757-Y812 HydrophobicContact CD1-CD1 3.64Å; I757-Y812 HydrophobicContact CD1-CE1 4.26Å; E808-Y812 PolarHBondContact O-N 3.33Å; G809-Y812 PolarHBondContact O-N 2.85Å; L810-Y812 VanDerWaalsContact C-N 3.28Å; L810-Y812 PolarHBondContact O-N 3.13Å; Y812-H814 PolarHBondContact O-N 3.02Å; Y812-D816 HydrophobicContact CD2-CB 3.68Å; Y812-D816 HydrophobicContact CE2-CB 4.16Å; Y812-D816 HydrophobicContact CG-CB 4.34Å; Y812-D816 CarbonylContact O-C 3.14Å; Y812-D816 PolarHBondContact O-N 3.17Å; Y812-Y817 AromaticContact CE1-CD2 4Å; Y812-Y817 HydrophobicContact CE1-CD2 4Å; Y812-Y817 HydrophobicContact CE1-CG 4.42Å; Y812-Y817 PolarHBondContact O-N 2.63Å
813	L	92.7	Very high	90.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	I	π-helix	trans	-62.1	-40.4	179.5	-68	173.8	0	0	0	113.2	I752 I757 G809 L810 S811 I821 F844	I752-L813 HydrophobicContact CD1-CD2 3.73Å; I757-L813 HydrophobicContact CD1-CD1 4.36Å; I757-L813 HydrophobicContact CD1-CD2 3.69Å; I757-L813 HydrophobicContact CD1-CG 3.78Å; G809-L813 WeakPolarHBondContact O-CG 3.42Å; G809-L813 PolarHBondContact O-N 2.83Å; L810-L813 HydrophobicContact CD2-CD1 4.34Å; L810-L813 PolarHBondContact O-N 2.73Å; S811-L813 PolarHBondContact O-N 3.32Å; L813-I821 HydrophobicContact CB-CB 4.49Å; L813-I821 HydrophobicContact CD2-CB 4.28Å; L813-I821 HydrophobicContact CD2-CG2 4.36Å; L813-I821 PolarHBondContact O-N 2.85Å; L813-F844 HydrophobicContact CD1-CE1 3.59Å; L813-F844 HydrophobicContact CD1-CZ 3.81Å; L813-F844 HydrophobicContact CD2-CE1 3.76Å; L813-F844 HydrophobicContact CD2-CZ 4.26Å; L813-F844 HydrophobicContact CG-CE1 4.34Å
814	H	90.5	Very high	89.9	Confident	11 Å²	11	24.7 Å²	24.7	5%	0.051	13%	0.133	C	C	.	.	I	π-helix	trans	-80.6	-36.2	-175.4	-66.2	174.5	0	0	0	113.3	L810 S811 Y812 A820 I821 E882 D885 M962	L810-H814 PolarHBondContact O-N 2.95Å; S811-H814 PolarHBondContact O-N 2.63Å; Y812-H814 PolarHBondContact O-N 3.02Å; H814-A820 VanDerWaalsContact O-CB 3.29Å; H814-A820 WeakPolarHBondContact O-CB 3.41Å; H814-I821 PolarHBondContact CD2-O 3.16Å; H814-E882 HydrophobicContact CB-CB 4.26Å; H814-D885 IonicContact CD2-OD2 3.66Å; H814-D885 VanDerWaalsContact CE1-CB 3.42Å; H814-D885 WeakPolarHBondContact CE1-CB 3.14Å; H814-D885 IonicContact CE1-OD2 2.98Å; H814-D885 WeakPolarHBondContact NE2-CB 3.25Å; H814-D885 IonicContact NE2-OD2 2.91Å; H814-D885 PolarHBondContact NE2-OD2 2.9Å; H814-M962 WeakPolarHBondContact ND1-CG 3.36Å
815	H	84.3	Confident	89.6	Confident	46 Å²	46	24 Å²	24	21%	0.213	13%	0.13	C	C	.	.	I	π-helix	trans	-122.4	-27.7	-165.1	-55.6	-71.8	0	0	0	114.6	Y104 S811 M962 R963	Y104-H815 PolarHBondContact OH-O 3.45Å; Y104-H815 VanDerWaalsContact OH-O 3.1Å; S811-H815 WeakPolarHBondContact O-CB 3.2Å; S811-H815 PolarHBondContact O-CD2 2.88Å; S811-H815 PolarHBondContact O-N 2.96Å; H815-M962 PolarHBondContact NE2-N 2.88Å; H815-R963 VanDerWaalsContact CB-NH2 3.27Å
816	D	80.4	Confident	89.4	Confident	72 Å²	72	23 Å²	23	39%	0.385	13%	0.125	S	C	.	.	I	π-helix	trans	-109	-21.1	-172.2	-51.2	-33.4	0	0	0	112.5	Y812 R963	Y812-D816 HydrophobicContact CD2-CB 3.68Å; Y812-D816 HydrophobicContact CE2-CB 4.16Å; Y812-D816 HydrophobicContact CG-CB 4.34Å; Y812-D816 CarbonylContact O-C 3.14Å; Y812-D816 PolarHBondContact O-N 3.17Å; D816-R963 IonicContact OD1-CZ 2.63Å; D816-R963 IonicContact OD1-NH2 3.64Å; D816-R963 PolarHBondContact OD1-NH2 2.79Å
817	Y	79.3	Confident	89.3	Confident	34 Å²	34	24.7 Å²	24.7	13%	0.133	13%	0.132	C	C	.	.	S	Bend	trans	-90.6	126.4	173	-169.9	-88.9	0	0	0	110.6	K751 I752 Y812 P819 A820 I821	K751-Y817 WeakPolarHBondContact CB-OH 3.16Å; I752-Y817 HydrophobicContact CG1-CD2 3.78Å; I752-Y817 HydrophobicContact CG1-CE2 3.5Å; I752-Y817 VanDerWaalsContact CG1-CE2 3.5Å; I752-Y817 HydrophobicContact CG1-CG 4.47Å; Y812-Y817 AromaticContact CE1-CD2 4Å; Y812-Y817 HydrophobicContact CE1-CD2 4Å; Y812-Y817 HydrophobicContact CE1-CG 4.42Å; Y812-Y817 PolarHBondContact O-N 2.63Å; Y817-P819 WeakPolarHBondContact CD1-O 3.41Å; Y817-P819 CarbonylContact O-C 3.22Å; Y817-P819 VanDerWaalsContact O-C 3.24Å; Y817-A820 VanDerWaalsContact O-CA 3.24Å; Y817-A820 WeakPolarHBondContact O-CA 3.25Å; Y817-A820 PolarHBondContact O-N 3.15Å; Y817-A820 VanDerWaalsContact O-N 3.16Å; Y817-I821 HydrophobicContact CD1-CD1 3.4Å; Y817-I821 VanDerWaalsContact CD1-CD1 3.4Å; Y817-I821 HydrophobicContact CD1-CG1 3.7Å; Y817-I821 HydrophobicContact CE1-CD1 3.25Å; Y817-I821 HydrophobicContact CE1-CG1 3.83Å; Y817-I821 HydrophobicContact CG-CD1 4.21Å
818	V	72.6	Confident	89.2	Confident	96 Å²	96	24.8 Å²	24.8	58%	0.582	13%	0.132	S	C	*	.	S	Bend	trans	-117.5	127.4	-177.5	-178.2	0	0	0	0	110.8
819	P	77.1	Confident	89.1	Confident	59 Å²	59	26.6 Å²	26.6	38%	0.383	14%	0.144	S	C	.	.	S	Bend	cis	-67.6	149.4	-9.3	28.4	-37.1	0	0	0	112.9	Y817 V849	Y817-P819 WeakPolarHBondContact CD1-O 3.41Å; Y817-P819 CarbonylContact O-C 3.22Å; Y817-P819 VanDerWaalsContact O-C 3.24Å; P819-V849 HydrophobicContact CB-CG1 3.6Å; P819-V849 HydrophobicContact CG-CB 4.45Å; P819-V849 HydrophobicContact CG-CG1 3.16Å
820	A	79.7	Confident	88.9	Confident	31 Å²	31	27.3 Å²	27.3	26%	0.256	15%	0.147	S	C	.	.			trans	-53	142.5	-177.9	0	0	0	0	0	112.4	H814 Y817 V849 V850	H814-A820 VanDerWaalsContact O-CB 3.29Å; H814-A820 WeakPolarHBondContact O-CB 3.41Å; Y817-A820 VanDerWaalsContact O-CA 3.24Å; Y817-A820 WeakPolarHBondContact O-CA 3.25Å; Y817-A820 PolarHBondContact O-N 3.15Å; Y817-A820 VanDerWaalsContact O-N 3.16Å; A820-V849 WeakPolarHBondContact O-CA 3.47Å; A820-V850 PolarHBondContact O-N 2.92Å
821	I	87	Confident	89	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127.6	178.9	-68.3	172.2	0	0	0	108.9	T748 I752 L813 H814 Y817 A847 K848 V849	T748-I821 HydrophobicContact CG2-CD1 4.04Å; T748-I821 HydrophobicContact CG2-CG2 4.44Å; I752-I821 HydrophobicContact CD1-CD1 3.63Å; I752-I821 HydrophobicContact CG1-CD1 4.32Å; L813-I821 HydrophobicContact CB-CB 4.49Å; L813-I821 HydrophobicContact CD2-CB 4.28Å; L813-I821 HydrophobicContact CD2-CG2 4.36Å; L813-I821 PolarHBondContact O-N 2.85Å; H814-I821 PolarHBondContact CD2-O 3.16Å; Y817-I821 HydrophobicContact CD1-CD1 3.4Å; Y817-I821 VanDerWaalsContact CD1-CD1 3.4Å; Y817-I821 HydrophobicContact CD1-CG1 3.7Å; Y817-I821 HydrophobicContact CE1-CD1 3.25Å; Y817-I821 HydrophobicContact CE1-CG1 3.83Å; Y817-I821 HydrophobicContact CG-CD1 4.21Å; I821-A847 HydrophobicContact CG2-CB 4.1Å; I821-K848 WeakPolarHBondContact CA-O 3.43Å; I821-V849 HydrophobicContact CG1-CG2 4.18Å
822	V	88	Confident	89	Confident	2 Å²	2	29 Å²	29	1%	0.012	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.3	167.7	-175.5	0	0	0	0	108	R824 A847 K848 V850 V880 E882 D885	V822-R824 HydrophobicContact CB-CG 4.31Å; V822-R824 HydrophobicContact CG1-CG 3.73Å; V822-A847 VanDerWaalsContact O-CA 3.31Å; V822-A847 WeakPolarHBondContact O-CA 3.48Å; V822-K848 PolarHBondContact N-O 3.46Å; V822-K848 PolarHBondContact O-N 3.13Å; V822-V850 HydrophobicContact CB-CG2 4.41Å; V822-V850 HydrophobicContact CG2-CG2 3.39Å; V822-V880 HydrophobicContact CB-CG1 4.13Å; V822-V880 HydrophobicContact CG1-CG1 3.72Å; V822-E882 HydrophobicContact CG2-CB 4.36Å; V822-D885 WeakPolarHBondContact CA-OD2 3.3Å; V822-D885 WeakPolarHBondContact CG1-OD2 3.49Å
823	H	92.4	Very high	89.1	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.			trans	-71	-44	-175.7	-170.8	-83	0	0	0	112.3	L810 D825 V826 A842 D843 F844 D885	L810-H823 HydrophobicContact CD2-CB 4.47Å; H823-D825 PolarHBondContact CE1-O 2.84Å; H823-D825 VanDerWaalsContact ND1-C 3.28Å; H823-D825 PolarHBondContact ND1-N 2.93Å; H823-D825 PolarHBondContact ND1-O 3.36Å; H823-D825 PolarHBondContact O-N 2.84Å; H823-D825 VanDerWaalsContact O-N 3.12Å; H823-V826 HydrophobicContact CB-CG2 3.78Å; H823-V826 PolarHBondContact ND1-N 3Å; H823-A842 PolarHBondContact CE1-O 3.04Å; H823-A842 PolarHBondContact NE2-O 3.28Å; H823-D843 PolarHBondContact CE1-O 3.39Å; H823-D843 VanDerWaalsContact CE1-O 3.26Å; H823-D843 PolarHBondContact NE2-O 2.91Å; H823-F844 AromaticContact CD2-CD1 3.97Å; H823-F844 AromaticContact CD2-CE1 3.76Å; H823-F844 AromaticContact CD2-CZ 3.84Å; H823-D885 WeakPolarHBondContact CB-OD2 3.35Å; H823-D885 PolarHBondContact N-OD1 2.97Å; H823-D885 PolarHBondContact N-OD2 3.35Å
824	R	88.8	Confident	89.2	Confident	21 Å²	21	28 Å²	28	8%	0.079	15%	0.153	C	C	.	.	S	Bend	trans	69.1	-12.1	177	-56.5	172.4	60.6	-155.5	3.2	117.2	V822 V846 V862 A864 G865 Y874 V880 D885	V822-R824 HydrophobicContact CB-CG 4.31Å; V822-R824 HydrophobicContact CG1-CG 3.73Å; R824-V846 HydrophobicContact CB-CG2 4.17Å; R824-V846 WeakPolarHBondContact CD-O 3.36Å; R824-V846 PolarHBondContact NH1-O 3.15Å; R824-V862 PolarHBondContact NH2-O 3.41Å; R824-A864 VanDerWaalsContact NH2-CB 3.26Å; R824-G865 WeakPolarHBondContact O-CA 3.43Å; R824-Y874 PolarHBondContact NH2-OH 3.41Å; R824-V880 HydrophobicContact CG-CG1 3.79Å; R824-D885 WeakPolarHBondContact CA-OD1 3.4Å; R824-D885 PolarHBondContact N-OD1 2.71Å
825	D	91.2	Very high	89.3	Confident	16 Å²	16	30.4 Å²	30.4	9%	0.086	17%	0.174	C	C	.	.			trans	-132.8	48.6	173.1	-164.2	39.7	0	0	0	111.7	H823 K827 N830 V846 S866	H823-D825 PolarHBondContact CE1-O 2.84Å; H823-D825 VanDerWaalsContact ND1-C 3.28Å; H823-D825 PolarHBondContact ND1-N 2.93Å; H823-D825 PolarHBondContact ND1-O 3.36Å; H823-D825 PolarHBondContact O-N 2.84Å; H823-D825 VanDerWaalsContact O-N 3.12Å; D825-K827 PolarHBondContact O-N 2.96Å; D825-K827 IonicContact OD1-NZ 2.77Å; D825-K827 WeakPolarHBondContact OD2-CE 3.38Å; D825-K827 IonicContact OD2-NZ 3.61Å; D825-K827 PolarHBondContact OD2-NZ 3.17Å; D825-N830 PolarHBondContact O-ND2 2.91Å; D825-N830 PolarHBondContact OD2-ND2 2.94Å; D825-N830 VanDerWaalsContact OD2-ND2 3.12Å; D825-V846 HydrophobicContact CB-CG2 3.75Å; D825-S866 WeakPolarHBondContact OD1-CB 3.49Å; D825-S866 PolarHBondContact OD1-N 2.84Å; D825-S866 PolarHBondContact OD1-OG 2.79Å
826	V	95.4	Very high	89.8	Confident	3 Å²	3	34.6 Å²	34.6	2%	0.018	19%	0.194	C	C	.	.			trans	-69.3	123.8	173	179.7	0	0	0	0	108.5	L810 H823 D885 S888 F889 V892	L810-V826 HydrophobicContact CD1-CG1 4.04Å; L810-V826 HydrophobicContact CD1-CG2 4.31Å; L810-V826 HydrophobicContact CD2-CG2 3.67Å; H823-V826 HydrophobicContact CB-CG2 3.78Å; H823-V826 PolarHBondContact ND1-N 3Å; V826-D885 HydrophobicContact CG2-CB 4.13Å; V826-S888 WeakPolarHBondContact O-CB 3.35Å; V826-F889 HydrophobicContact CG1-CB 4.45Å; V826-V892 HydrophobicContact CG1-CG2 4.49Å
827	K	95.5	Very high	90.4	Very high	35 Å²	35	33.4 Å²	33.4	15%	0.152	19%	0.186	C	C	.	.			trans	-159.1	161.1	177.2	58.8	-172.4	176.9	-152.4	0	110.1	D825 N829 N830 I831 S866 Y869	D825-K827 PolarHBondContact O-N 2.96Å; D825-K827 IonicContact OD1-NZ 2.77Å; D825-K827 WeakPolarHBondContact OD2-CE 3.38Å; D825-K827 IonicContact OD2-NZ 3.61Å; D825-K827 PolarHBondContact OD2-NZ 3.17Å; K827-N829 HydrophobicContact CD-CB 4.46Å; K827-N829 HydrophobicContact CG-CB 4.36Å; K827-N829 PolarHBondContact O-N 3.11Å; K827-N830 VanDerWaalsContact CE-ND2 3.3Å; K827-N830 WeakPolarHBondContact CE-ND2 3.26Å; K827-N830 WeakPolarHBondContact CE-OD1 3.34Å; K827-N830 HydrophobicContact CG-CB 3.81Å; K827-N830 PolarHBondContact O-N 3.23Å; K827-I831 PolarHBondContact O-N 3.07Å; K827-S866 VanDerWaalsContact CD-OG 3.3Å; K827-S866 WeakPolarHBondContact CD-OG 3.46Å; K827-S866 PolarHBondContact NZ-OG 2.75Å; K827-Y869 HydrophobicContact CB-CD1 3.92Å; K827-Y869 HydrophobicContact CB-CD2 3.76Å; K827-Y869 HydrophobicContact CB-CE1 3.73Å; K827-Y869 HydrophobicContact CB-CE2 3.53Å; K827-Y869 HydrophobicContact CB-CG 3.93Å
828	S	96.3	Very high	91.2	Very high	1 Å²	1	32 Å²	32	1%	0.007	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-57.3	-32.6	179.1	55.7	0	0	0	0	113	L782 G783 N830 I831 Y869 E895	L782-S828 WeakPolarHBondContact CB-O 3.4Å; L782-S828 PolarHBondContact N-O 3.25Å; G783-S828 PolarHBondContact N-O 3.27Å; S828-N830 VanDerWaalsContact C-N 3.3Å; S828-N830 PolarHBondContact O-N 2.76Å; S828-I831 PolarHBondContact O-N 3.07Å; S828-Y869 PolarHBondContact N-OH 2.96Å; S828-Y869 PolarHBondContact OG-OH 2.79Å; S828-E895 WeakPolarHBondContact CB-OE2 3.49Å; S828-E895 PolarHBondContact OG-OE1 2.97Å; S828-E895 PolarHBondContact OG-OE2 3.22Å
829	N	94.3	Very high	92.4	Very high	77 Å²	77	27.4 Å²	27.4	41%	0.412	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-71.8	-18.8	175.4	-70.1	-14.5	0	0	0	114.8	S781 G783 K827	S781-N829 VanDerWaalsContact CB-O 3.3Å; S781-N829 WeakPolarHBondContact CB-O 3.42Å; S781-N829 PolarHBondContact OG-OD1 2.91Å; G783-N829 VanDerWaalsContact CA-OD1 3.28Å; G783-N829 WeakPolarHBondContact CA-OD1 3.48Å; K827-N829 HydrophobicContact CD-CB 4.46Å; K827-N829 HydrophobicContact CG-CB 4.36Å; K827-N829 PolarHBondContact O-N 3.11Å
830	N	94.6	Very high	93.4	Very high	14 Å²	14	26.4 Å²	26.4	8%	0.075	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-98.5	7.2	177.1	-76.4	3.6	0	0	0	112.3	D825 K827 S828 A842	D825-N830 PolarHBondContact O-ND2 2.91Å; D825-N830 PolarHBondContact OD2-ND2 2.94Å; D825-N830 VanDerWaalsContact OD2-ND2 3.12Å; K827-N830 VanDerWaalsContact CE-ND2 3.3Å; K827-N830 WeakPolarHBondContact CE-ND2 3.26Å; K827-N830 WeakPolarHBondContact CE-OD1 3.34Å; K827-N830 HydrophobicContact CG-CB 3.81Å; K827-N830 PolarHBondContact O-N 3.23Å; S828-N830 VanDerWaalsContact C-N 3.3Å; S828-N830 PolarHBondContact O-N 2.76Å; N830-A842 WeakPolarHBondContact CB-O 3.17Å; N830-A842 WeakPolarHBondContact O-CB 3.44Å; N830-A842 PolarHBondContact O-N 3.28Å
831	I	97.3	Very high	94.2	Very high	2 Å²	2	25 Å²	25	1%	0.01	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	108.5	170.7	-64.1	169.1	0	0	0	106.9	S781 L782 I802 A806 K827 S828 A839 V892	S781-I831 CarbonylContact C-O 3.57Å; S781-I831 WeakPolarHBondContact CA-O 3.47Å; L782-I831 HydrophobicContact CB-CB 4.25Å; L782-I831 HydrophobicContact CB-CG2 4.3Å; L782-I831 HydrophobicContact CD2-CD1 4.43Å; L782-I831 HydrophobicContact CD2-CG2 4.47Å; L782-I831 PolarHBondContact N-O 3.32Å; I802-I831 HydrophobicContact CG2-CG2 4.47Å; A806-I831 HydrophobicContact CB-CD1 3.99Å; A806-I831 HydrophobicContact CB-CG1 4.49Å; A806-I831 HydrophobicContact CB-CG2 4.38Å; K827-I831 PolarHBondContact O-N 3.07Å; S828-I831 PolarHBondContact O-N 3.07Å; I831-A839 HydrophobicContact CG2-CB 3.77Å; I831-V892 HydrophobicContact CD1-CG1 3.7Å; I831-V892 HydrophobicContact CD1-CG2 4.16Å
832	L	97.2	Very high	94.5	Very high	43 Å²	43	25.4 Å²	25.4	23%	0.225	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	150.9	-178	-56.6	-174.4	0	0	0	111.5	V758 M777 G780 A839 R840 A842	V758-L832 HydrophobicContact CG2-CD1 4.11Å; M777-L832 HydrophobicContact CB-CB 3.81Å; M777-L832 HydrophobicContact CB-CD1 4.17Å; M777-L832 HydrophobicContact CE-CB 3.94Å; M777-L832 WeakPolarHBondContact CE-O 3.22Å; M777-L832 HydrophobicContact CG-CB 3.64Å; M777-L832 HydrophobicContact CG-CD1 3.77Å; M777-L832 HydrophobicContact CG-CG 4.37Å; G780-L832 CarbonylContact O-C 3.38Å; G780-L832 WeakPolarHBondContact O-CA 3.28Å; L832-A839 WeakPolarHBondContact O-CA 3.4Å; L832-R840 PolarHBondContact N-O 3.08Å; L832-R840 PolarHBondContact O-N 3.02Å; L832-A842 HydrophobicContact CD1-CB 3.82Å; L832-A842 HydrophobicContact CG-CB 3.81Å
833	L	97.1	Very high	94.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.5	-173.1	-57.8	177.6	0	0	0	111.4	M777 N779 G780 L782 V785 I802 F837 G838 A839	M777-L833 VanDerWaalsContact CE-C 3.49Å; N779-L833 HydrophobicContact CB-CB 3.72Å; N779-L833 PolarHBondContact N-O 3.21Å; G780-L833 PolarHBondContact O-N 2.82Å; L782-L833 HydrophobicContact CB-CD1 4.47Å; V785-L833 HydrophobicContact CG2-CD1 4.27Å; I802-L833 HydrophobicContact CD1-CD1 4.11Å; I802-L833 HydrophobicContact CD1-CD2 3.72Å; I802-L833 HydrophobicContact CG1-CD2 3.77Å; I802-L833 HydrophobicContact CG2-CD2 4.31Å; L833-F837 HydrophobicContact CD1-CD1 4.17Å; L833-G838 WeakPolarHBondContact CA-O 3.49Å; L833-A839 HydrophobicContact CD2-CB 4.11Å
834	D	94.7	Very high	94.3	Very high	25 Å²	25	27.4 Å²	27.4	13%	0.134	15%	0.145	C	C	.	.			trans	-77.7	-176.7	174	66.7	26.3	0	0	0	112	M777 N779 E836 F837 G838 R840	M777-D834 HydrophobicContact CE-CB 3.9Å; M777-D834 VanDerWaalsContact CE-N 3.34Å; M777-D834 HydrophobicContact SD-CB 4.47Å; N779-D834 PolarHBondContact ND2-O 3.34Å; D834-E836 PolarHBondContact O-N 3.21Å; D834-E836 PolarHBondContact OD1-N 3Å; D834-E836 VanDerWaalsContact OD1-N 3.12Å; D834-F837 PolarHBondContact O-N 3.02Å; D834-F837 PolarHBondContact OD1-N 3Å; D834-G838 PolarHBondContact N-O 2.8Å; D834-G838 WeakPolarHBondContact OD1-CA 3.31Å; D834-G838 PolarHBondContact OD1-N 3.34Å; D834-R840 IonicContact OD2-NE 2.83Å; D834-R840 IonicContact OD2-NH2 3.96Å; D834-R840 PolarHBondContact OD2-NH2 2.92Å
835	A	92.7	Very high	94	Very high	60 Å²	60	26.8 Å²	26.8	50%	0.496	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-32	-175.6	0	0	0	0	0	112.7	P778 N779	P778-A835 HydrophobicContact CG-CB 3.98Å; N779-A835 PolarHBondContact ND2-O 2.75Å
836	E	93.3	Very high	93.6	Very high	135 Å²	135	28.5 Å²	28.5	63%	0.631	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	17.2	178	-60	80.5	-170.9	0	0	113.2	K801 D834 G838	K801-E836 PolarHBondContact NZ-O 3.25Å; D834-E836 PolarHBondContact O-N 3.21Å; D834-E836 PolarHBondContact OD1-N 3Å; D834-E836 VanDerWaalsContact OD1-N 3.12Å; E836-G838 PolarHBondContact O-N 2.77Å
837	F	93.9	Very high	93.1	Very high	46 Å²	46	28.7 Å²	28.7	20%	0.202	16%	0.158	C	C	.	.			trans	58.2	24.7	-175.3	-64.1	-93.1	0	0	0	114	L794 T798 I802 L833 D834	L794-F837 HydrophobicContact CD2-CD1 3.78Å; L794-F837 HydrophobicContact CD2-CE1 3.9Å; T798-F837 HydrophobicContact CG2-CB 3.62Å; T798-F837 HydrophobicContact CG2-CD1 4.05Å; T798-F837 HydrophobicContact CG2-CG 3.84Å; I802-F837 WeakPolarHBondContact CG1-O 3.39Å; L833-F837 HydrophobicContact CD1-CD1 4.17Å; D834-F837 PolarHBondContact O-N 3.02Å; D834-F837 PolarHBondContact OD1-N 3Å
838	G	96.2	Very high	92.3	Very high	5 Å²	5	32.5 Å²	32.5	5%	0.052	18%	0.175	C	C	.	.			trans	-68.2	131.1	167.4	0	0	0	0	0	110.5	D805 L833 D834 E836	D805-G838 WeakPolarHBondContact OD2-CA 3.44Å; L833-G838 WeakPolarHBondContact CA-O 3.49Å; D834-G838 PolarHBondContact N-O 2.8Å; D834-G838 WeakPolarHBondContact OD1-CA 3.31Å; D834-G838 PolarHBondContact OD1-N 3.34Å; E836-G838 PolarHBondContact O-N 2.77Å
839	A	97.8	Very high	91.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	137.4	-175	0	0	0	0	0	112.3	N756 I802 D805 A806 I831 L832 L833	N756-A839 WeakPolarHBondContact CA-O 3.5Å; N756-A839 WeakPolarHBondContact CB-O 3.43Å; N756-A839 PolarHBondContact ND2-O 2.95Å; N756-A839 VanDerWaalsContact ND2-O 3.1Å; I802-A839 HydrophobicContact CB-CB 4.27Å; I802-A839 HydrophobicContact CG1-CB 4.39Å; I802-A839 HydrophobicContact CG2-CB 3.91Å; D805-A839 HydrophobicContact CB-CB 3.64Å; D805-A839 PolarHBondContact OD2-N 3.01Å; A806-A839 HydrophobicContact CB-CB 4.46Å; I831-A839 HydrophobicContact CG2-CB 3.77Å; L832-A839 WeakPolarHBondContact O-CA 3.4Å; L833-A839 HydrophobicContact CD2-CB 4.11Å
840	R	97.5	Very high	90	Very high	37 Å²	37	32.9 Å²	32.9	14%	0.14	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128.7	175	-52.2	-166.9	-171.5	-170.5	9.2	111.7	K755 N756 V758 E775 M777 L832 D834	K755-R840 WeakPolarHBondContact O-CD 3.41Å; K755-R840 PolarHBondContact O-NE 3.03Å; N756-R840 WeakPolarHBondContact O-CA 3.17Å; V758-R840 HydrophobicContact CG2-CB 3.76Å; E775-R840 IonicContact OE1-CZ 2.65Å; E775-R840 IonicContact OE1-NH1 2.7Å; E775-R840 PolarHBondContact OE1-NH1 2.95Å; E775-R840 IonicContact OE2-CZ 2.69Å; E775-R840 IonicContact OE2-NH1 3.4Å; E775-R840 PolarHBondContact OE2-NH1 3.04Å; M777-R840 HydrophobicContact CE-CB 3.93Å; M777-R840 HydrophobicContact CE-CG 3.66Å; L832-R840 PolarHBondContact N-O 3.08Å; L832-R840 PolarHBondContact O-N 3.02Å; D834-R840 IonicContact OD2-NE 2.83Å; D834-R840 IonicContact OD2-NH2 3.96Å; D834-R840 PolarHBondContact OD2-NH2 2.92Å
841	V	97.1	Very high	88.1	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.018	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	133.6	175.5	-175.4	0	0	0	0	109.7	N756 V758 L810 F844	N756-V841 PolarHBondContact O-N 2.98Å; V758-V841 PolarHBondContact N-O 2.94Å; L810-V841 HydrophobicContact CD2-CG1 4.32Å; L810-V841 HydrophobicContact CD2-CG2 4.35Å; L810-V841 HydrophobicContact CG-CG2 4.22Å; V841-F844 HydrophobicContact CG1-CE2 4.39Å; V841-F844 HydrophobicContact CG1-CZ 4.23Å
842	A	93.8	Very high	85.6	Confident	9 Å²	9	43.2 Å²	43.2	7%	0.074	25%	0.246	C	C	.	.			trans	-136.2	169.3	-174.1	0	0	0	0	0	112.1	V758 H823 N830 L832	V758-A842 HydrophobicContact CB-CB 4.24Å; V758-A842 HydrophobicContact CG2-CB 3.63Å; H823-A842 PolarHBondContact CE1-O 3.04Å; H823-A842 PolarHBondContact NE2-O 3.28Å; N830-A842 WeakPolarHBondContact CB-O 3.17Å; N830-A842 WeakPolarHBondContact O-CB 3.44Å; N830-A842 PolarHBondContact O-N 3.28Å; L832-A842 HydrophobicContact CD1-CB 3.82Å; L832-A842 HydrophobicContact CG-CB 3.81Å
843	D	88	Confident	82.5	Confident	43 Å²	43	44 Å²	44	23%	0.23	25%	0.253	C	S	.	.			trans	66.3	74	176.7	-159	19.9	0	0	0	115.3	K718 H823 G845	K718-D843 IonicContact NZ-OD1 3.71Å; K718-D843 PolarHBondContact NZ-OD1 3.12Å; H823-D843 PolarHBondContact CE1-O 3.39Å; H823-D843 VanDerWaalsContact CE1-O 3.26Å; H823-D843 PolarHBondContact NE2-O 2.91Å; D843-G845 VanDerWaalsContact C-N 3.27Å; D843-G845 PolarHBondContact O-N 2.79Å
844	F	88.5	Confident	79.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.298	C	S	.	.			trans	-89	16.2	-178.2	-71.9	-107.1	0	0	0	113.1	E745 T748 L749 I752 I757 L813 H823 V841 V846 A847	E745-F844 HydrophobicContact CG-CB 4.27Å; T748-F844 WeakPolarHBondContact OG1-CB 3.24Å; L749-F844 HydrophobicContact CD1-CB 4.36Å; L749-F844 HydrophobicContact CD1-CD2 3.72Å; L749-F844 HydrophobicContact CD1-CE2 4.41Å; L749-F844 HydrophobicContact CD1-CG 4.26Å; L749-F844 HydrophobicContact CD2-CD1 4.49Å; L749-F844 HydrophobicContact CD2-CD2 3.55Å; L749-F844 HydrophobicContact CD2-CE1 4.46Å; L749-F844 HydrophobicContact CD2-CE2 3.53Å; L749-F844 HydrophobicContact CD2-CG 4.06Å; L749-F844 HydrophobicContact CD2-CZ 4.01Å; L749-F844 HydrophobicContact CG-CB 4.2Å; L749-F844 HydrophobicContact CG-CD2 3.68Å; L749-F844 HydrophobicContact CG-CE2 4.2Å; L749-F844 HydrophobicContact CG-CG 3.91Å; I752-F844 HydrophobicContact CD1-CE1 4.35Å; I757-F844 HydrophobicContact CG2-CE2 3.87Å; I757-F844 HydrophobicContact CG2-CZ 3.67Å; L813-F844 HydrophobicContact CD1-CE1 3.59Å; L813-F844 HydrophobicContact CD1-CZ 3.81Å; L813-F844 HydrophobicContact CD2-CE1 3.76Å; L813-F844 HydrophobicContact CD2-CZ 4.26Å; L813-F844 HydrophobicContact CG-CE1 4.34Å; H823-F844 AromaticContact CD2-CD1 3.97Å; H823-F844 AromaticContact CD2-CE1 3.76Å; H823-F844 AromaticContact CD2-CZ 3.84Å; V841-F844 HydrophobicContact CG1-CE2 4.39Å; V841-F844 HydrophobicContact CG1-CZ 4.23Å; F844-V846 PolarHBondContact O-N 2.83Å; F844-A847 HydrophobicContact CB-CB 3.93Å; F844-A847 HydrophobicContact CD1-CB 3.85Å; F844-A847 HydrophobicContact CG-CB 4.34Å; F844-A847 VanDerWaalsContact O-CB 3.27Å; F844-A847 WeakPolarHBondContact O-CB 3.48Å; F844-A847 PolarHBondContact O-N 2.68Å
845	G	82.2	Confident	76.6	Confident	9 Å²	9	61.8 Å²	61.8	9%	0.093	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.9	-172.4	0	0	0	0	0	114.7	S741 E745 D843	S741-G845 VanDerWaalsContact CA-O 3.22Å; S741-G845 WeakPolarHBondContact CA-O 3.08Å; S741-G845 WeakPolarHBondContact CB-O 3.26Å; E745-G845 VanDerWaalsContact CG-CA 3.47Å; E745-G845 VanDerWaalsContact CG-N 3.34Å; D843-G845 VanDerWaalsContact C-N 3.27Å; D843-G845 PolarHBondContact O-N 2.79Å
846	V	82.1	Confident	74.2	Confident	52 Å²	52	60.7 Å²	60.7	32%	0.315	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	3.5	174.9	-62.7	0	0	0	0	113.2	R824 D825 F844 A864	R824-V846 HydrophobicContact CB-CG2 4.17Å; R824-V846 WeakPolarHBondContact CD-O 3.36Å; R824-V846 PolarHBondContact NH1-O 3.15Å; D825-V846 HydrophobicContact CB-CG2 3.75Å; F844-V846 PolarHBondContact O-N 2.83Å; V846-A864 HydrophobicContact CB-CB 3.96Å; V846-A864 HydrophobicContact CG1-CB 4.05Å; V846-A864 HydrophobicContact CG2-CB 4.31Å
847	A	85.3	Confident	71.8	Confident	7 Å²	7	57.4 Å²	57.4	6%	0.058	32%	0.32	C	S	.	.			trans	-62.3	147.5	-177.2	0	0	0	0	0	111.3	T748 I821 V822 F844	T748-A847 HydrophobicContact CG2-CB 4.14Å; I821-A847 HydrophobicContact CG2-CB 4.1Å; V822-A847 VanDerWaalsContact O-CA 3.31Å; V822-A847 WeakPolarHBondContact O-CA 3.48Å; F844-A847 HydrophobicContact CB-CB 3.93Å; F844-A847 HydrophobicContact CD1-CB 3.85Å; F844-A847 HydrophobicContact CG-CB 4.34Å; F844-A847 VanDerWaalsContact O-CB 3.27Å; F844-A847 WeakPolarHBondContact O-CB 3.48Å; F844-A847 PolarHBondContact O-N 2.68Å
848	K	78.1	Confident	69.3	Low	114 Å²	114	62.5 Å²	62.5	50%	0.496	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	138.7	-176.9	-158.7	76.4	175.2	-174.2	0	110.9	I821 V822	I821-K848 WeakPolarHBondContact CA-O 3.43Å; V822-K848 PolarHBondContact N-O 3.46Å; V822-K848 PolarHBondContact O-N 3.13Å
849	V	76.2	Confident	66.9	Low	42 Å²	42	66.2 Å²	66.2	26%	0.255	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.3	169.2	170.6	0	0	0	0	109.2	P819 A820 I821 E851	P819-V849 HydrophobicContact CB-CG1 3.6Å; P819-V849 HydrophobicContact CG-CB 4.45Å; P819-V849 HydrophobicContact CG-CG1 3.16Å; A820-V849 WeakPolarHBondContact O-CA 3.47Å; I821-V849 HydrophobicContact CG1-CG2 4.18Å; V849-E851 HydrophobicContact CG1-CG 4.49Å; V849-E851 PolarHBondContact O-N 2.9Å
850	V	67.3	Low	64.6	Low	45 Å²	45	68.4 Å²	68.4	27%	0.273	38%	0.378	S	S	.	.			trans	-87.2	106.8	174.1	-177.7	0	0	0	0	108.5	A820 V822	A820-V850 PolarHBondContact O-N 2.92Å; V822-V850 HydrophobicContact CB-CG2 4.41Å; V822-V850 HydrophobicContact CG2-CG2 3.39Å
851	E	54.4	Low	62.2	Low	126 Å²	126	71.9 Å²	71.9	59%	0.589	41%	0.408	S	S	*	.			trans	-85.1	117.2	168.5	-73.2	174.2	179.9	0	0	109.1	V849 T853	V849-E851 HydrophobicContact CG1-CG 4.49Å; V849-E851 PolarHBondContact O-N 2.9Å; E851-T853 HydrophobicContact CB-CG2 4.42Å; E851-T853 PolarHBondContact O-N 2.91Å
852	A	43.7	Very low	60.2	Low	107 Å²	107	76.4 Å²	76.4	88%	0.884	44%	0.436	S	S	*	.			trans	-70.2	77.5	170.1	0	0	0	0	0	109.6
853	T	32.8	Very low	58.5	Low	60 Å²	60	79.7 Å²	79.7	37%	0.368	45%	0.451	S	S	.	.			trans	-79	147.1	168.4	59.1	0	0	0	0	110.1	E851 R855 G856	E851-T853 HydrophobicContact CB-CG2 4.42Å; E851-T853 PolarHBondContact O-N 2.91Å; T853-R855 PolarHBondContact O-N 3.38Å; T853-G856 PolarHBondContact O-N 2.81Å; T853-G856 PolarHBondContact OG1-O 2.81Å
854	V	32.7	Very low	57.2	Low	156 Å²	156	78.5 Å²	78.5	95%	0.945	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-12.8	179.6	-178.6	0	0	0	0	114.2
855	R	34.2	Very low	56.5	Low	241 Å²	241	80 Å²	80	91%	0.909	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	14.8	-178.7	-67	-171.9	177.6	-165.4	-0.7	115.3	T853	T853-R855 PolarHBondContact O-N 3.38Å
856	G	42.3	Very low	56.4	Low	37 Å²	37	80.9 Å²	80.9	38%	0.381	47%	0.468	S	S	.	.			trans	80.9	176.4	-178.6	0	0	0	0	0	113.7	T853	T853-G856 PolarHBondContact O-N 2.81Å; T853-G856 PolarHBondContact OG1-O 2.81Å
857	P	43.9	Very low	56.3	Low	67 Å²	67	83.7 Å²	83.7	44%	0.435	49%	0.488	S	S	.	.	S	Bend	trans	-66.7	133.9	-177	24.7	-31.3	0	0	0	111.7
858	K	41.9	Very low	56.2	Low	152 Å²	152	84.1 Å²	84.1	66%	0.661	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-64.1	136.7	177.7	-68.7	175.3	-179.2	165.9	0	110.9
859	S	44.1	Very low	56.8	Low	84 Å²	84	79.3 Å²	79.3	59%	0.587	47%	0.472	S	S	*	.	B	Isolated β-bridge	trans	-66.6	138	169.6	-58.8	0	0	0	0	111.1
860	M	51	Low	57.3	Low	45 Å²	45	79.6 Å²	79.6	22%	0.222	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-89.9	154.3	-178.4	-63	-64.9	-73.7	0	0	112.5	L878 V880	M860-L878 WeakPolarHBondContact CB-O 3.09Å; M860-L878 PolarHBondContact N-O 3.19Å; M860-V880 HydrophobicContact CG-CB 4.46Å; M860-V880 HydrophobicContact CG-CG2 3.73Å
861	S	47.4	Very low	57.9	Low	111 Å²	111	77.5 Å²	77.5	78%	0.776	46%	0.459	S	S	*	.	S	Bend	trans	-84.2	-22.5	175.9	52.4	0	0	0	0	114.3
862	V	53.9	Low	58.9	Low	98 Å²	98	73.3 Å²	73.3	59%	0.594	44%	0.442	S	S	*	.	S	Bend	trans	-140.2	135.9	-173.9	-176.1	0	0	0	0	111.1	R824	R824-V862 PolarHBondContact NH2-O 3.41Å
863	I	59	Low	60.1	Low	78 Å²	78	69.5 Å²	69.5	40%	0.4	41%	0.406	S	S	.	.			trans	-74.3	125	171.7	-58.9	171.4	0	0	0	108.3	I870 Y874 L878	I863-I870 HydrophobicContact CG2-CD1 4.34Å; I863-Y874 HydrophobicContact CG2-CE1 4.11Å; I863-L878 HydrophobicContact CD1-CD2 4.1Å; I863-L878 HydrophobicContact CG1-CD2 3.42Å; I863-L878 VanDerWaalsContact CG1-CD2 3.42Å
864	A	60.1	Low	61.5	Low	17 Å²	17	66.9 Å²	66.9	14%	0.14	39%	0.39	C	S	.	.			trans	-123.1	129.8	174.2	0	0	0	0	0	110.1	R824 V846 Y874	R824-A864 VanDerWaalsContact NH2-CB 3.26Å; V846-A864 HydrophobicContact CB-CB 3.96Å; V846-A864 HydrophobicContact CG1-CB 4.05Å; V846-A864 HydrophobicContact CG2-CB 4.31Å; A864-Y874 PolarHBondContact N-OH 3.45Å; A864-Y874 VanDerWaalsContact O-CE1 3.31Å; A864-Y874 WeakPolarHBondContact O-CE1 3.3Å
865	G	73.1	Confident	62.7	Low	33 Å²	33	61.8 Å²	61.8	34%	0.34	36%	0.364	S	S	.	.	S	Bend	trans	153.7	171.6	-178.8	0	0	0	0	0	110.9	R824	R824-G865 WeakPolarHBondContact O-CA 3.43Å
866	S	80.4	Confident	63.3	Low	27 Å²	27	56.9 Å²	56.9	19%	0.189	35%	0.346	C	S	.	.			trans	-102	138.2	-178.2	-61.7	0	0	0	0	112.1	D825 K827 G868 Y869 I870	D825-S866 WeakPolarHBondContact OD1-CB 3.49Å; D825-S866 PolarHBondContact OD1-N 2.84Å; D825-S866 PolarHBondContact OD1-OG 2.79Å; K827-S866 VanDerWaalsContact CD-OG 3.3Å; K827-S866 WeakPolarHBondContact CD-OG 3.46Å; K827-S866 PolarHBondContact NZ-OG 2.75Å; S866-G868 PolarHBondContact O-N 3.29Å; S866-Y869 PolarHBondContact O-N 2.79Å; S866-I870 PolarHBondContact O-N 3.29Å
867	C	80.1	Confident	63.9	Low	110 Å²	110	58.2 Å²	58.2	74%	0.743	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	135.2	178.9	-168.6	0	0	0	0	111.2	Y869	C867-Y869 VanDerWaalsContact C-N 3.33Å
868	G	83	Confident	64.5	Low	16 Å²	16	58 Å²	58	17%	0.165	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	-24.3	-173.3	0	0	0	0	0	115.1	S866	S866-G868 PolarHBondContact O-N 3.29Å
869	Y	91.5	Very high	65.2	Low	13 Å²	13	58 Å²	58	5%	0.051	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-15.6	177.3	-60.5	-89.3	0	0	0	113.9	K827 S828 S866 C867 A871 Y887 S888 V891 V892 E895 P902	K827-Y869 HydrophobicContact CB-CD1 3.92Å; K827-Y869 HydrophobicContact CB-CD2 3.76Å; K827-Y869 HydrophobicContact CB-CE1 3.73Å; K827-Y869 HydrophobicContact CB-CE2 3.53Å; K827-Y869 HydrophobicContact CB-CG 3.93Å; S828-Y869 PolarHBondContact N-OH 2.96Å; S828-Y869 PolarHBondContact OG-OH 2.79Å; S866-Y869 PolarHBondContact O-N 2.79Å; C867-Y869 VanDerWaalsContact C-N 3.33Å; Y869-A871 PolarHBondContact O-N 2.79Å; Y869-Y887 WeakPolarHBondContact O-CD1 3.08Å; Y869-S888 WeakPolarHBondContact O-CB 3.18Å; Y869-S888 PolarHBondContact O-OG 3.42Å; Y869-V891 HydrophobicContact CD1-CB 3.84Å; Y869-V891 HydrophobicContact CD1-CG1 3.66Å; Y869-V891 HydrophobicContact CE1-CB 4.23Å; Y869-V891 HydrophobicContact CE1-CG1 3.72Å; Y869-V891 HydrophobicContact CG-CG1 4.4Å; Y869-V892 HydrophobicContact CD1-CG2 4.42Å; Y869-V892 HydrophobicContact CE1-CG2 3.95Å; Y869-E895 VanDerWaalsContact CE1-OE2 3.27Å; Y869-E895 WeakPolarHBondContact CE1-OE2 3.27Å; Y869-E895 PolarHBondContact OH-OE1 3.41Å; Y869-E895 VanDerWaalsContact OH-OE1 3.08Å; Y869-E895 PolarHBondContact OH-OE2 3.49Å; Y869-P902 HydrophobicContact CD2-CG 4.32Å; Y869-P902 HydrophobicContact CE2-CB 4.06Å; Y869-P902 HydrophobicContact CE2-CG 3.53Å
870	I	85.7	Confident	66	Low	49 Å²	49	54.7 Å²	54.7	25%	0.251	31%	0.314	S	S	.	.	S	Bend	trans	-66.7	123.6	-178.4	-67.9	165.2	0	0	0	109.5	I863 S866 Y874 A875 Y887	I863-I870 HydrophobicContact CG2-CD1 4.34Å; S866-I870 PolarHBondContact O-N 3.29Å; I870-Y874 HydrophobicContact CG2-CD1 4.12Å; I870-A875 HydrophobicContact CG2-CB 4.49Å; I870-Y887 WeakPolarHBondContact O-CE1 3.27Å
871	A	80	Confident	67.2	Low	1 Å²	1	54.9 Å²	54.9	1%	0.008	32%	0.316	C	S	.	.			trans	-59.1	135.5	174.2	0	0	0	0	0	110.9	Y869 E873 Y874 Y887	Y869-A871 PolarHBondContact O-N 2.79Å; A871-E873 VanDerWaalsContact CB-OE1 3.24Å; A871-E873 WeakPolarHBondContact CB-OE1 3.4Å; A871-E873 WeakPolarHBondContact CB-OE2 3.48Å; A871-E873 PolarHBondContact O-N 2.77Å; A871-Y874 WeakPolarHBondContact O-CB 3.37Å; A871-Y874 PolarHBondContact O-N 2.89Å; A871-Y887 VanDerWaalsContact CA-CD1 3.44Å; A871-Y887 HydrophobicContact CB-CD1 3.96Å; A871-Y887 HydrophobicContact CB-CD2 4.42Å; A871-Y887 HydrophobicContact CB-CG 3.76Å
872	P	75.7	Confident	68.9	Low	37 Å²	37	52.5 Å²	52.5	24%	0.24	29%	0.293	C	S	.	.	H	α-helix	trans	-51.6	-54.9	-174.4	-29.1	34.6	0	0	0	111.9	Y874 A875 Y876 Y887	P872-Y874 PolarHBondContact O-N 2.78Å; P872-A875 WeakPolarHBondContact O-CB 3.28Å; P872-A875 PolarHBondContact O-N 3.01Å; P872-Y876 VanDerWaalsContact C-CD2 3.44Å; P872-Y876 HydrophobicContact CB-CE2 4.17Å; P872-Y876 WeakPolarHBondContact O-CD2 3.43Å; P872-Y876 WeakPolarHBondContact O-CE2 3.28Å; P872-Y887 HydrophobicContact CG-CE2 3.97Å
873	E	69.3	Low	70.4	Confident	27 Å²	27	49.3 Å²	49.3	13%	0.126	27%	0.271	C	S	.	.	H	α-helix	trans	-56.6	-27.6	-179.6	79.4	-74.6	-176.7	0	0	113.9	A871 A875 Y876 T877 P956 R959	A871-E873 VanDerWaalsContact CB-OE1 3.24Å; A871-E873 WeakPolarHBondContact CB-OE1 3.4Å; A871-E873 WeakPolarHBondContact CB-OE2 3.48Å; A871-E873 PolarHBondContact O-N 2.77Å; E873-A875 VanDerWaalsContact C-N 3.3Å; E873-Y876 PolarHBondContact O-N 3.29Å; E873-Y876 VanDerWaalsContact O-N 3.16Å; E873-T877 WeakPolarHBondContact O-CB 3.08Å; E873-T877 WeakPolarHBondContact O-CG2 3.27Å; E873-T877 PolarHBondContact O-N 2.88Å; E873-T877 PolarHBondContact O-OG1 2.87Å; E873-P956 HydrophobicContact CB-CG 4Å; E873-P956 VanDerWaalsContact CD-CG 3.43Å; E873-P956 HydrophobicContact CG-CG 3.39Å; E873-R959 IonicContact OE1-CZ 3.38Å; E873-R959 IonicContact OE1-NH1 3.42Å; E873-R959 PolarHBondContact OE1-NH1 3.34Å; E873-R959 IonicContact OE1-NH2 2.89Å; E873-R959 IonicContact OE2-CZ 2.66Å; E873-R959 IonicContact OE2-NH1 2.73Å; E873-R959 PolarHBondContact OE2-NH1 2.85Å; E873-R959 IonicContact OE2-NH2 3.98Å; E873-R959 PolarHBondContact OE2-NH2 3.15Å
874	Y	62.5	Low	71.6	Confident	6 Å²	6	45.9 Å²	45.9	2%	0.024	25%	0.254	C	S	.	.	H	α-helix	trans	-71.2	-33.5	-177.3	-178.3	-137.3	0	0	0	110.6	R824 I863 A864 I870 A871 P872 Y876 L878 R879 V880	R824-Y874 PolarHBondContact NH2-OH 3.41Å; I863-Y874 HydrophobicContact CG2-CE1 4.11Å; A864-Y874 PolarHBondContact N-OH 3.45Å; A864-Y874 VanDerWaalsContact O-CE1 3.31Å; A864-Y874 WeakPolarHBondContact O-CE1 3.3Å; I870-Y874 HydrophobicContact CG2-CD1 4.12Å; A871-Y874 WeakPolarHBondContact O-CB 3.37Å; A871-Y874 PolarHBondContact O-N 2.89Å; P872-Y874 PolarHBondContact O-N 2.78Å; Y874-Y876 VanDerWaalsContact C-N 3.3Å; Y874-Y876 PolarHBondContact O-N 3.46Å; Y874-L878 PolarHBondContact O-N 3.37Å; Y874-R879 WeakPolarHBondContact CD2-O 3.4Å; Y874-V880 HydrophobicContact CD2-CG2 3.94Å; Y874-V880 HydrophobicContact CE2-CB 4.43Å; Y874-V880 HydrophobicContact CE2-CG2 3.16Å
875	A	56.7	Low	73.2	Confident	48 Å²	48	45 Å²	45	40%	0.397	25%	0.247	S	C	.	.	H	α-helix	trans	-67.7	-27.4	170.8	0	0	0	0	0	113	I870 P872 E873	I870-A875 HydrophobicContact CG2-CB 4.49Å; P872-A875 WeakPolarHBondContact O-CB 3.28Å; P872-A875 PolarHBondContact O-N 3.01Å; E873-A875 VanDerWaalsContact C-N 3.3Å
876	Y	47	Very low	74.2	Confident	138 Å²	138	43.5 Å²	43.5	54%	0.541	23%	0.231	S	C	.	.	H	α-helix	trans	-93.6	-35.9	-177.8	-56.6	-87.1	0	0	0	113.8	P872 E873 Y874	P872-Y876 VanDerWaalsContact C-CD2 3.44Å; P872-Y876 HydrophobicContact CB-CE2 4.17Å; P872-Y876 WeakPolarHBondContact O-CD2 3.43Å; P872-Y876 WeakPolarHBondContact O-CE2 3.28Å; E873-Y876 PolarHBondContact O-N 3.29Å; E873-Y876 VanDerWaalsContact O-N 3.16Å; Y874-Y876 VanDerWaalsContact C-N 3.3Å; Y874-Y876 PolarHBondContact O-N 3.46Å
877	T	55.4	Low	74.8	Confident	66 Å²	66	42.7 Å²	42.7	41%	0.405	22%	0.224	S	C	.	.	H	α-helix	trans	-104.6	-19.7	-169	65	0	0	0	0	114.9	E873 R879	E873-T877 WeakPolarHBondContact O-CB 3.08Å; E873-T877 WeakPolarHBondContact O-CG2 3.27Å; E873-T877 PolarHBondContact O-N 2.88Å; E873-T877 PolarHBondContact O-OG1 2.87Å; T877-R879 PolarHBondContact O-N 3.13Å; T877-R879 PolarHBondContact OG1-N 3.2Å
878	L	56.2	Low	75.6	Confident	61 Å²	61	37.8 Å²	37.8	32%	0.319	19%	0.19	S	C	.	.			trans	54.7	11.5	-168	-59.2	170.8	0	0	0	114.6	M860 I863 Y874	M860-L878 WeakPolarHBondContact CB-O 3.09Å; M860-L878 PolarHBondContact N-O 3.19Å; I863-L878 HydrophobicContact CD1-CD2 4.1Å; I863-L878 HydrophobicContact CG1-CD2 3.42Å; I863-L878 VanDerWaalsContact CG1-CD2 3.42Å; Y874-L878 PolarHBondContact O-N 3.37Å
879	R	56.5	Low	76.3	Confident	152 Å²	152	37 Å²	37	57%	0.574	18%	0.183	S	C	*	.	B	Isolated β-bridge	trans	-88.1	125.2	176	-67.3	-176.5	-179.9	-178.6	2.2	108.9	Y874 T877	Y874-R879 WeakPolarHBondContact CD2-O 3.4Å; T877-R879 PolarHBondContact O-N 3.13Å; T877-R879 PolarHBondContact OG1-N 3.2Å
880	V	62.5	Low	76.6	Confident	16 Å²	16	36.4 Å²	36.4	10%	0.097	18%	0.18	C	C	.	.			trans	-104.3	125	177.6	178.4	0	0	0	0	109.3	V822 R824 M860 Y874	V822-V880 HydrophobicContact CB-CG1 4.13Å; V822-V880 HydrophobicContact CG1-CG1 3.72Å; R824-V880 HydrophobicContact CG-CG1 3.79Å; M860-V880 HydrophobicContact CG-CB 4.46Å; M860-V880 HydrophobicContact CG-CG2 3.73Å; Y874-V880 HydrophobicContact CD2-CG2 3.94Å; Y874-V880 HydrophobicContact CE2-CB 4.43Å; Y874-V880 HydrophobicContact CE2-CG2 3.16Å
881	N	74.5	Confident	77.2	Confident	49 Å²	49	34 Å²	34	26%	0.262	17%	0.168	S	C	.	.			trans	-138.6	178.1	164.6	67.2	7.1	0	0	0	109.3	K883 S884	N881-K883 PolarHBondContact O-N 3Å; N881-K883 VanDerWaalsContact O-N 3.16Å; N881-K883 VanDerWaalsContact OD1-CB 3.26Å; N881-K883 WeakPolarHBondContact OD1-CB 3.38Å; N881-K883 PolarHBondContact OD1-N 3.47Å; N881-K883 VanDerWaalsContact OD1-N 3.09Å; N881-S884 PolarHBondContact O-N 3.27Å; N881-S884 VanDerWaalsContact O-N 3.16Å; N881-S884 PolarHBondContact O-OG 3.09Å
882	E	83.8	Confident	78.1	Confident	60 Å²	60	34.1 Å²	34.1	28%	0.28	17%	0.168	S	C	.	.	H	α-helix	trans	-60.3	-21.5	179	73.4	-66.9	158.3	0	0	113.8	H814 V822 S884 D885 I886	H814-E882 HydrophobicContact CB-CB 4.26Å; V822-E882 HydrophobicContact CG2-CB 4.36Å; E882-S884 PolarHBondContact O-N 3.26Å; E882-D885 PolarHBondContact O-N 3.12Å; E882-I886 HydrophobicContact CG-CD1 4.4Å; E882-I886 WeakPolarHBondContact O-CD1 3.42Å; E882-I886 WeakPolarHBondContact O-CG1 3.24Å; E882-I886 PolarHBondContact O-N 3.25Å; E882-I886 VanDerWaalsContact O-N 3.16Å
883	K	84.8	Confident	79.2	Confident	32 Å²	32	32.3 Å²	32.3	14%	0.139	16%	0.157	C	C	.	.	H	α-helix	trans	-65.3	-24.6	176.5	-56	-51.8	-165.8	90.7	0	113	N881 I886 Y887 P956 R959	N881-K883 PolarHBondContact O-N 3Å; N881-K883 VanDerWaalsContact O-N 3.16Å; N881-K883 VanDerWaalsContact OD1-CB 3.26Å; N881-K883 WeakPolarHBondContact OD1-CB 3.38Å; N881-K883 PolarHBondContact OD1-N 3.47Å; N881-K883 VanDerWaalsContact OD1-N 3.09Å; K883-I886 HydrophobicContact CD-CD1 3.6Å; K883-I886 PolarHBondContact O-N 3.36Å; K883-Y887 PolarHBondContact O-N 3.01Å; K883-Y887 VanDerWaalsContact O-N 3.17Å; K883-P956 HydrophobicContact CB-CB 3.93Å; K883-P956 HydrophobicContact CG-CB 4.16Å; K883-P956 PolarHBondContact NZ-O 2.65Å; K883-R959 HydrophobicContact CD-CB 4.32Å; K883-R959 PolarHBondContact NZ-O 3.39Å; K883-R959 WeakPolarHBondContact O-CD 3.22Å; K883-R959 PolarHBondContact O-NH1 3.49Å
884	S	85	Confident	80.5	Confident	5 Å²	5	31 Å²	31	4%	0.035	15%	0.151	C	C	.	.	H	α-helix	trans	-67.1	-45.6	174.5	62	0	0	0	0	111.6	N881 E882 I886 Y887 S888	N881-S884 PolarHBondContact O-N 3.27Å; N881-S884 VanDerWaalsContact O-N 3.16Å; N881-S884 PolarHBondContact O-OG 3.09Å; E882-S884 PolarHBondContact O-N 3.26Å; S884-I886 VanDerWaalsContact C-N 3.31Å; S884-I886 PolarHBondContact O-N 3.42Å; S884-Y887 WeakPolarHBondContact O-CB 3.13Å; S884-Y887 PolarHBondContact O-N 3.4Å; S884-S888 PolarHBondContact O-N 3.31Å; S884-S888 VanDerWaalsContact O-N 3.14Å; S884-S888 PolarHBondContact O-OG 3.2Å
885	D	93.8	Very high	82.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.8	-37	173.9	-76	-9.5	0	0	0	112.1	H814 V822 H823 R824 V826 E882 Y887 S888 F889	H814-D885 IonicContact CD2-OD2 3.66Å; H814-D885 VanDerWaalsContact CE1-CB 3.42Å; H814-D885 WeakPolarHBondContact CE1-CB 3.14Å; H814-D885 IonicContact CE1-OD2 2.98Å; H814-D885 WeakPolarHBondContact NE2-CB 3.25Å; H814-D885 IonicContact NE2-OD2 2.91Å; H814-D885 PolarHBondContact NE2-OD2 2.9Å; V822-D885 WeakPolarHBondContact CA-OD2 3.3Å; V822-D885 WeakPolarHBondContact CG1-OD2 3.49Å; H823-D885 WeakPolarHBondContact CB-OD2 3.35Å; H823-D885 PolarHBondContact N-OD1 2.97Å; H823-D885 PolarHBondContact N-OD2 3.35Å; R824-D885 WeakPolarHBondContact CA-OD1 3.4Å; R824-D885 PolarHBondContact N-OD1 2.71Å; V826-D885 HydrophobicContact CG2-CB 4.13Å; E882-D885 PolarHBondContact O-N 3.12Å; D885-Y887 VanDerWaalsContact C-N 3.32Å; D885-Y887 PolarHBondContact O-N 2.82Å; D885-S888 PolarHBondContact O-N 3.05Å; D885-F889 WeakPolarHBondContact O-CB 3.34Å; D885-F889 PolarHBondContact O-N 2.97Å
886	I	94.8	Very high	84.1	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.7	-40.1	177.3	-66.5	155.6	0	0	0	111	E882 K883 S884 F889 G890 C951 R959 P960 M962	E882-I886 HydrophobicContact CG-CD1 4.4Å; E882-I886 WeakPolarHBondContact O-CD1 3.42Å; E882-I886 WeakPolarHBondContact O-CG1 3.24Å; E882-I886 PolarHBondContact O-N 3.25Å; E882-I886 VanDerWaalsContact O-N 3.16Å; K883-I886 HydrophobicContact CD-CD1 3.6Å; K883-I886 PolarHBondContact O-N 3.36Å; S884-I886 VanDerWaalsContact C-N 3.31Å; S884-I886 PolarHBondContact O-N 3.42Å; I886-F889 PolarHBondContact O-N 3.05Å; I886-G890 PolarHBondContact O-N 3.21Å; I886-C951 HydrophobicContact CG2-CB 3.98Å; I886-C951 WeakPolarHBondContact O-CB 3.04Å; I886-R959 HydrophobicContact CG2-CB 3.88Å; I886-P960 WeakPolarHBondContact CD1-O 3.18Å; I886-P960 WeakPolarHBondContact CG2-O 3.37Å; I886-M962 HydrophobicContact CB-SD 4.45Å; I886-M962 HydrophobicContact CD1-CG 4.44Å; I886-M962 HydrophobicContact CG1-CG 3.68Å; I886-M962 HydrophobicContact CG1-SD 3.76Å
887	Y	92.9	Very high	86.5	Confident	11 Å²	11	22 Å²	22	4%	0.043	11%	0.106	C	C	.	.	H	α-helix	trans	-62.9	-50.4	174	-178.9	-84.6	0	0	0	111.6	Y869 I870 A871 P872 K883 S884 D885 F889 G890 V891 C951 S952	Y869-Y887 WeakPolarHBondContact O-CD1 3.08Å; I870-Y887 WeakPolarHBondContact O-CE1 3.27Å; A871-Y887 VanDerWaalsContact CA-CD1 3.44Å; A871-Y887 HydrophobicContact CB-CD1 3.96Å; A871-Y887 HydrophobicContact CB-CD2 4.42Å; A871-Y887 HydrophobicContact CB-CG 3.76Å; P872-Y887 HydrophobicContact CG-CE2 3.97Å; K883-Y887 PolarHBondContact O-N 3.01Å; K883-Y887 VanDerWaalsContact O-N 3.17Å; S884-Y887 WeakPolarHBondContact O-CB 3.13Å; S884-Y887 PolarHBondContact O-N 3.4Å; D885-Y887 VanDerWaalsContact C-N 3.32Å; D885-Y887 PolarHBondContact O-N 2.82Å; Y887-F889 PolarHBondContact O-N 3.04Å; Y887-G890 WeakPolarHBondContact O-CA 3.23Å; Y887-G890 PolarHBondContact O-N 2.96Å; Y887-V891 HydrophobicContact CD1-CG2 4.13Å; Y887-V891 HydrophobicContact CE1-CG2 3.76Å; Y887-V891 PolarHBondContact O-N 3.26Å; Y887-C951 VanDerWaalsContact CA-O 3.3Å; Y887-C951 WeakPolarHBondContact CA-O 3.21Å; Y887-S952 WeakPolarHBondContact CE2-O 3.15Å
888	S	95.9	Very high	88.4	Confident	6 Å²	6	19.2 Å²	19.2	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-58.5	-37.5	178.3	-57.6	0	0	0	0	111.8	V826 Y869 S884 D885 V891 V892	V826-S888 WeakPolarHBondContact O-CB 3.35Å; Y869-S888 WeakPolarHBondContact O-CB 3.18Å; Y869-S888 PolarHBondContact O-OG 3.42Å; S884-S888 PolarHBondContact O-N 3.31Å; S884-S888 VanDerWaalsContact O-N 3.14Å; S884-S888 PolarHBondContact O-OG 3.2Å; D885-S888 PolarHBondContact O-N 3.05Å; S888-V891 WeakPolarHBondContact O-CB 3.41Å; S888-V891 PolarHBondContact O-N 3.08Å; S888-V892 PolarHBondContact O-N 3.41Å; S888-V892 VanDerWaalsContact O-N 3.16Å
889	F	98.3	Very high	90.2	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-67.4	-37.8	172.2	-176	-107.5	0	0	0	112.7	A803 A806 A807 L810 V826 D885 I886 Y887 V891 V892 L893 M962 V965 L969	A803-F889 WeakPolarHBondContact O-CZ 3.32Å; A806-F889 HydrophobicContact CB-CE2 3.88Å; A807-F889 HydrophobicContact CB-CE1 3.96Å; A807-F889 HydrophobicContact CB-CE2 4.36Å; A807-F889 HydrophobicContact CB-CZ 3.62Å; L810-F889 HydrophobicContact CD1-CB 3.85Å; L810-F889 HydrophobicContact CD1-CD2 3.56Å; L810-F889 HydrophobicContact CD1-CE2 4.37Å; L810-F889 HydrophobicContact CD1-CG 3.83Å; V826-F889 HydrophobicContact CG1-CB 4.45Å; D885-F889 WeakPolarHBondContact O-CB 3.34Å; D885-F889 PolarHBondContact O-N 2.97Å; I886-F889 PolarHBondContact O-N 3.05Å; Y887-F889 PolarHBondContact O-N 3.04Å; F889-V891 VanDerWaalsContact C-N 3.28Å; F889-V891 PolarHBondContact O-N 2.93Å; F889-V892 WeakPolarHBondContact O-CB 3.28Å; F889-V892 PolarHBondContact O-N 3.26Å; F889-V892 VanDerWaalsContact O-N 3.12Å; F889-L893 HydrophobicContact CD1-CD1 4.12Å; F889-L893 HydrophobicContact CD1-CG 4.22Å; F889-L893 HydrophobicContact CE1-CD1 3.67Å; F889-L893 HydrophobicContact CE1-CD2 3.96Å; F889-L893 HydrophobicContact CE1-CG 3.76Å; F889-L893 HydrophobicContact CZ-CD1 4.34Å; F889-L893 HydrophobicContact CZ-CD2 3.76Å; F889-L893 HydrophobicContact CZ-CG 3.99Å; F889-L893 PolarHBondContact O-N 3.17Å; F889-M962 HydrophobicContact CB-SD 4.42Å; F889-M962 HydrophobicContact CD1-CE 3.74Å; F889-M962 HydrophobicContact CD1-SD 3.95Å; F889-M962 HydrophobicContact CE1-CE 3.9Å; F889-M962 HydrophobicContact CG-CE 4.19Å; F889-M962 HydrophobicContact CG-SD 4.3Å; F889-M962 HydrophobicContact CZ-CE 4.46Å; F889-V965 HydrophobicContact CD1-CG1 4.08Å; F889-V965 HydrophobicContact CE1-CG1 3.63Å; F889-L969 HydrophobicContact CE1-CD1 4.44Å; F889-L969 HydrophobicContact CZ-CD1 4.42Å
890	G	97.7	Very high	91.9	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-56.2	-42.3	170.8	0	0	0	0	0	112.3	I886 Y887 L893 L894	I886-G890 PolarHBondContact O-N 3.21Å; Y887-G890 WeakPolarHBondContact O-CA 3.23Å; Y887-G890 PolarHBondContact O-N 2.96Å; G890-L893 WeakPolarHBondContact O-CB 3.4Å; G890-L893 PolarHBondContact O-N 3.01Å; G890-L894 WeakPolarHBondContact O-CG 3.28Å; G890-L894 PolarHBondContact O-N 3.31Å
891	V	97.9	Very high	93.4	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62	-43	173.8	-179.7	0	0	0	0	111.4	Y869 Y887 S888 F889 L893 L894 E895 P902 V913	Y869-V891 HydrophobicContact CD1-CB 3.84Å; Y869-V891 HydrophobicContact CD1-CG1 3.66Å; Y869-V891 HydrophobicContact CE1-CB 4.23Å; Y869-V891 HydrophobicContact CE1-CG1 3.72Å; Y869-V891 HydrophobicContact CG-CG1 4.4Å; Y887-V891 HydrophobicContact CD1-CG2 4.13Å; Y887-V891 HydrophobicContact CE1-CG2 3.76Å; Y887-V891 PolarHBondContact O-N 3.26Å; S888-V891 WeakPolarHBondContact O-CB 3.41Å; S888-V891 PolarHBondContact O-N 3.08Å; F889-V891 VanDerWaalsContact C-N 3.28Å; F889-V891 PolarHBondContact O-N 2.93Å; V891-L893 VanDerWaalsContact C-N 3.33Å; V891-L893 PolarHBondContact O-N 3.1Å; V891-L894 WeakPolarHBondContact O-CB 3.15Å; V891-L894 PolarHBondContact O-N 3.25Å; V891-L894 VanDerWaalsContact O-N 3.12Å; V891-E895 WeakPolarHBondContact O-CG 3.4Å; V891-E895 PolarHBondContact O-N 2.74Å; V891-P902 HydrophobicContact CG1-CB 3.81Å; V891-V913 HydrophobicContact CG2-CG2 3.87Å
892	V	98.3	Very high	94.1	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.012	6%	0.064	C	C	.	.	H	α-helix	trans	-60.5	-40.7	174.6	173.3	0	0	0	0	111.9	L782 V826 I831 Y869 S888 F889 L894 E895 L896	L782-V892 HydrophobicContact CD2-CG1 4.01Å; V826-V892 HydrophobicContact CG1-CG2 4.49Å; I831-V892 HydrophobicContact CD1-CG1 3.7Å; I831-V892 HydrophobicContact CD1-CG2 4.16Å; Y869-V892 HydrophobicContact CD1-CG2 4.42Å; Y869-V892 HydrophobicContact CE1-CG2 3.95Å; S888-V892 PolarHBondContact O-N 3.41Å; S888-V892 VanDerWaalsContact O-N 3.16Å; F889-V892 WeakPolarHBondContact O-CB 3.28Å; F889-V892 PolarHBondContact O-N 3.26Å; F889-V892 VanDerWaalsContact O-N 3.12Å; V892-L894 VanDerWaalsContact C-N 3.34Å; V892-E895 PolarHBondContact O-N 3.39Å; V892-L896 HydrophobicContact CG1-CD1 4.36Å; V892-L896 WeakPolarHBondContact O-CG 3.48Å; V892-L896 PolarHBondContact O-N 2.87Å
893	L	98.4	Very high	94.2	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-63.4	-40.3	174.4	-67.9	-179.6	0	0	0	111.6	A803 F889 G890 V891 L896 V897 V944 I947 A948	A803-L893 HydrophobicContact CB-CD2 3.59Å; F889-L893 HydrophobicContact CD1-CD1 4.12Å; F889-L893 HydrophobicContact CD1-CG 4.22Å; F889-L893 HydrophobicContact CE1-CD1 3.67Å; F889-L893 HydrophobicContact CE1-CD2 3.96Å; F889-L893 HydrophobicContact CE1-CG 3.76Å; F889-L893 HydrophobicContact CZ-CD1 4.34Å; F889-L893 HydrophobicContact CZ-CD2 3.76Å; F889-L893 HydrophobicContact CZ-CG 3.99Å; F889-L893 PolarHBondContact O-N 3.17Å; G890-L893 WeakPolarHBondContact O-CB 3.4Å; G890-L893 PolarHBondContact O-N 3.01Å; V891-L893 VanDerWaalsContact C-N 3.33Å; V891-L893 PolarHBondContact O-N 3.1Å; L893-L896 HydrophobicContact CD2-CD1 4.48Å; L893-L896 PolarHBondContact O-N 3.19Å; L893-V897 WeakPolarHBondContact O-CG2 3.36Å; L893-V897 PolarHBondContact O-N 3.4Å; L893-V944 HydrophobicContact CD2-CG1 4.23Å; L893-I947 HydrophobicContact CD1-CG2 3.86Å; L893-A948 HydrophobicContact CB-CB 3.46Å; L893-A948 VanDerWaalsContact CB-CB 3.46Å; L893-A948 HydrophobicContact CD1-CB 4.2Å
894	L	98.1	Very high	94.1	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-62.8	-42	173.9	-67	179.1	0	0	0	111.5	G890 V891 V892 L896 V897 T898 L912 V913 V916 L945 A948 L949	G890-L894 WeakPolarHBondContact O-CG 3.28Å; G890-L894 PolarHBondContact O-N 3.31Å; V891-L894 WeakPolarHBondContact O-CB 3.15Å; V891-L894 PolarHBondContact O-N 3.25Å; V891-L894 VanDerWaalsContact O-N 3.12Å; V892-L894 VanDerWaalsContact C-N 3.34Å; L894-L896 VanDerWaalsContact C-N 3.33Å; L894-L896 PolarHBondContact O-N 3.47Å; L894-V897 PolarHBondContact O-N 2.84Å; L894-T898 VanDerWaalsContact O-CB 3.31Å; L894-T898 WeakPolarHBondContact O-CB 3.31Å; L894-T898 VanDerWaalsContact O-CG2 3.25Å; L894-T898 WeakPolarHBondContact O-CG2 3.2Å; L894-T898 PolarHBondContact O-N 3.47Å; L894-T898 PolarHBondContact O-OG1 2.92Å; L894-L912 HydrophobicContact CB-CD2 3.72Å; L894-L912 HydrophobicContact CB-CG 4.15Å; L894-L912 HydrophobicContact CD1-CG 4.49Å; L894-V913 HydrophobicContact CD1-CB 4.3Å; L894-V913 HydrophobicContact CD1-CG2 3.77Å; L894-V916 HydrophobicContact CD2-CG1 4.18Å; L894-V916 HydrophobicContact CD2-CG2 4.33Å; L894-L945 HydrophobicContact CD2-CD1 3.61Å; L894-A948 HydrophobicContact CD2-CB 3.57Å; L894-A948 HydrophobicContact CG-CB 3.89Å; L894-L949 HydrophobicContact CD2-CD2 4.34Å
895	E	97.4	Very high	93.7	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.7	-45.9	173.9	-66.8	178.2	90.2	0	0	110.9	L786 H787 S828 Y869 V891 V892 V897 T898 G899 K900 P902 L912	L786-E895 HydrophobicContact CD2-CB 3.9Å; H787-E895 IonicContact CD2-OE1 2.85Å; H787-E895 IonicContact CE1-OE1 3.81Å; H787-E895 IonicContact NE2-OE1 2.82Å; H787-E895 PolarHBondContact NE2-OE1 2.82Å; S828-E895 WeakPolarHBondContact CB-OE2 3.49Å; S828-E895 PolarHBondContact OG-OE1 2.97Å; S828-E895 PolarHBondContact OG-OE2 3.22Å; Y869-E895 VanDerWaalsContact CE1-OE2 3.27Å; Y869-E895 WeakPolarHBondContact CE1-OE2 3.27Å; Y869-E895 PolarHBondContact OH-OE1 3.41Å; Y869-E895 VanDerWaalsContact OH-OE1 3.08Å; Y869-E895 PolarHBondContact OH-OE2 3.49Å; V891-E895 WeakPolarHBondContact O-CG 3.4Å; V891-E895 PolarHBondContact O-N 2.74Å; V892-E895 PolarHBondContact O-N 3.39Å; E895-V897 VanDerWaalsContact C-N 3.32Å; E895-V897 PolarHBondContact O-N 2.97Å; E895-T898 PolarHBondContact O-N 3.25Å; E895-G899 VanDerWaalsContact O-CA 3.28Å; E895-G899 WeakPolarHBondContact O-CA 3.38Å; E895-G899 PolarHBondContact O-N 2.85Å; E895-K900 WeakPolarHBondContact CG-O 3.26Å; E895-P902 WeakPolarHBondContact OE1-CD 3.4Å; E895-L912 HydrophobicContact CG-CD2 3.93Å
896	L	97.6	Very high	92.9	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-62.1	-37.2	179.2	-73.4	170	0	0	0	112.8	L782 L786 R799 A803 V892 L893 L894	L782-L896 HydrophobicContact CD1-CD2 3.85Å; L782-L896 HydrophobicContact CD2-CD2 4.03Å; L782-L896 HydrophobicContact CD2-CG 4.37Å; L786-L896 HydrophobicContact CD2-CD2 4.37Å; R799-L896 HydrophobicContact CB-CD2 3.95Å; R799-L896 WeakPolarHBondContact CD-O 3.29Å; R799-L896 HydrophobicContact CG-CD2 3.96Å; R799-L896 PolarHBondContact NH1-O 3.01Å; A803-L896 HydrophobicContact CB-CD1 3.87Å; V892-L896 HydrophobicContact CG1-CD1 4.36Å; V892-L896 WeakPolarHBondContact O-CG 3.48Å; V892-L896 PolarHBondContact O-N 2.87Å; L893-L896 HydrophobicContact CD2-CD1 4.48Å; L893-L896 PolarHBondContact O-N 3.19Å; L894-L896 VanDerWaalsContact C-N 3.33Å; L894-L896 PolarHBondContact O-N 3.47Å
897	V	96.8	Very high	92.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-78.5	-41	179.6	170.2	0	0	0	0	112.3	W796 L893 L894 E895 L929 D930 I941 V944 L945	W796-V897 HydrophobicContact CH2-CG2 4.31Å; W796-V897 HydrophobicContact CZ3-CG2 4.31Å; L893-V897 WeakPolarHBondContact O-CG2 3.36Å; L893-V897 PolarHBondContact O-N 3.4Å; L894-V897 PolarHBondContact O-N 2.84Å; E895-V897 VanDerWaalsContact C-N 3.32Å; E895-V897 PolarHBondContact O-N 2.97Å; V897-L929 HydrophobicContact CG1-CD2 3.57Å; V897-D930 WeakPolarHBondContact O-CB 3.4Å; V897-D930 PolarHBondContact O-N 3.3Å; V897-I941 HydrophobicContact CG1-CG2 3.77Å; V897-I941 HydrophobicContact CG2-CG2 4.44Å; V897-V944 HydrophobicContact CG2-CB 4.34Å; V897-V944 HydrophobicContact CG2-CG1 3.9Å; V897-L945 HydrophobicContact CG1-CB 4.2Å; V897-L945 HydrophobicContact CG1-CD1 4.19Å
898	T	94.8	Very high	91.4	Very high	6 Å²	6	27.4 Å²	27.4	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-92.5	-20.7	-172.7	65.7	0	0	0	0	113.6	L894 E895 K900 L912 W915 V916 V928 D930	L894-T898 VanDerWaalsContact O-CB 3.31Å; L894-T898 WeakPolarHBondContact O-CB 3.31Å; L894-T898 VanDerWaalsContact O-CG2 3.25Å; L894-T898 WeakPolarHBondContact O-CG2 3.2Å; L894-T898 PolarHBondContact O-N 3.47Å; L894-T898 PolarHBondContact O-OG1 2.92Å; E895-T898 PolarHBondContact O-N 3.25Å; T898-K900 PolarHBondContact O-N 3.36Å; T898-K900 PolarHBondContact OG1-N 3.2Å; T898-L912 HydrophobicContact CG2-CD1 4.47Å; T898-W915 HydrophobicContact CG2-CZ3 4.48Å; T898-V916 HydrophobicContact CG2-CG2 3.87Å; T898-V928 WeakPolarHBondContact CA-O 3.41Å; T898-V928 WeakPolarHBondContact CB-O 3.38Å; T898-V928 HydrophobicContact CG2-CB 4.43Å; T898-V928 WeakPolarHBondContact CG2-O 3.39Å; T898-D930 WeakPolarHBondContact O-CB 3.3Å
899	G	93.8	Very high	90.4	Very high	20 Å²	20	36.8 Å²	36.8	21%	0.206	21%	0.214	C	C	.	.			trans	65.8	14.5	-172.1	0	0	0	0	0	113.4	E895 D930	E895-G899 VanDerWaalsContact O-CA 3.28Å; E895-G899 WeakPolarHBondContact O-CA 3.38Å; E895-G899 PolarHBondContact O-N 2.85Å; G899-D930 WeakPolarHBondContact CA-OD2 3.47Å
900	K	93.4	Very high	89.5	Confident	48 Å²	48	40.8 Å²	40.8	21%	0.209	23%	0.232	C	C	.	.			trans	-108.6	148.6	-177.6	-64.7	-167	173.1	-76.3	0	111.6	H787 E895 T898 E906 F907 L912 W915	H787-K900 PolarHBondContact CE1-O 3.12Å; E895-K900 WeakPolarHBondContact CG-O 3.26Å; T898-K900 PolarHBondContact O-N 3.36Å; T898-K900 PolarHBondContact OG1-N 3.2Å; K900-E906 IonicContact NZ-OE2 3.25Å; K900-E906 PolarHBondContact NZ-OE2 3.15Å; K900-F907 HydrophobicContact CB-CZ 3.94Å; K900-F907 HydrophobicContact CD-CE1 3.56Å; K900-F907 HydrophobicContact CD-CZ 3.77Å; K900-L912 HydrophobicContact CB-CD1 4.1Å; K900-W915 HydrophobicContact CD-CH2 3.92Å; K900-W915 HydrophobicContact CD-CZ2 4.37Å; K900-W915 HydrophobicContact CD-CZ3 3.98Å
901	P	92.9	Very high	89	Confident	34 Å²	34	42.6 Å²	42.6	22%	0.221	24%	0.241	C	C	.	.			trans	-69.4	162.8	174.8	30	-34.5	0	0	0	111.3	V903 D904 F907	P901-V903 PolarHBondContact O-N 3.14Å; P901-D904 HydrophobicContact CG-CB 4.04Å; P901-F907 WeakPolarHBondContact O-CE2 3.2Å
902	P	89.8	Confident	88.7	Confident	15 Å²	15	42.7 Å²	42.7	10%	0.097	24%	0.242	C	C	.	.	S	Bend	trans	-63.9	-25.1	-179.2	29.2	-41.1	0	0	0	113.7	Y869 V891 E895 L912	Y869-P902 HydrophobicContact CD2-CG 4.32Å; Y869-P902 HydrophobicContact CE2-CB 4.06Å; Y869-P902 HydrophobicContact CE2-CG 3.53Å; V891-P902 HydrophobicContact CG1-CB 3.81Å; E895-P902 WeakPolarHBondContact OE1-CD 3.4Å; P902-L912 WeakPolarHBondContact O-CB 3.28Å; P902-L912 PolarHBondContact O-N 2.93Å
903	V	86	Confident	88.4	Confident	80 Å²	80	43.2 Å²	43.2	49%	0.485	25%	0.245	S	C	.	.	S	Bend	trans	-135	123.7	175.1	-174.8	0	0	0	0	107	P901	P901-V903 PolarHBondContact O-N 3.14Å
904	D	82.1	Confident	87.9	Confident	32 Å²	32	49.2 Å²	49.2	17%	0.171	27%	0.271	C	S	.	.			trans	-138.2	135	-179.8	-163.6	-58.8	0	0	0	108.4	P901 E906 F907	P901-D904 HydrophobicContact CG-CB 4.04Å; D904-E906 PolarHBondContact O-N 3.11Å; D904-E906 VanDerWaalsContact O-N 3.1Å; D904-E906 VanDerWaalsContact OD1-CB 3.32Å; D904-E906 WeakPolarHBondContact OD1-CB 3.29Å; D904-E906 WeakPolarHBondContact OD1-CG 3.44Å; D904-E906 PolarHBondContact OD1-N 3.21Å; D904-F907 HydrophobicContact CB-CD1 4.11Å; D904-F907 HydrophobicContact CB-CD2 3.64Å; D904-F907 HydrophobicContact CB-CE1 3.9Å; D904-F907 HydrophobicContact CB-CE2 3.37Å; D904-F907 HydrophobicContact CB-CG 3.99Å; D904-F907 HydrophobicContact CB-CZ 3.52Å; D904-F907 VanDerWaalsContact N-CD2 3.32Å; D904-F907 WeakPolarHBondContact O-CB 3.34Å; D904-F907 WeakPolarHBondContact O-CG 3.08Å; D904-F907 PolarHBondContact O-N 3.11Å
905	P	76.3	Confident	87.5	Confident	126 Å²	126	51.1 Å²	51.1	82%	0.818	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-51.6	-28.3	172.4	-27.1	35	0	0	0	114.2	F907 G908	P905-F907 PolarHBondContact O-N 3.43Å; P905-G908 PolarHBondContact O-N 2.6Å; P905-G908 VanDerWaalsContact O-N 3.16Å
906	E	78	Confident	87.3	Confident	133 Å²	133	51.1 Å²	51.1	62%	0.621	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-60.7	-22.4	175.3	-70.7	-175.5	172.9	0	0	113.6	K900 D904 G908	K900-E906 IonicContact NZ-OE2 3.25Å; K900-E906 PolarHBondContact NZ-OE2 3.15Å; D904-E906 PolarHBondContact O-N 3.11Å; D904-E906 VanDerWaalsContact O-N 3.1Å; D904-E906 VanDerWaalsContact OD1-CB 3.32Å; D904-E906 WeakPolarHBondContact OD1-CB 3.29Å; D904-E906 WeakPolarHBondContact OD1-CG 3.44Å; D904-E906 PolarHBondContact OD1-N 3.21Å; E906-G908 VanDerWaalsContact C-N 3.32Å
907	F	80	Confident	86.9	Confident	11 Å²	11	53.4 Å²	53.4	5%	0.048	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-82.3	-11.4	-179.8	-52.2	-25.8	0	0	0	113.1	K900 P901 D904 P905 E909 K910 L912 W915	K900-F907 HydrophobicContact CB-CZ 3.94Å; K900-F907 HydrophobicContact CD-CE1 3.56Å; K900-F907 HydrophobicContact CD-CZ 3.77Å; P901-F907 WeakPolarHBondContact O-CE2 3.2Å; D904-F907 HydrophobicContact CB-CD1 4.11Å; D904-F907 HydrophobicContact CB-CD2 3.64Å; D904-F907 HydrophobicContact CB-CE1 3.9Å; D904-F907 HydrophobicContact CB-CE2 3.37Å; D904-F907 HydrophobicContact CB-CG 3.99Å; D904-F907 HydrophobicContact CB-CZ 3.52Å; D904-F907 VanDerWaalsContact N-CD2 3.32Å; D904-F907 WeakPolarHBondContact O-CB 3.34Å; D904-F907 WeakPolarHBondContact O-CG 3.08Å; D904-F907 PolarHBondContact O-N 3.11Å; P905-F907 PolarHBondContact O-N 3.43Å; F907-E909 PolarHBondContact O-N 2.97Å; F907-K910 HydrophobicContact CB-CB 4.19Å; F907-K910 WeakPolarHBondContact CB-O 3.24Å; F907-K910 WeakPolarHBondContact O-CB 3.33Å; F907-K910 PolarHBondContact O-N 3.45Å; F907-L912 HydrophobicContact CE2-CB 4.02Å; F907-L912 HydrophobicContact CE2-CD1 4.1Å; F907-L912 HydrophobicContact CZ-CB 4.49Å; F907-L912 HydrophobicContact CZ-CD1 3.69Å; F907-W915 HydrophobicContact CB-CB 4.28Å; F907-W915 HydrophobicContact CB-CG 4.41Å; F907-W915 HydrophobicContact CD1-CB 3.85Å; F907-W915 AromaticContact CD1-CD1 3.37Å; F907-W915 AromaticContact CD1-CD2 3.74Å; F907-W915 HydrophobicContact CD1-CD2 3.74Å; F907-W915 AromaticContact CD1-CE2 3.99Å; F907-W915 AromaticContact CD1-CG 3.37Å; F907-W915 HydrophobicContact CD1-CG 3.37Å; F907-W915 AromaticContact CD1-NE1 3.72Å; F907-W915 HydrophobicContact CD2-CB 4.49Å; F907-W915 HydrophobicContact CE1-CB 4.28Å; F907-W915 AromaticContact CE1-CD2 3.61Å; F907-W915 HydrophobicContact CE1-CD2 3.61Å; F907-W915 AromaticContact CE1-CE2 3.93Å; F907-W915 AromaticContact CE1-CE3 3.97Å; F907-W915 HydrophobicContact CE1-CE3 3.97Å; F907-W915 AromaticContact CE1-CG 3.73Å; F907-W915 HydrophobicContact CE1-CG 3.73Å; F907-W915 HydrophobicContact CG-CB 3.97Å; F907-W915 AromaticContact CG-CG 3.98Å; F907-W915 HydrophobicContact CG-CG 3.98Å; F907-W915 HydrophobicContact CZ-CD2 4.49Å
908	G	76.3	Confident	86.2	Confident	59 Å²	59	54.4 Å²	54.4	61%	0.608	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	-126.7	-167.3	0	0	0	0	0	110.8	P905 E906 K910	P905-G908 PolarHBondContact O-N 2.6Å; P905-G908 VanDerWaalsContact O-N 3.16Å; E906-G908 VanDerWaalsContact C-N 3.32Å; G908-K910 VanDerWaalsContact C-N 3.27Å; G908-K910 PolarHBondContact O-N 3.17Å
909	E	74.1	Confident	85.8	Confident	203 Å²	203	54.7 Å²	54.7	95%	0.949	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-1.6	178.2	-60.8	-175.3	169.1	0	0	114	F907	F907-E909 PolarHBondContact O-N 2.97Å
910	K	80.4	Confident	85.5	Confident	84 Å²	84	55.6 Å²	55.6	37%	0.365	30%	0.302	S	S	.	.			trans	-85.2	145.3	-178.5	-63.9	175.6	-178.2	175.4	0	111	F907 G908 K914 W915 S918	F907-K910 HydrophobicContact CB-CB 4.19Å; F907-K910 WeakPolarHBondContact CB-O 3.24Å; F907-K910 WeakPolarHBondContact O-CB 3.33Å; F907-K910 PolarHBondContact O-N 3.45Å; G908-K910 VanDerWaalsContact C-N 3.27Å; G908-K910 PolarHBondContact O-N 3.17Å; K910-K914 HydrophobicContact CB-CB 3.95Å; K910-K914 HydrophobicContact CD-CB 4.46Å; K910-K914 HydrophobicContact CG-CB 4.15Å; K910-W915 HydrophobicContact CB-CB 4.44Å; K910-S918 PolarHBondContact NZ-OG 2.94Å
911	D	86.2	Confident	84.7	Confident	38 Å²	38	59.9 Å²	59.9	20%	0.203	33%	0.328	C	S	.	.			trans	-79.7	170.8	160.7	56.7	53.5	0	0	0	110.6	V913 K914 W915	D911-V913 VanDerWaalsContact C-N 3.27Å; D911-V913 PolarHBondContact O-N 3.16Å; D911-V913 WeakPolarHBondContact OD1-CB 3.3Å; D911-V913 PolarHBondContact OD1-N 3.17Å; D911-V913 VanDerWaalsContact OD1-N 3.12Å; D911-K914 PolarHBondContact O-N 2.87Å; D911-K914 WeakPolarHBondContact OD1-CG 3.46Å; D911-K914 PolarHBondContact OD1-N 3.31Å; D911-W915 WeakPolarHBondContact O-CB 3.24Å; D911-W915 PolarHBondContact O-N 3.11Å
912	L	92.7	Very high	84.1	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-54.8	-40.2	179.8	179.3	63.6	0	0	0	112.6	L894 E895 T898 K900 P902 F907 W915 V916	L894-L912 HydrophobicContact CB-CD2 3.72Å; L894-L912 HydrophobicContact CB-CG 4.15Å; L894-L912 HydrophobicContact CD1-CG 4.49Å; E895-L912 HydrophobicContact CG-CD2 3.93Å; T898-L912 HydrophobicContact CG2-CD1 4.47Å; K900-L912 HydrophobicContact CB-CD1 4.1Å; P902-L912 WeakPolarHBondContact O-CB 3.28Å; P902-L912 PolarHBondContact O-N 2.93Å; F907-L912 HydrophobicContact CE2-CB 4.02Å; F907-L912 HydrophobicContact CE2-CD1 4.1Å; F907-L912 HydrophobicContact CZ-CB 4.49Å; F907-L912 HydrophobicContact CZ-CD1 3.69Å; L912-W915 HydrophobicContact CD1-CE3 4.14Å; L912-W915 PolarHBondContact O-N 3.48Å; L912-V916 HydrophobicContact CD1-CG2 4.05Å; L912-V916 HydrophobicContact CG-CG2 4.4Å; L912-V916 WeakPolarHBondContact O-CB 3.26Å; L912-V916 VanDerWaalsContact O-CG2 3.27Å; L912-V916 WeakPolarHBondContact O-CG2 3.43Å; L912-V916 PolarHBondContact O-N 2.92Å
913	V	92	Very high	83.8	Confident	14 Å²	14	70.6 Å²	70.6	9%	0.085	37%	0.371	C	S	.	.	H	α-helix	trans	-63.4	-51.1	-179.1	-178.6	0	0	0	0	110.2	V891 L894 D911 W915 V916 C917	V891-V913 HydrophobicContact CG2-CG2 3.87Å; L894-V913 HydrophobicContact CD1-CB 4.3Å; L894-V913 HydrophobicContact CD1-CG2 3.77Å; D911-V913 VanDerWaalsContact C-N 3.27Å; D911-V913 PolarHBondContact O-N 3.16Å; D911-V913 WeakPolarHBondContact OD1-CB 3.3Å; D911-V913 PolarHBondContact OD1-N 3.17Å; D911-V913 VanDerWaalsContact OD1-N 3.12Å; V913-W915 VanDerWaalsContact C-N 3.33Å; V913-W915 PolarHBondContact O-N 3.15Å; V913-V916 PolarHBondContact O-N 2.9Å; V913-C917 PolarHBondContact O-N 2.68Å; V913-C917 PolarHBondContact O-SG 2.88Å; V913-C917 VanDerWaalsContact O-SG 3.35Å
914	K	87	Confident	83.5	Confident	125 Å²	125	68.1 Å²	68.1	54%	0.543	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-38.9	177.4	-71.3	177	-175.9	173.1	0	112	K910 D911 S918	K910-K914 HydrophobicContact CB-CB 3.95Å; K910-K914 HydrophobicContact CD-CB 4.46Å; K910-K914 HydrophobicContact CG-CB 4.15Å; D911-K914 PolarHBondContact O-N 2.87Å; D911-K914 WeakPolarHBondContact OD1-CG 3.46Å; D911-K914 PolarHBondContact OD1-N 3.31Å; K914-S918 WeakPolarHBondContact O-CB 3.29Å; K914-S918 PolarHBondContact O-N 2.91Å; K914-S918 PolarHBondContact O-OG 2.82Å
915	W	91	Very high	83.8	Confident	41 Å²	41	68.6 Å²	68.6	16%	0.155	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-47.7	176.5	178.9	85.5	0	0	0	111.2	T898 K900 F907 K910 D911 L912 V913 S918 T919 V928	T898-W915 HydrophobicContact CG2-CZ3 4.48Å; K900-W915 HydrophobicContact CD-CH2 3.92Å; K900-W915 HydrophobicContact CD-CZ2 4.37Å; K900-W915 HydrophobicContact CD-CZ3 3.98Å; F907-W915 HydrophobicContact CB-CB 4.28Å; F907-W915 HydrophobicContact CB-CG 4.41Å; F907-W915 HydrophobicContact CD1-CB 3.85Å; F907-W915 AromaticContact CD1-CD1 3.37Å; F907-W915 AromaticContact CD1-CD2 3.74Å; F907-W915 HydrophobicContact CD1-CD2 3.74Å; F907-W915 AromaticContact CD1-CE2 3.99Å; F907-W915 AromaticContact CD1-CG 3.37Å; F907-W915 HydrophobicContact CD1-CG 3.37Å; F907-W915 AromaticContact CD1-NE1 3.72Å; F907-W915 HydrophobicContact CD2-CB 4.49Å; F907-W915 HydrophobicContact CE1-CB 4.28Å; F907-W915 AromaticContact CE1-CD2 3.61Å; F907-W915 HydrophobicContact CE1-CD2 3.61Å; F907-W915 AromaticContact CE1-CE2 3.93Å; F907-W915 AromaticContact CE1-CE3 3.97Å; F907-W915 HydrophobicContact CE1-CE3 3.97Å; F907-W915 AromaticContact CE1-CG 3.73Å; F907-W915 HydrophobicContact CE1-CG 3.73Å; F907-W915 HydrophobicContact CG-CB 3.97Å; F907-W915 AromaticContact CG-CG 3.98Å; F907-W915 HydrophobicContact CG-CG 3.98Å; F907-W915 HydrophobicContact CZ-CD2 4.49Å; K910-W915 HydrophobicContact CB-CB 4.44Å; D911-W915 WeakPolarHBondContact O-CB 3.24Å; D911-W915 PolarHBondContact O-N 3.11Å; L912-W915 HydrophobicContact CD1-CE3 4.14Å; L912-W915 PolarHBondContact O-N 3.48Å; V913-W915 VanDerWaalsContact C-N 3.33Å; V913-W915 PolarHBondContact O-N 3.15Å; W915-S918 PolarHBondContact O-N 3.06Å; W915-S918 PolarHBondContact O-OG 3.31Å; W915-T919 VanDerWaalsContact O-CB 3.24Å; W915-T919 WeakPolarHBondContact O-CB 3.33Å; W915-T919 PolarHBondContact O-N 2.97Å; W915-T919 PolarHBondContact O-OG1 3.29Å; W915-V928 HydrophobicContact CH2-CB 4.48Å; W915-V928 HydrophobicContact CH2-CG1 4.25Å; W915-V928 HydrophobicContact CZ3-CB 4.17Å; W915-V928 HydrophobicContact CZ3-CG1 3.99Å
916	V	92.7	Very high	84.3	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-59.9	-53.4	177.2	170.3	0	0	0	0	110.8	L894 T898 L912 V913 S918 T919 I920 V928 L945 L949	L894-V916 HydrophobicContact CD2-CG1 4.18Å; L894-V916 HydrophobicContact CD2-CG2 4.33Å; T898-V916 HydrophobicContact CG2-CG2 3.87Å; L912-V916 HydrophobicContact CD1-CG2 4.05Å; L912-V916 HydrophobicContact CG-CG2 4.4Å; L912-V916 WeakPolarHBondContact O-CB 3.26Å; L912-V916 VanDerWaalsContact O-CG2 3.27Å; L912-V916 WeakPolarHBondContact O-CG2 3.43Å; L912-V916 PolarHBondContact O-N 2.92Å; V913-V916 PolarHBondContact O-N 2.9Å; V916-S918 PolarHBondContact O-N 2.68Å; V916-T919 PolarHBondContact O-N 2.91Å; V916-T919 VanDerWaalsContact O-N 3.16Å; V916-I920 HydrophobicContact CG1-CD1 3.6Å; V916-I920 HydrophobicContact CG1-CG1 4.26Å; V916-I920 WeakPolarHBondContact O-CG1 3.17Å; V916-I920 PolarHBondContact O-N 3.35Å; V916-V928 HydrophobicContact CG1-CG1 4.3Å; V916-V928 HydrophobicContact CG1-CG2 4.45Å; V916-V928 HydrophobicContact CG2-CG1 4.5Å; V916-L945 HydrophobicContact CG1-CD1 4.08Å; V916-L949 HydrophobicContact CG1-CD2 3.99Å
917	C	88	Confident	84.9	Confident	51 Å²	51	66 Å²	66	35%	0.345	34%	0.343	S	S	.	.	H	α-helix	trans	-56.4	-50.6	-179.6	-66.4	0	0	0	0	111.5	V913 T919 I920 D921	V913-C917 PolarHBondContact O-N 2.68Å; V913-C917 PolarHBondContact O-SG 2.88Å; V913-C917 VanDerWaalsContact O-SG 3.35Å; C917-T919 VanDerWaalsContact C-N 3.3Å; C917-T919 PolarHBondContact O-N 3.09Å; C917-I920 PolarHBondContact O-N 3.02Å; C917-D921 VanDerWaalsContact O-CG 3.3Å; C917-D921 PolarHBondContact O-N 3.12Å
918	S	83	Confident	85.5	Confident	21 Å²	21	65.7 Å²	65.7	15%	0.147	34%	0.342	C	S	.	.	H	α-helix	trans	-65.9	-30.4	-179.9	64.6	0	0	0	0	113.8	K910 K914 W915 V916 Q922	K910-S918 PolarHBondContact NZ-OG 2.94Å; K914-S918 WeakPolarHBondContact O-CB 3.29Å; K914-S918 PolarHBondContact O-N 2.91Å; K914-S918 PolarHBondContact O-OG 2.82Å; W915-S918 PolarHBondContact O-N 3.06Å; W915-S918 PolarHBondContact O-OG 3.31Å; V916-S918 PolarHBondContact O-N 2.68Å; S918-Q922 WeakPolarHBondContact O-CB 2.96Å; S918-Q922 WeakPolarHBondContact O-CG 3.35Å; S918-Q922 PolarHBondContact O-N 3.19Å; S918-Q922 VanDerWaalsContact O-N 3.17Å
919	T	86.2	Confident	86.3	Confident	11 Å²	11	63.5 Å²	63.5	7%	0.067	32%	0.316	C	S	.	.	H	α-helix	trans	-76.3	-39	177.9	-58.8	0	0	0	0	111.5	W915 V916 C917 D921 Q922 K923 G924 H927 V928	W915-T919 VanDerWaalsContact O-CB 3.24Å; W915-T919 WeakPolarHBondContact O-CB 3.33Å; W915-T919 PolarHBondContact O-N 2.97Å; W915-T919 PolarHBondContact O-OG1 3.29Å; V916-T919 PolarHBondContact O-N 2.91Å; V916-T919 VanDerWaalsContact O-N 3.16Å; C917-T919 VanDerWaalsContact C-N 3.3Å; C917-T919 PolarHBondContact O-N 3.09Å; T919-D921 VanDerWaalsContact C-N 3.35Å; T919-Q922 PolarHBondContact O-N 3.16Å; T919-K923 HydrophobicContact CG2-CB 4.39Å; T919-K923 HydrophobicContact CG2-CD 4.37Å; T919-K923 WeakPolarHBondContact O-CA 3.43Å; T919-K923 WeakPolarHBondContact O-CB 3.33Å; T919-K923 PolarHBondContact O-N 3.48Å; T919-G924 PolarHBondContact O-N 3.33Å; T919-H927 HydrophobicContact CG2-CB 3.92Å; T919-V928 HydrophobicContact CG2-CG1 3.56Å
920	I	87.8	Confident	87.2	Confident	39 Å²	39	54.4 Å²	54.4	20%	0.2	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-46.6	173.5	-69.2	172	0	0	0	109.9	V916 C917 Q922 G924 V925 V928 L945 L949	V916-I920 HydrophobicContact CG1-CD1 3.6Å; V916-I920 HydrophobicContact CG1-CG1 4.26Å; V916-I920 WeakPolarHBondContact O-CG1 3.17Å; V916-I920 PolarHBondContact O-N 3.35Å; C917-I920 PolarHBondContact O-N 3.02Å; I920-Q922 VanDerWaalsContact C-N 3.33Å; I920-Q922 PolarHBondContact O-N 3.07Å; I920-G924 WeakPolarHBondContact O-CA 3.19Å; I920-G924 PolarHBondContact O-N 3.07Å; I920-V925 HydrophobicContact CG1-CG2 4.43Å; I920-V925 HydrophobicContact CG2-CG2 4.12Å; I920-V928 HydrophobicContact CD1-CG2 4.26Å; I920-V928 HydrophobicContact CG1-CG1 4.05Å; I920-V928 HydrophobicContact CG1-CG2 3.99Å; I920-L945 HydrophobicContact CD1-CD2 4.09Å; I920-L949 HydrophobicContact CD1-CD1 3.89Å
921	D	77.4	Confident	87.6	Confident	139 Å²	139	55.8 Å²	55.8	74%	0.743	29%	0.294	S	S	*	.	H	α-helix	trans	-63.5	-37.1	-179.6	-69.2	-20.5	0	0	0	112.7	C917 T919	C917-D921 VanDerWaalsContact O-CG 3.3Å; C917-D921 PolarHBondContact O-N 3.12Å; T919-D921 VanDerWaalsContact C-N 3.35Å
922	Q	80.1	Confident	87.7	Confident	145 Å²	145	60.7 Å²	60.7	68%	0.678	31%	0.314	S	S	*	.	H	α-helix	trans	-90.3	-37	-175.1	-69.3	175.7	8.7	0	0	114.2	S918 T919 I920	S918-Q922 WeakPolarHBondContact O-CB 2.96Å; S918-Q922 WeakPolarHBondContact O-CG 3.35Å; S918-Q922 PolarHBondContact O-N 3.19Å; S918-Q922 VanDerWaalsContact O-N 3.17Å; T919-Q922 PolarHBondContact O-N 3.16Å; I920-Q922 VanDerWaalsContact C-N 3.33Å; I920-Q922 PolarHBondContact O-N 3.07Å
923	K	81.9	Confident	87.6	Confident	128 Å²	128	61 Å²	61	56%	0.557	32%	0.316	S	S	*	.	H	α-helix	trans	-127.4	-9.3	-167.9	-57.6	-177.3	-177.3	172.9	0	113.3	T919 H927	T919-K923 HydrophobicContact CG2-CB 4.39Å; T919-K923 HydrophobicContact CG2-CD 4.37Å; T919-K923 WeakPolarHBondContact O-CA 3.43Å; T919-K923 WeakPolarHBondContact O-CB 3.33Å; T919-K923 PolarHBondContact O-N 3.48Å; K923-H927 HydrophobicContact CB-CB 3.98Å; K923-H927 PolarHBondContact O-CE1 3.13Å; K923-H927 VanDerWaalsContact O-CE1 3.25Å; K923-H927 PolarHBondContact O-ND1 2.57Å
924	G	80.3	Confident	87.4	Confident	28 Å²	28	64.7 Å²	64.7	29%	0.289	33%	0.334	S	S	.	.			trans	82	170.2	-176.7	0	0	0	0	0	114	T919 I920 E926 H927	T919-G924 PolarHBondContact O-N 3.33Å; I920-G924 WeakPolarHBondContact O-CA 3.19Å; I920-G924 PolarHBondContact O-N 3.07Å; G924-E926 PolarHBondContact O-N 3.01Å; G924-H927 PolarHBondContact O-N 3.48Å
925	V	87.6	Confident	87.4	Confident	43 Å²	43	62.4 Å²	62.4	26%	0.261	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-62.2	-35.5	-168.3	177.9	0	0	0	0	113.8	I920 H927 V928 L929 N942 L945	I920-V925 HydrophobicContact CG1-CG2 4.43Å; I920-V925 HydrophobicContact CG2-CG2 4.12Å; V925-H927 PolarHBondContact O-N 3.18Å; V925-V928 WeakPolarHBondContact O-CG2 3.39Å; V925-V928 PolarHBondContact O-N 3.42Å; V925-V928 VanDerWaalsContact O-N 3.09Å; V925-L929 HydrophobicContact CG1-CD2 4.24Å; V925-L929 HydrophobicContact CG1-CG 4.47Å; V925-N942 WeakPolarHBondContact CG1-OD1 3.25Å; V925-L945 HydrophobicContact CG1-CD2 3.51Å
926	E	87.7	Confident	87.3	Confident	90 Å²	90	65.5 Å²	65.5	42%	0.421	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-56.9	-29.4	-177.8	-50.7	-56.5	137.9	0	0	113.6	G924 V928 K938	G924-E926 PolarHBondContact O-N 3.01Å; E926-V928 VanDerWaalsContact C-N 3.3Å; E926-V928 PolarHBondContact O-N 3Å; E926-K938 VanDerWaalsContact CD-CE 3.46Å; E926-K938 WeakPolarHBondContact OE1-CE 3.3Å; E926-K938 IonicContact OE1-NZ 3.17Å; E926-K938 PolarHBondContact OE1-NZ 2.88Å; E926-K938 VanDerWaalsContact OE2-CE 3.25Å; E926-K938 WeakPolarHBondContact OE2-CE 3.41Å; E926-K938 IonicContact OE2-NZ 2.73Å; E926-K938 PolarHBondContact OE2-NZ 2.77Å
927	H	90	Very high	87.2	Confident	115 Å²	115	68.3 Å²	68.3	53%	0.532	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-80.6	-9.8	-175.2	-67.2	88.8	0	0	0	113.7	T919 K923 G924 V925	T919-H927 HydrophobicContact CG2-CB 3.92Å; K923-H927 HydrophobicContact CB-CB 3.98Å; K923-H927 PolarHBondContact O-CE1 3.13Å; K923-H927 VanDerWaalsContact O-CE1 3.25Å; K923-H927 PolarHBondContact O-ND1 2.57Å; G924-H927 PolarHBondContact O-N 3.48Å; V925-H927 PolarHBondContact O-N 3.18Å
928	V	92.7	Very high	87.2	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.018	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-16.2	175.2	-60.8	0	0	0	0	112.9	T898 W915 V916 T919 I920 V925 E926 L945	T898-V928 WeakPolarHBondContact CA-O 3.41Å; T898-V928 WeakPolarHBondContact CB-O 3.38Å; T898-V928 HydrophobicContact CG2-CB 4.43Å; T898-V928 WeakPolarHBondContact CG2-O 3.39Å; W915-V928 HydrophobicContact CH2-CB 4.48Å; W915-V928 HydrophobicContact CH2-CG1 4.25Å; W915-V928 HydrophobicContact CZ3-CB 4.17Å; W915-V928 HydrophobicContact CZ3-CG1 3.99Å; V916-V928 HydrophobicContact CG1-CG1 4.3Å; V916-V928 HydrophobicContact CG1-CG2 4.45Å; V916-V928 HydrophobicContact CG2-CG1 4.5Å; T919-V928 HydrophobicContact CG2-CG1 3.56Å; I920-V928 HydrophobicContact CD1-CG2 4.26Å; I920-V928 HydrophobicContact CG1-CG1 4.05Å; I920-V928 HydrophobicContact CG1-CG2 3.99Å; V925-V928 WeakPolarHBondContact O-CG2 3.39Å; V925-V928 PolarHBondContact O-N 3.42Å; V925-V928 VanDerWaalsContact O-N 3.09Å; E926-V928 VanDerWaalsContact C-N 3.3Å; E926-V928 PolarHBondContact O-N 3Å; V928-L945 HydrophobicContact CG2-CD2 3.85Å
929	L	93.7	Very high	87.4	Confident	14 Å²	14	73.5 Å²	73.5	7%	0.073	38%	0.382	C	S	.	.	S	Bend	trans	-73.8	142.2	-176.8	-54.5	-172.5	0	0	0	111.4	V897 V925 S931 M935 I941 L945	V897-L929 HydrophobicContact CG1-CD2 3.57Å; V925-L929 HydrophobicContact CG1-CD2 4.24Å; V925-L929 HydrophobicContact CG1-CG 4.47Å; L929-S931 PolarHBondContact O-N 3.32Å; L929-S931 VanDerWaalsContact O-N 3.13Å; L929-M935 HydrophobicContact CB-CE 4.28Å; L929-M935 HydrophobicContact CD1-SD 4.35Å; L929-I941 HydrophobicContact CD1-CG2 4.2Å; L929-I941 HydrophobicContact CD2-CG2 3.61Å; L929-I941 HydrophobicContact CG-CG2 4.42Å; L929-L945 HydrophobicContact CD2-CD2 4.23Å
930	D	92.5	Very high	87.7	Confident	12 Å²	12	74.3 Å²	74.3	6%	0.064	39%	0.385	C	S	.	.			trans	-61.7	116.6	174.7	-173.7	-11.1	0	0	0	110.4	R799 V897 T898 G899 K932 L933	R799-D930 IonicContact CZ-OD2 2.73Å; R799-D930 VanDerWaalsContact CZ-OD2 3.25Å; R799-D930 IonicContact NH1-OD2 3.59Å; R799-D930 PolarHBondContact NH1-OD2 3.05Å; R799-D930 IonicContact NH2-OD2 2.73Å; R799-D930 PolarHBondContact NH2-OD2 2.99Å; V897-D930 WeakPolarHBondContact O-CB 3.4Å; V897-D930 PolarHBondContact O-N 3.3Å; T898-D930 WeakPolarHBondContact O-CB 3.3Å; G899-D930 WeakPolarHBondContact CA-OD2 3.47Å; D930-K932 PolarHBondContact O-N 3.35Å; D930-K932 WeakPolarHBondContact OD1-CB 3.29Å; D930-K932 WeakPolarHBondContact OD1-CG 3.22Å; D930-K932 PolarHBondContact OD1-N 2.8Å; D930-L933 HydrophobicContact CB-CD1 3.91Å; D930-L933 HydrophobicContact CB-CG 3.96Å; D930-L933 WeakPolarHBondContact O-CB 3.46Å; D930-L933 PolarHBondContact O-N 2.76Å
931	S	89.2	Confident	88.1	Confident	112 Å²	112	72.4 Å²	72.4	78%	0.783	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-17.2	177.3	61.2	0	0	0	0	114.8	L929	L929-S931 PolarHBondContact O-N 3.32Å; L929-S931 VanDerWaalsContact O-N 3.13Å
932	K	88.5	Confident	88.8	Confident	142 Å²	142	67.5 Å²	67.5	62%	0.617	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-13.1	177.3	-60.6	171	-174.5	165.3	0	113.3	D930	D930-K932 PolarHBondContact O-N 3.35Å; D930-K932 WeakPolarHBondContact OD1-CB 3.29Å; D930-K932 WeakPolarHBondContact OD1-CG 3.22Å; D930-K932 PolarHBondContact OD1-N 2.8Å
933	L	90.3	Very high	89.3	Confident	9 Å²	9	65 Å²	65	5%	0.047	33%	0.333	C	S	.	.	S	Bend	trans	-79.8	144.1	179.4	-69	174.3	0	0	0	111.3	W796 D930 M935 I941	W796-L933 HydrophobicContact CB-CD2 4.15Å; W796-L933 HydrophobicContact CE3-CD1 3.97Å; W796-L933 HydrophobicContact CE3-CD2 4.26Å; W796-L933 HydrophobicContact CZ3-CD1 4.34Å; D930-L933 HydrophobicContact CB-CD1 3.91Å; D930-L933 HydrophobicContact CB-CG 3.96Å; D930-L933 WeakPolarHBondContact O-CB 3.46Å; D930-L933 PolarHBondContact O-N 2.76Å; L933-M935 PolarHBondContact O-N 2.86Å; L933-I941 HydrophobicContact CB-CD1 4.11Å; L933-I941 HydrophobicContact CD1-CD1 4.09Å
934	D	87.5	Confident	90	Very high	90 Å²	90	59 Å²	59	48%	0.481	31%	0.308	S	S	.	.			trans	-71.4	118.9	173.3	-176.1	3.8	0	0	0	110.5	T936 F937	D934-T936 PolarHBondContact O-N 3.35Å; D934-T936 VanDerWaalsContact O-N 3.15Å; D934-T936 WeakPolarHBondContact OD1-CG2 3.48Å; D934-T936 PolarHBondContact OD1-N 3.14Å; D934-T936 PolarHBondContact OD1-OG1 3.43Å; D934-T936 PolarHBondContact OD2-OG1 3.36Å; D934-F937 HydrophobicContact CB-CD2 4.23Å; D934-F937 PolarHBondContact O-N 3.03Å; D934-F937 VanDerWaalsContact O-N 3.17Å
935	M	88	Confident	90.7	Very high	77 Å²	77	57.8 Å²	57.8	38%	0.379	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-70.7	-3.8	-179	-63.5	-64.7	156	0	0	113.4	L929 L933 F937 K938	L929-M935 HydrophobicContact CB-CE 4.28Å; L929-M935 HydrophobicContact CD1-SD 4.35Å; L933-M935 PolarHBondContact O-N 2.86Å; M935-F937 PolarHBondContact O-N 3.06Å; M935-K938 WeakPolarHBondContact O-CB 3.48Å; M935-K938 PolarHBondContact O-N 3.43Å
936	T	88.3	Confident	90.9	Very high	107 Å²	107	60.1 Å²	60.1	66%	0.656	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-60.2	-28.3	165.6	61.2	0	0	0	0	112.5	D934	D934-T936 PolarHBondContact O-N 3.35Å; D934-T936 VanDerWaalsContact O-N 3.15Å; D934-T936 WeakPolarHBondContact OD1-CG2 3.48Å; D934-T936 PolarHBondContact OD1-N 3.14Å; D934-T936 PolarHBondContact OD1-OG1 3.43Å; D934-T936 PolarHBondContact OD2-OG1 3.36Å
937	F	90.5	Very high	91.2	Very high	59 Å²	59	56.4 Å²	56.4	26%	0.259	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-93.1	10.9	177.2	-62.1	-79.5	0	0	0	114	W796 D934 M935 D939 E940 I941	W796-F937 HydrophobicContact CB-CB 4.29Å; W796-F937 HydrophobicContact CB-CD2 3.94Å; W796-F937 HydrophobicContact CB-CG 4.16Å; W796-F937 AromaticContact CD1-CD1 3.53Å; W796-F937 AromaticContact CD1-CD2 3.97Å; W796-F937 AromaticContact CD1-CG 3.32Å; W796-F937 HydrophobicContact CG-CB 3.78Å; W796-F937 HydrophobicContact CG-CD2 4.25Å; W796-F937 AromaticContact CG-CG 3.95Å; W796-F937 HydrophobicContact CG-CG 3.95Å; D934-F937 HydrophobicContact CB-CD2 4.23Å; D934-F937 PolarHBondContact O-N 3.03Å; D934-F937 VanDerWaalsContact O-N 3.17Å; M935-F937 PolarHBondContact O-N 3.06Å; F937-D939 VanDerWaalsContact C-N 3.27Å; F937-D939 PolarHBondContact O-N 2.8Å; F937-D939 VanDerWaalsContact O-N 3.11Å; F937-E940 WeakPolarHBondContact O-CA 3.27Å; F937-E940 WeakPolarHBondContact O-CB 3.08Å; F937-E940 PolarHBondContact O-N 3.12Å; F937-I941 HydrophobicContact CB-CD1 4.19Å; F937-I941 HydrophobicContact CB-CG1 4.31Å; F937-I941 WeakPolarHBondContact O-CG1 3.23Å; F937-I941 PolarHBondContact O-N 3.34Å
938	K	88.5	Confident	91.6	Very high	67 Å²	67	50.9 Å²	50.9	29%	0.291	26%	0.263	S	S	.	.	H	α-helix	trans	-50.1	-41.1	-173	173.7	173.5	169.6	166.2	0	114.5	E926 M935 E940 I941 N942	E926-K938 VanDerWaalsContact CD-CE 3.46Å; E926-K938 WeakPolarHBondContact OE1-CE 3.3Å; E926-K938 IonicContact OE1-NZ 3.17Å; E926-K938 PolarHBondContact OE1-NZ 2.88Å; E926-K938 VanDerWaalsContact OE2-CE 3.25Å; E926-K938 WeakPolarHBondContact OE2-CE 3.41Å; E926-K938 IonicContact OE2-NZ 2.73Å; E926-K938 PolarHBondContact OE2-NZ 2.77Å; M935-K938 WeakPolarHBondContact O-CB 3.48Å; M935-K938 PolarHBondContact O-N 3.43Å; K938-E940 PolarHBondContact O-N 3.35Å; K938-I941 PolarHBondContact O-N 2.97Å; K938-N942 WeakPolarHBondContact O-CB 3.21Å; K938-N942 PolarHBondContact O-N 3.08Å; K938-N942 PolarHBondContact O-ND2 3.38Å
939	D	87.6	Confident	91.6	Very high	114 Å²	114	52.9 Å²	52.9	61%	0.61	27%	0.273	S	S	*	.	H	α-helix	trans	-65.1	-38.8	177.9	-70.3	-24.3	0	0	0	112.2	F937 R943	F937-D939 VanDerWaalsContact C-N 3.27Å; F937-D939 PolarHBondContact O-N 2.8Å; F937-D939 VanDerWaalsContact O-N 3.11Å; D939-R943 WeakPolarHBondContact O-CD 3.31Å; D939-R943 WeakPolarHBondContact O-CG 3.16Å; D939-R943 PolarHBondContact O-N 2.99Å
940	E	92.6	Very high	91.4	Very high	27 Å²	27	56.3 Å²	56.3	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-66.4	-45.2	173.9	-63	-174.2	-158.8	0	0	111	W796 F937 K938 N942 R943 V944 V972 R973	W796-E940 HydrophobicContact CZ2-CB 4.1Å; W796-E940 PolarHBondContact NE1-OE2 3.15Å; F937-E940 WeakPolarHBondContact O-CA 3.27Å; F937-E940 WeakPolarHBondContact O-CB 3.08Å; F937-E940 PolarHBondContact O-N 3.12Å; K938-E940 PolarHBondContact O-N 3.35Å; E940-N942 VanDerWaalsContact C-N 3.34Å; E940-N942 PolarHBondContact O-N 3.29Å; E940-R943 PolarHBondContact O-N 3.03Å; E940-V944 WeakPolarHBondContact O-CG2 3.47Å; E940-V944 PolarHBondContact O-N 3.12Å; E940-V972 HydrophobicContact CB-CG1 3.68Å; E940-V972 HydrophobicContact CG-CG1 3.88Å; E940-R973 IonicContact OE2-NE 3.89Å; E940-R973 PolarHBondContact OE2-NE 2.63Å; E940-R973 IonicContact OE2-NH2 2.79Å
941	I	94.5	Very high	91.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59	-46.6	179.6	-62	167.6	0	0	0	110.4	W796 V897 L929 L933 F937 K938 R943 V944 L945	W796-I941 HydrophobicContact CD2-CD1 4.21Å; W796-I941 HydrophobicContact CD2-CG1 3.52Å; W796-I941 HydrophobicContact CE3-CD1 4.23Å; W796-I941 HydrophobicContact CE3-CG1 3.58Å; W796-I941 HydrophobicContact CG-CG1 4.21Å; W796-I941 HydrophobicContact CH2-CB 4.08Å; W796-I941 HydrophobicContact CH2-CG1 3.76Å; W796-I941 HydrophobicContact CH2-CG2 4.29Å; W796-I941 HydrophobicContact CZ2-CB 4.2Å; W796-I941 HydrophobicContact CZ2-CG1 3.71Å; W796-I941 HydrophobicContact CZ3-CB 4.31Å; W796-I941 HydrophobicContact CZ3-CG1 3.7Å; W796-I941 HydrophobicContact CZ3-CG2 4.25Å; V897-I941 HydrophobicContact CG1-CG2 3.77Å; V897-I941 HydrophobicContact CG2-CG2 4.44Å; L929-I941 HydrophobicContact CD1-CG2 4.2Å; L929-I941 HydrophobicContact CD2-CG2 3.61Å; L929-I941 HydrophobicContact CG-CG2 4.42Å; L933-I941 HydrophobicContact CB-CD1 4.11Å; L933-I941 HydrophobicContact CD1-CD1 4.09Å; F937-I941 HydrophobicContact CB-CD1 4.19Å; F937-I941 HydrophobicContact CB-CG1 4.31Å; F937-I941 WeakPolarHBondContact O-CG1 3.23Å; F937-I941 PolarHBondContact O-N 3.34Å; K938-I941 PolarHBondContact O-N 2.97Å; I941-R943 VanDerWaalsContact C-N 3.33Å; I941-R943 PolarHBondContact O-N 3.38Å; I941-V944 PolarHBondContact O-N 3.1Å; I941-L945 WeakPolarHBondContact O-CB 3.18Å; I941-L945 PolarHBondContact O-N 2.91Å
942	N	91.9	Very high	91.6	Very high	35 Å²	35	50.6 Å²	50.6	19%	0.187	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-36.8	178.6	-72.9	-18.9	0	0	0	112.6	V925 K938 E940 L945 N946	V925-N942 WeakPolarHBondContact CG1-OD1 3.25Å; K938-N942 WeakPolarHBondContact O-CB 3.21Å; K938-N942 PolarHBondContact O-N 3.08Å; K938-N942 PolarHBondContact O-ND2 3.38Å; E940-N942 VanDerWaalsContact C-N 3.34Å; E940-N942 PolarHBondContact O-N 3.29Å; N942-L945 WeakPolarHBondContact O-CB 3.1Å; N942-L945 PolarHBondContact O-N 3.31Å; N942-N946 VanDerWaalsContact O-CG 3.3Å; N942-N946 PolarHBondContact O-N 3.29Å; N942-N946 PolarHBondContact O-ND2 3.42Å
943	R	91.9	Very high	91.4	Very high	93 Å²	93	44.8 Å²	44.8	35%	0.351	23%	0.23	S	C	.	.	H	α-helix	trans	-67.7	-43.1	175.6	-71	164	176.8	-137.1	-12.7	111.6	D939 E940 I941 L945 N946 I947 V972 E975	D939-R943 WeakPolarHBondContact O-CD 3.31Å; D939-R943 WeakPolarHBondContact O-CG 3.16Å; D939-R943 PolarHBondContact O-N 2.99Å; E940-R943 PolarHBondContact O-N 3.03Å; I941-R943 VanDerWaalsContact C-N 3.33Å; I941-R943 PolarHBondContact O-N 3.38Å; R943-L945 VanDerWaalsContact C-N 3.32Å; R943-N946 PolarHBondContact O-N 3.23Å; R943-I947 WeakPolarHBondContact O-CG1 3.05Å; R943-I947 PolarHBondContact O-N 3.29Å; R943-V972 HydrophobicContact CB-CG1 4.12Å; R943-V972 HydrophobicContact CB-CG2 3.9Å; R943-V972 PolarHBondContact NH1-O 3.49Å; R943-E975 IonicContact CZ-OE2 3.66Å; R943-E975 IonicContact NH1-OE2 3.64Å; R943-E975 PolarHBondContact NH1-OE2 3.18Å; R943-E975 IonicContact NH2-OE2 2.91Å; R943-E975 PolarHBondContact NH2-OE2 3.11Å
944	V	96.2	Very high	90.8	Very high	3 Å²	3	48 Å²	48	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-64.6	-38.1	175	175.8	0	0	0	0	111.1	W796 Y800 L893 V897 E940 I941 N946 I947 A948 L969 V972	W796-V944 HydrophobicContact CH2-CB 3.82Å; W796-V944 HydrophobicContact CH2-CG1 4.12Å; W796-V944 HydrophobicContact CH2-CG2 3.83Å; W796-V944 HydrophobicContact CZ2-CB 4.23Å; W796-V944 HydrophobicContact CZ2-CG2 3.77Å; Y800-V944 HydrophobicContact CD2-CG2 4.16Å; Y800-V944 HydrophobicContact CE2-CG2 4.41Å; L893-V944 HydrophobicContact CD2-CG1 4.23Å; V897-V944 HydrophobicContact CG2-CB 4.34Å; V897-V944 HydrophobicContact CG2-CG1 3.9Å; E940-V944 WeakPolarHBondContact O-CG2 3.47Å; E940-V944 PolarHBondContact O-N 3.12Å; I941-V944 PolarHBondContact O-N 3.1Å; V944-N946 VanDerWaalsContact C-N 3.34Å; V944-N946 PolarHBondContact O-N 3.25Å; V944-I947 WeakPolarHBondContact O-CB 3.15Å; V944-I947 PolarHBondContact O-N 2.98Å; V944-A948 WeakPolarHBondContact O-CB 3.29Å; V944-A948 PolarHBondContact O-N 2.85Å; V944-L969 HydrophobicContact CG1-CD2 4.35Å; V944-L969 HydrophobicContact CG2-CD2 4.09Å; V944-V972 HydrophobicContact CG2-CG1 4.48Å; V944-V972 HydrophobicContact CG2-CG2 4.27Å
945	L	95.1	Very high	89.8	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-58.4	-44.3	172.6	179	59.9	0	0	0	111.8	L894 V897 V916 I920 V925 V928 L929 I941 N942 R943 I947 A948 L949	L894-L945 HydrophobicContact CD2-CD1 3.61Å; V897-L945 HydrophobicContact CG1-CB 4.2Å; V897-L945 HydrophobicContact CG1-CD1 4.19Å; V916-L945 HydrophobicContact CG1-CD1 4.08Å; I920-L945 HydrophobicContact CD1-CD2 4.09Å; V925-L945 HydrophobicContact CG1-CD2 3.51Å; V928-L945 HydrophobicContact CG2-CD2 3.85Å; L929-L945 HydrophobicContact CD2-CD2 4.23Å; I941-L945 WeakPolarHBondContact O-CB 3.18Å; I941-L945 PolarHBondContact O-N 2.91Å; N942-L945 WeakPolarHBondContact O-CB 3.1Å; N942-L945 PolarHBondContact O-N 3.31Å; R943-L945 VanDerWaalsContact C-N 3.32Å; L945-I947 VanDerWaalsContact C-N 3.35Å; L945-I947 PolarHBondContact O-N 3.5Å; L945-A948 VanDerWaalsContact O-CB 3.3Å; L945-A948 WeakPolarHBondContact O-CB 2.97Å; L945-A948 PolarHBondContact O-N 2.91Å; L945-A948 VanDerWaalsContact O-N 3.17Å; L945-L949 HydrophobicContact CD1-CD1 4.5Å; L945-L949 HydrophobicContact CD1-CG 4.44Å; L945-L949 HydrophobicContact CG-CD1 4.36Å; L945-L949 WeakPolarHBondContact O-CG 3.1Å; L945-L949 PolarHBondContact O-N 3.28Å
946	N	91.9	Very high	89	Confident	93 Å²	93	44.4 Å²	44.4	50%	0.497	24%	0.237	S	C	.	.	H	α-helix	trans	-63.8	-40	176.4	-69.2	-25.5	0	0	0	112.1	N942 R943 V944 A948 L949 L950	N942-N946 VanDerWaalsContact O-CG 3.3Å; N942-N946 PolarHBondContact O-N 3.29Å; N942-N946 PolarHBondContact O-ND2 3.42Å; R943-N946 PolarHBondContact O-N 3.23Å; V944-N946 VanDerWaalsContact C-N 3.34Å; V944-N946 PolarHBondContact O-N 3.25Å; N946-A948 VanDerWaalsContact C-N 3.31Å; N946-L949 PolarHBondContact O-N 3.31Å; N946-L950 WeakPolarHBondContact O-CG 3.16Å; N946-L950 PolarHBondContact O-N 3.13Å
947	I	94.3	Very high	88.2	Confident	11 Å²	11	44.1 Å²	44.1	6%	0.056	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-43.4	173	-64.7	165.4	0	0	0	110.1	L893 R943 V944 L945 L949 L950 C951 V965 M968 L969 V972	L893-I947 HydrophobicContact CD1-CG2 3.86Å; R943-I947 WeakPolarHBondContact O-CG1 3.05Å; R943-I947 PolarHBondContact O-N 3.29Å; V944-I947 WeakPolarHBondContact O-CB 3.15Å; V944-I947 PolarHBondContact O-N 2.98Å; L945-I947 VanDerWaalsContact C-N 3.35Å; L945-I947 PolarHBondContact O-N 3.5Å; I947-L949 PolarHBondContact O-N 3.14Å; I947-L950 PolarHBondContact O-N 3.05Å; I947-C951 WeakPolarHBondContact O-CB 3.25Å; I947-C951 PolarHBondContact O-N 2.66Å; I947-C951 PolarHBondContact O-SG 3.5Å; I947-V965 HydrophobicContact CG2-CG1 4.05Å; I947-M968 HydrophobicContact CD1-CB 3.69Å; I947-M968 HydrophobicContact CG1-CB 3.98Å; I947-M968 HydrophobicContact CG1-CE 4.41Å; I947-M968 HydrophobicContact CG2-CE 3.94Å; I947-L969 HydrophobicContact CD1-CD2 3.9Å; I947-L969 HydrophobicContact CD1-CG 4.26Å; I947-V972 HydrophobicContact CD1-CG2 3.97Å
948	A	97.1	Very high	87.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.4	-47.4	177.9	0	0	0	0	0	111.6	L893 L894 V944 L945 N946 C951 S952	L893-A948 HydrophobicContact CB-CB 3.46Å; L893-A948 VanDerWaalsContact CB-CB 3.46Å; L893-A948 HydrophobicContact CD1-CB 4.2Å; L894-A948 HydrophobicContact CD2-CB 3.57Å; L894-A948 HydrophobicContact CG-CB 3.89Å; V944-A948 WeakPolarHBondContact O-CB 3.29Å; V944-A948 PolarHBondContact O-N 2.85Å; L945-A948 VanDerWaalsContact O-CB 3.3Å; L945-A948 WeakPolarHBondContact O-CB 2.97Å; L945-A948 PolarHBondContact O-N 2.91Å; L945-A948 VanDerWaalsContact O-N 3.17Å; N946-A948 VanDerWaalsContact C-N 3.31Å; A948-C951 WeakPolarHBondContact O-CB 3.46Å; A948-C951 PolarHBondContact O-N 3.34Å; A948-S952 WeakPolarHBondContact O-CB 3.38Å; A948-S952 PolarHBondContact O-N 3.07Å; A948-S952 PolarHBondContact O-OG 2.93Å; A948-S952 VanDerWaalsContact O-OG 3.06Å
949	L	92.5	Very high	87.2	Confident	44 Å²	44	39.3 Å²	39.3	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-65.1	-37.9	178.3	-68	172.5	0	0	0	112.9	L894 V916 I920 L945 N946 I947 S952 S953	L894-L949 HydrophobicContact CD2-CD2 4.34Å; V916-L949 HydrophobicContact CG1-CD2 3.99Å; I920-L949 HydrophobicContact CD1-CD1 3.89Å; L945-L949 HydrophobicContact CD1-CD1 4.5Å; L945-L949 HydrophobicContact CD1-CG 4.44Å; L945-L949 HydrophobicContact CG-CD1 4.36Å; L945-L949 WeakPolarHBondContact O-CG 3.1Å; L945-L949 PolarHBondContact O-N 3.28Å; N946-L949 PolarHBondContact O-N 3.31Å; I947-L949 PolarHBondContact O-N 3.14Å; L949-S952 CarbonylContact O-C 3.24Å; L949-S952 PolarHBondContact O-N 3.39Å; L949-S953 PolarHBondContact O-N 3.2Å; L949-S953 VanDerWaalsContact O-N 3.12Å
950	L	89.5	Confident	87	Confident	86 Å²	86	34.4 Å²	34.4	45%	0.45	18%	0.184	S	C	.	.	H	α-helix	trans	-63.6	-45.2	172.8	-76	166.3	0	0	0	111.5	N946 I947 S953	N946-L950 WeakPolarHBondContact O-CG 3.16Å; N946-L950 PolarHBondContact O-N 3.13Å; I947-L950 PolarHBondContact O-N 3.05Å; L950-S953 WeakPolarHBondContact O-CB 3.47Å; L950-S953 PolarHBondContact O-N 3Å
951	C	93.8	Very high	86.6	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-40.8	176.1	-70.9	0	0	0	0	111.9	I886 Y887 I947 A948 S953 R959 V965	I886-C951 HydrophobicContact CG2-CB 3.98Å; I886-C951 WeakPolarHBondContact O-CB 3.04Å; Y887-C951 VanDerWaalsContact CA-O 3.3Å; Y887-C951 WeakPolarHBondContact CA-O 3.21Å; I947-C951 WeakPolarHBondContact O-CB 3.25Å; I947-C951 PolarHBondContact O-N 2.66Å; I947-C951 PolarHBondContact O-SG 3.5Å; A948-C951 WeakPolarHBondContact O-CB 3.46Å; A948-C951 PolarHBondContact O-N 3.34Å; C951-S953 VanDerWaalsContact C-N 3.29Å; C951-S953 PolarHBondContact O-N 3.24Å; C951-R959 WeakPolarHBondContact O-CD 3.5Å; C951-R959 VanDerWaalsContact O-CG 3.3Å; C951-R959 WeakPolarHBondContact O-CG 3.2Å; C951-V965 VanDerWaalsContact SG-CG2 3.5Å
952	S	93.5	Very high	86.6	Confident	4 Å²	4	35 Å²	35	3%	0.028	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	18.7	-179.9	72.3	0	0	0	0	114	Y887 A948 L949 S954	Y887-S952 WeakPolarHBondContact CE2-O 3.15Å; A948-S952 WeakPolarHBondContact O-CB 3.38Å; A948-S952 PolarHBondContact O-N 3.07Å; A948-S952 PolarHBondContact O-OG 2.93Å; A948-S952 VanDerWaalsContact O-OG 3.06Å; L949-S952 CarbonylContact O-C 3.24Å; L949-S952 PolarHBondContact O-N 3.39Å; S952-S954 PolarHBondContact O-N 2.79Å
953	S	83.4	Confident	86.4	Confident	21 Å²	21	38 Å²	38	15%	0.147	20%	0.203	C	C	.	.			trans	-56.8	138.1	173.7	166.2	0	0	0	0	110.6	L949 L950 C951 L955 N958 R959	L949-S953 PolarHBondContact O-N 3.2Å; L949-S953 VanDerWaalsContact O-N 3.12Å; L950-S953 WeakPolarHBondContact O-CB 3.47Å; L950-S953 PolarHBondContact O-N 3Å; C951-S953 VanDerWaalsContact C-N 3.29Å; C951-S953 PolarHBondContact O-N 3.24Å; S953-L955 PolarHBondContact O-N 3.42Å; S953-L955 PolarHBondContact OG-N 2.97Å; S953-L955 PolarHBondContact OG-O 3.19Å; S953-L955 VanDerWaalsContact OG-O 3.11Å; S953-N958 WeakPolarHBondContact OG-CB 3.32Å; S953-R959 PolarHBondContact O-NE 3.45Å; S953-R959 PolarHBondContact O-NH2 3.49Å
954	S	77.2	Confident	86.2	Confident	77 Å²	77	36.5 Å²	36.5	54%	0.538	20%	0.197	S	C	.	.	S	Bend	trans	-61.2	-32.5	176.3	54.8	0	0	0	0	112.5	S952 R959	S952-S954 PolarHBondContact O-N 2.79Å; S954-R959 PolarHBondContact O-NH2 3.21Å
955	L	67.8	Low	86.1	Confident	58 Å²	58	36.3 Å²	36.3	30%	0.304	20%	0.196	S	C	.	.	S	Bend	trans	-89.3	124.4	176.1	-64	175	0	0	0	111	Y271 S953 I957 N958	Y271-L955 HydrophobicContact CE2-CD1 4.16Å; S953-L955 PolarHBondContact O-N 3.42Å; S953-L955 PolarHBondContact OG-N 2.97Å; S953-L955 PolarHBondContact OG-O 3.19Å; S953-L955 VanDerWaalsContact OG-O 3.11Å; L955-I957 VanDerWaalsContact C-N 3.25Å; L955-I957 HydrophobicContact CB-CG2 4.27Å; L955-I957 PolarHBondContact O-N 3.42Å; L955-N958 PolarHBondContact O-N 3.34Å
956	P	70.8	Confident	86.1	Confident	33 Å²	33	37 Å²	37	21%	0.214	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-62.7	-29	179.9	-22.6	32.1	0	0	0	114.3	E873 K883 N958 R959	E873-P956 HydrophobicContact CB-CG 4Å; E873-P956 VanDerWaalsContact CD-CG 3.43Å; E873-P956 HydrophobicContact CG-CG 3.39Å; K883-P956 HydrophobicContact CB-CB 3.93Å; K883-P956 HydrophobicContact CG-CB 4.16Å; K883-P956 PolarHBondContact NZ-O 2.65Å; P956-N958 VanDerWaalsContact C-N 3.29Å; P956-N958 PolarHBondContact O-N 2.71Å; P956-R959 PolarHBondContact O-N 3.47Å
957	I	70.7	Confident	85.9	Confident	100 Å²	100	34.5 Å²	34.5	51%	0.513	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-65.9	-33.8	-177.3	-167.5	163.7	0	0	0	111.8	Y175 L955 R959	Y175-I957 PolarHBondContact OH-O 3.01Å; L955-I957 VanDerWaalsContact C-N 3.25Å; L955-I957 HydrophobicContact CB-CG2 4.27Å; L955-I957 PolarHBondContact O-N 3.42Å; I957-R959 VanDerWaalsContact C-N 3.28Å; I957-R959 PolarHBondContact O-N 2.89Å
958	N	72.3	Confident	85.8	Confident	25 Å²	25	35.1 Å²	35.1	13%	0.134	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-75.4	-16.6	178.4	-64.6	-10.5	0	0	0	113.2	S953 L955 P956	S953-N958 WeakPolarHBondContact OG-CB 3.32Å; L955-N958 PolarHBondContact O-N 3.34Å; P956-N958 VanDerWaalsContact C-N 3.29Å; P956-N958 PolarHBondContact O-N 2.71Å
959	R	85.9	Confident	85.7	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-76.2	125.3	-176.5	-60.7	-178.7	-165	144	10.9	110.1	E873 K883 I886 C951 S953 S954 P956 I957	E873-R959 IonicContact OE1-CZ 3.38Å; E873-R959 IonicContact OE1-NH1 3.42Å; E873-R959 PolarHBondContact OE1-NH1 3.34Å; E873-R959 IonicContact OE1-NH2 2.89Å; E873-R959 IonicContact OE2-CZ 2.66Å; E873-R959 IonicContact OE2-NH1 2.73Å; E873-R959 PolarHBondContact OE2-NH1 2.85Å; E873-R959 IonicContact OE2-NH2 3.98Å; E873-R959 PolarHBondContact OE2-NH2 3.15Å; K883-R959 HydrophobicContact CD-CB 4.32Å; K883-R959 PolarHBondContact NZ-O 3.39Å; K883-R959 WeakPolarHBondContact O-CD 3.22Å; K883-R959 PolarHBondContact O-NH1 3.49Å; I886-R959 HydrophobicContact CG2-CB 3.88Å; C951-R959 WeakPolarHBondContact O-CD 3.5Å; C951-R959 VanDerWaalsContact O-CG 3.3Å; C951-R959 WeakPolarHBondContact O-CG 3.2Å; S953-R959 PolarHBondContact O-NE 3.45Å; S953-R959 PolarHBondContact O-NH2 3.49Å; S954-R959 PolarHBondContact O-NH2 3.21Å; P956-R959 PolarHBondContact O-N 3.47Å; I957-R959 VanDerWaalsContact C-N 3.28Å; I957-R959 PolarHBondContact O-N 2.89Å
960	P	83.2	Confident	85.7	Confident	11 Å²	11	37.3 Å²	37.3	7%	0.071	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-68.2	149.9	177.5	25.6	-31.1	0	0	0	111.2	I886 R964 V965 M968	I886-P960 WeakPolarHBondContact CD1-O 3.18Å; I886-P960 WeakPolarHBondContact CG2-O 3.37Å; P960-R964 HydrophobicContact CB-CB 4.04Å; P960-R964 HydrophobicContact CB-CG 3.78Å; P960-V965 HydrophobicContact CB-CG2 4.24Å; P960-V965 HydrophobicContact CG-CG2 3.76Å; P960-M968 HydrophobicContact CB-CE 3.95Å; P960-M968 HydrophobicContact CG-CE 3.52Å
961	A	85.7	Confident	85.7	Confident	39 Å²	39	36.3 Å²	36.3	32%	0.322	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-59.3	146.8	170.6	0	0	0	0	0	111.1	R963 R964 V965	A961-R963 PolarHBondContact O-N 3.33Å; A961-R963 VanDerWaalsContact O-N 3.09Å; A961-R964 WeakPolarHBondContact O-CA 3.28Å; A961-R964 VanDerWaalsContact O-CB 3.24Å; A961-R964 WeakPolarHBondContact O-CB 3.37Å; A961-R964 PolarHBondContact O-N 3.4Å; A961-V965 PolarHBondContact O-N 3.4Å
962	M	93.4	Very high	85.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-54.5	-34.1	-179.6	-79.2	-52.9	-51.9	0	0	114.3	A807 L810 H814 H815 I886 F889 R964 V965 V966	A807-M962 HydrophobicContact CB-CE 3.7Å; L810-M962 HydrophobicContact CB-CE 3.99Å; L810-M962 HydrophobicContact CB-CG 4.07Å; L810-M962 HydrophobicContact CB-SD 4.43Å; L810-M962 HydrophobicContact CD1-CE 4.3Å; H814-M962 WeakPolarHBondContact ND1-CG 3.36Å; H815-M962 PolarHBondContact NE2-N 2.88Å; I886-M962 HydrophobicContact CB-SD 4.45Å; I886-M962 HydrophobicContact CD1-CG 4.44Å; I886-M962 HydrophobicContact CG1-CG 3.68Å; I886-M962 HydrophobicContact CG1-SD 3.76Å; F889-M962 HydrophobicContact CB-SD 4.42Å; F889-M962 HydrophobicContact CD1-CE 3.74Å; F889-M962 HydrophobicContact CD1-SD 3.95Å; F889-M962 HydrophobicContact CE1-CE 3.9Å; F889-M962 HydrophobicContact CG-CE 4.19Å; F889-M962 HydrophobicContact CG-SD 4.3Å; F889-M962 HydrophobicContact CZ-CE 4.46Å; M962-R964 VanDerWaalsContact C-N 3.28Å; M962-R964 PolarHBondContact O-N 3.27Å; M962-V965 HydrophobicContact CE-CB 3.99Å; M962-V965 HydrophobicContact CE-CG1 4Å; M962-V965 WeakPolarHBondContact O-CA 3.18Å; M962-V965 WeakPolarHBondContact O-CB 3.19Å; M962-V965 PolarHBondContact O-N 3.29Å; M962-V965 VanDerWaalsContact O-N 3.07Å; M962-V965 HydrophobicContact SD-CB 4.23Å; M962-V965 HydrophobicContact SD-CG1 4.48Å; M962-V965 HydrophobicContact SD-CG2 4.15Å; M962-V966 WeakPolarHBondContact O-CG2 3.09Å; M962-V966 PolarHBondContact O-N 3.49Å
963	R	88	Confident	84.9	Confident	100 Å²	100	40.3 Å²	40.3	38%	0.377	21%	0.205	S	C	.	.	H	α-helix	trans	-59.5	-38.6	172.8	-171.9	179.5	-71.1	163.6	-1.6	112.5	S811 H815 D816 A961 K967	S811-R963 WeakPolarHBondContact OG-CA 3.31Å; S811-R963 PolarHBondContact OG-N 2.92Å; H815-R963 VanDerWaalsContact CB-NH2 3.27Å; D816-R963 IonicContact OD1-CZ 2.63Å; D816-R963 IonicContact OD1-NH2 3.64Å; D816-R963 PolarHBondContact OD1-NH2 2.79Å; A961-R963 PolarHBondContact O-N 3.33Å; A961-R963 VanDerWaalsContact O-N 3.09Å; R963-K967 PolarHBondContact O-N 3.47Å
964	R	88.4	Confident	84.1	Confident	60 Å²	60	42 Å²	42	23%	0.226	22%	0.221	C	C	.	.	H	α-helix	trans	-68.4	-40.4	173	178.2	63.9	-177.2	-173.9	9.2	110.8	P960 A961 M962 K967 M968	P960-R964 HydrophobicContact CB-CB 4.04Å; P960-R964 HydrophobicContact CB-CG 3.78Å; A961-R964 WeakPolarHBondContact O-CA 3.28Å; A961-R964 VanDerWaalsContact O-CB 3.24Å; A961-R964 WeakPolarHBondContact O-CB 3.37Å; A961-R964 PolarHBondContact O-N 3.4Å; M962-R964 VanDerWaalsContact C-N 3.28Å; M962-R964 PolarHBondContact O-N 3.27Å; R964-K967 PolarHBondContact O-N 3.47Å; R964-M968 HydrophobicContact CG-CE 4.24Å; R964-M968 HydrophobicContact CG-CG 4.27Å; R964-M968 HydrophobicContact CG-SD 4.14Å; R964-M968 VanDerWaalsContact O-CG 3.27Å; R964-M968 WeakPolarHBondContact O-CG 3.31Å; R964-M968 PolarHBondContact O-N 2.78Å
965	V	93.5	Very high	83	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.9	-47.1	175.9	-179.7	0	0	0	0	111.8	F889 I947 C951 P960 A961 M962 K967 M968 L969	F889-V965 HydrophobicContact CD1-CG1 4.08Å; F889-V965 HydrophobicContact CE1-CG1 3.63Å; I947-V965 HydrophobicContact CG2-CG1 4.05Å; C951-V965 VanDerWaalsContact SG-CG2 3.5Å; P960-V965 HydrophobicContact CB-CG2 4.24Å; P960-V965 HydrophobicContact CG-CG2 3.76Å; A961-V965 PolarHBondContact O-N 3.4Å; M962-V965 HydrophobicContact CE-CB 3.99Å; M962-V965 HydrophobicContact CE-CG1 4Å; M962-V965 WeakPolarHBondContact O-CA 3.18Å; M962-V965 WeakPolarHBondContact O-CB 3.19Å; M962-V965 PolarHBondContact O-N 3.29Å; M962-V965 VanDerWaalsContact O-N 3.07Å; M962-V965 HydrophobicContact SD-CB 4.23Å; M962-V965 HydrophobicContact SD-CG1 4.48Å; M962-V965 HydrophobicContact SD-CG2 4.15Å; V965-K967 VanDerWaalsContact C-N 3.3Å; V965-K967 PolarHBondContact O-N 2.78Å; V965-M968 HydrophobicContact CB-CE 4.28Å; V965-M968 HydrophobicContact CG2-CE 3.97Å; V965-M968 PolarHBondContact O-N 3.48Å; V965-L969 HydrophobicContact CG1-CD1 4.17Å; V965-L969 WeakPolarHBondContact O-CG 3.28Å; V965-L969 PolarHBondContact O-N 3.48Å
966	V	95.8	Very high	82.2	Confident	15 Å²	15	43.7 Å²	43.7	9%	0.091	23%	0.23	C	C	.	.	H	α-helix	trans	-55.6	-47.2	174.8	171.8	0	0	0	0	110.9	L804 A807 E808 M962 L969 Q970	L804-V966 HydrophobicContact CD1-CG1 4.16Å; A807-V966 VanDerWaalsContact C-CG2 3.43Å; A807-V966 HydrophobicContact CB-CG2 3.68Å; A807-V966 WeakPolarHBondContact O-CG2 3.39Å; E808-V966 HydrophobicContact CG-CG1 3.91Å; E808-V966 HydrophobicContact CG-CG2 4.18Å; M962-V966 WeakPolarHBondContact O-CG2 3.09Å; M962-V966 PolarHBondContact O-N 3.49Å; V966-L969 PolarHBondContact O-N 2.82Å; V966-Q970 WeakPolarHBondContact O-CG 3.44Å; V966-Q970 PolarHBondContact O-N 3.35Å
967	K	88	Confident	80.9	Confident	41 Å²	41	47.5 Å²	47.5	18%	0.178	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-46.8	178.9	-175.9	171.4	179.4	171.3	0	112.7	N153 R963 R964 V965 L969 Q970 E971	N153-K967 PolarHBondContact OD1-NZ 3.46Å; R963-K967 PolarHBondContact O-N 3.47Å; R964-K967 PolarHBondContact O-N 3.47Å; V965-K967 VanDerWaalsContact C-N 3.3Å; V965-K967 PolarHBondContact O-N 2.78Å; K967-L969 VanDerWaalsContact C-N 3.28Å; K967-L969 PolarHBondContact O-N 2.82Å; K967-Q970 PolarHBondContact O-N 2.7Å; K967-E971 WeakPolarHBondContact CE-OE1 3.14Å; K967-E971 WeakPolarHBondContact CG-OE1 3.22Å; K967-E971 WeakPolarHBondContact O-CG 3.37Å; K967-E971 PolarHBondContact O-N 2.8Å
968	M	91.9	Very high	79.2	Confident	23 Å²	23	51.6 Å²	51.6	11%	0.113	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-41.1	176.7	-68.5	-176.5	-54.9	0	0	111.1	I947 P960 R964 V965 E971 V972	I947-M968 HydrophobicContact CD1-CB 3.69Å; I947-M968 HydrophobicContact CG1-CB 3.98Å; I947-M968 HydrophobicContact CG1-CE 4.41Å; I947-M968 HydrophobicContact CG2-CE 3.94Å; P960-M968 HydrophobicContact CB-CE 3.95Å; P960-M968 HydrophobicContact CG-CE 3.52Å; R964-M968 HydrophobicContact CG-CE 4.24Å; R964-M968 HydrophobicContact CG-CG 4.27Å; R964-M968 HydrophobicContact CG-SD 4.14Å; R964-M968 VanDerWaalsContact O-CG 3.27Å; R964-M968 WeakPolarHBondContact O-CG 3.31Å; R964-M968 PolarHBondContact O-N 2.78Å; V965-M968 HydrophobicContact CB-CE 4.28Å; V965-M968 HydrophobicContact CG2-CE 3.97Å; V965-M968 PolarHBondContact O-N 3.48Å; M968-E971 PolarHBondContact O-N 3.26Å; M968-V972 WeakPolarHBondContact O-CG2 3.2Å; M968-V972 PolarHBondContact O-N 3.5Å
969	L	94.8	Very high	77.4	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.5	-48	175.5	-73.2	171.2	0	0	0	111.1	Y800 L804 A807 F889 V944 I947 V965 V966 K967 E971 V972	Y800-L969 PolarHBondContact OH-O 3.35Å; L804-L969 HydrophobicContact CD1-CB 4.12Å; A807-L969 HydrophobicContact CB-CD1 3.75Å; F889-L969 HydrophobicContact CE1-CD1 4.44Å; F889-L969 HydrophobicContact CZ-CD1 4.42Å; V944-L969 HydrophobicContact CG1-CD2 4.35Å; V944-L969 HydrophobicContact CG2-CD2 4.09Å; I947-L969 HydrophobicContact CD1-CD2 3.9Å; I947-L969 HydrophobicContact CD1-CG 4.26Å; V965-L969 HydrophobicContact CG1-CD1 4.17Å; V965-L969 WeakPolarHBondContact O-CG 3.28Å; V965-L969 PolarHBondContact O-N 3.48Å; V966-L969 PolarHBondContact O-N 2.82Å; K967-L969 VanDerWaalsContact C-N 3.28Å; K967-L969 PolarHBondContact O-N 2.82Å; L969-E971 VanDerWaalsContact C-N 3.29Å; L969-E971 PolarHBondContact O-N 2.99Å; L969-V972 VanDerWaalsContact O-CB 3.27Å; L969-V972 WeakPolarHBondContact O-CB 3.45Å; L969-V972 WeakPolarHBondContact O-CG2 3.47Å; L969-V972 PolarHBondContact O-N 3.27Å; L969-V972 VanDerWaalsContact O-N 3.16Å
970	Q	92.2	Very high	74.9	Confident	91 Å²	91	67 Å²	67	43%	0.425	33%	0.333	S	S	.	.	H	α-helix	trans	-59.8	-37.3	177.7	-70.3	170.6	-12.4	0	0	112.7	L804 V966 K967 V972 R973 A974	L804-Q970 HydrophobicContact CD1-CG 3.77Å; L804-Q970 HydrophobicContact CD2-CG 4.31Å; V966-Q970 WeakPolarHBondContact O-CG 3.44Å; V966-Q970 PolarHBondContact O-N 3.35Å; K967-Q970 PolarHBondContact O-N 2.7Å; Q970-V972 VanDerWaalsContact C-N 3.27Å; Q970-V972 PolarHBondContact O-N 3.34Å; Q970-R973 PolarHBondContact O-N 3.01Å; Q970-A974 PolarHBondContact O-N 3.41Å
971	E	89.6	Confident	72.6	Confident	65 Å²	65	74.1 Å²	74.1	30%	0.304	37%	0.37	S	S	.	.	H	α-helix	trans	-65.6	-26.2	178.2	-74.9	169.6	178.7	0	0	113.1	K967 M968 L969 R973 A974 E975	K967-E971 WeakPolarHBondContact CE-OE1 3.14Å; K967-E971 WeakPolarHBondContact CG-OE1 3.22Å; K967-E971 WeakPolarHBondContact O-CG 3.37Å; K967-E971 PolarHBondContact O-N 2.8Å; M968-E971 PolarHBondContact O-N 3.26Å; L969-E971 VanDerWaalsContact C-N 3.29Å; L969-E971 PolarHBondContact O-N 2.99Å; E971-R973 VanDerWaalsContact C-N 3.26Å; E971-R973 PolarHBondContact O-N 2.93Å; E971-A974 PolarHBondContact O-N 2.77Å; E971-E975 PolarHBondContact O-N 3.44Å
972	V	88.4	Confident	69.8	Low	5 Å²	5	80.6 Å²	80.6	3%	0.03	39%	0.394	C	S	.	.	H	α-helix	trans	-53.3	-43.8	176.9	177.8	0	0	0	0	111.5	Y800 E940 R943 V944 I947 M968 L969 Q970	Y800-V972 HydrophobicContact CE2-CB 4.04Å; Y800-V972 HydrophobicContact CE2-CG1 4.23Å; E940-V972 HydrophobicContact CB-CG1 3.68Å; E940-V972 HydrophobicContact CG-CG1 3.88Å; R943-V972 HydrophobicContact CB-CG1 4.12Å; R943-V972 HydrophobicContact CB-CG2 3.9Å; R943-V972 PolarHBondContact NH1-O 3.49Å; V944-V972 HydrophobicContact CG2-CG1 4.48Å; V944-V972 HydrophobicContact CG2-CG2 4.27Å; I947-V972 HydrophobicContact CD1-CG2 3.97Å; M968-V972 WeakPolarHBondContact O-CG2 3.2Å; M968-V972 PolarHBondContact O-N 3.5Å; L969-V972 VanDerWaalsContact O-CB 3.27Å; L969-V972 WeakPolarHBondContact O-CB 3.45Å; L969-V972 WeakPolarHBondContact O-CG2 3.47Å; L969-V972 PolarHBondContact O-N 3.27Å; L969-V972 VanDerWaalsContact O-N 3.16Å; Q970-V972 VanDerWaalsContact C-N 3.27Å; Q970-V972 PolarHBondContact O-N 3.34Å
973	R	81.2	Confident	67	Low	82 Å²	82	90 Å²	90	31%	0.309	43%	0.434	S	S	.	.	H	α-helix	trans	-89.5	-31	-179.6	-74	-172.6	171.1	-173.2	-6.6	113.9	S797 Y800 E940 Q970 E971 E975 A976 T977	S797-R973 PolarHBondContact OG-NH2 3.36Å; Y800-R973 VanDerWaalsContact CD1-CZ 3.44Å; Y800-R973 VanDerWaalsContact CE1-CD 3.43Å; Y800-R973 HydrophobicContact CE1-CG 4.02Å; Y800-R973 HydrophobicContact CE2-CG 4.38Å; E940-R973 IonicContact OE2-NE 3.89Å; E940-R973 PolarHBondContact OE2-NE 2.63Å; E940-R973 IonicContact OE2-NH2 2.79Å; Q970-R973 PolarHBondContact O-N 3.01Å; E971-R973 VanDerWaalsContact C-N 3.26Å; E971-R973 PolarHBondContact O-N 2.93Å; R973-E975 PolarHBondContact O-N 2.95Å; R973-A976 PolarHBondContact O-N 3.46Å; R973-A976 VanDerWaalsContact O-N 3.14Å; R973-T977 PolarHBondContact O-N 2.81Å; R973-T977 PolarHBondContact O-OG1 2.76Å; R973-T977 VanDerWaalsContact O-OG1 3.08Å
974	A	66.3	Low	64.3	Low	58 Å²	58	92.9 Å²	92.9	48%	0.479	46%	0.457	S	S	.	.	H	α-helix	trans	-59.1	-36.3	-178.6	0	0	0	0	0	112.6	Q970 E971 T977	Q970-A974 PolarHBondContact O-N 3.41Å; E971-A974 PolarHBondContact O-N 2.77Å; A974-T977 PolarHBondContact O-OG1 2.74Å
975	E	54.2	Low	61.7	Low	100 Å²	100	92.7 Å²	92.7	47%	0.467	47%	0.474	S	S	.	.	H	α-helix	trans	-76.7	-30.6	177	-71.5	-173.5	162.4	0	0	114	R943 E971 R973 T977 R978	R943-E975 IonicContact CZ-OE2 3.66Å; R943-E975 IonicContact NH1-OE2 3.64Å; R943-E975 PolarHBondContact NH1-OE2 3.18Å; R943-E975 IonicContact NH2-OE2 2.91Å; R943-E975 PolarHBondContact NH2-OE2 3.11Å; E971-E975 PolarHBondContact O-N 3.44Å; R973-E975 PolarHBondContact O-N 2.95Å; E975-T977 PolarHBondContact O-N 2.86Å; E975-R978 PolarHBondContact O-N 3.45Å; E975-R978 VanDerWaalsContact O-N 3.15Å
976	A	52.3	Low	58.7	Low	70 Å²	70	102.6 Å²	102.6	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-63.9	-29.8	174.9	0	0	0	0	0	111.8	R973	R973-A976 PolarHBondContact O-N 3.46Å; R973-A976 VanDerWaalsContact O-N 3.14Å
977	T	43.7	Very low	55.6	Low	112 Å²	112	110 Å²	110	69%	0.687	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-4.6	174.8	26.4	0	0	0	0	115.6	R973 A974 E975 P979	R973-T977 PolarHBondContact O-N 2.81Å; R973-T977 PolarHBondContact O-OG1 2.76Å; R973-T977 VanDerWaalsContact O-OG1 3.08Å; A974-T977 PolarHBondContact O-OG1 2.74Å; E975-T977 PolarHBondContact O-N 2.86Å; T977-P979 VanDerWaalsContact O-CD 3.27Å; T977-P979 WeakPolarHBondContact O-CD 3.16Å
978	R	34.3	Very low	52.7	Low	187 Å²	187	112.6 Å²	112.6	71%	0.706	58%	0.578	S	S	*	*	S	Bend	trans	-68.8	118.7	168.9	-77.3	-173.9	177.5	177.8	1.9	107.3	E975 R980	E975-R978 PolarHBondContact O-N 3.45Å; E975-R978 VanDerWaalsContact O-N 3.15Å; R978-R980 PolarHBondContact O-N 2.72Å
979	P	34.5	Very low	49.9	Very low	117 Å²	117	116 Å²	116	76%	0.76	60%	0.602	S	S	*	*			trans	-56.1	123.9	171.8	3.9	-0.6	0	0	0	106.9	T977 L981	T977-P979 VanDerWaalsContact O-CD 3.27Å; T977-P979 WeakPolarHBondContact O-CD 3.16Å; P979-L981 VanDerWaalsContact C-N 3.29Å; P979-L981 PolarHBondContact O-N 3.33Å
980	R	34.5	Very low	47	Very low	230 Å²	230	126.1 Å²	126.1	87%	0.868	64%	0.642	S	S	*	*			trans	-53	106	163	-78.7	-179.7	169.5	163.4	-0.9	104.8	R978 E982	R978-R980 PolarHBondContact O-N 2.72Å; R980-E982 VanDerWaalsContact C-N 3.32Å; R980-E982 PolarHBondContact O-N 2.78Å
981	L	33.2	Very low	44	Very low	161 Å²	161	131.6 Å²	131.6	84%	0.843	66%	0.66	S	S	*	*			trans	-53.3	108.6	165.9	-84.7	160.1	0	0	0	104.7	P979 K983	P979-L981 VanDerWaalsContact C-N 3.29Å; P979-L981 PolarHBondContact O-N 3.33Å; L981-K983 PolarHBondContact O-N 2.73Å
982	E	28.5	Very low	41.3	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.822	68%	0.683	S	S	*	*			trans	-56.3	97.5	167.3	-74.9	-174.3	155.2	0	0	105.9	R980 D984	R980-E982 VanDerWaalsContact C-N 3.32Å; R980-E982 PolarHBondContact O-N 2.78Å; E982-D984 PolarHBondContact O-N 2.74Å
983	K	33.9	Very low	38.4	Very low	197 Å²	197	145 Å²	145	86%	0.857	72%	0.716	S	S	*	*			trans	-76.8	68.9	166.3	-88.8	-171.6	173	-179	0	107.5	L981 G985	L981-K983 PolarHBondContact O-N 2.73Å; K983-G985 VanDerWaalsContact C-N 3.25Å; K983-G985 PolarHBondContact O-N 2.72Å; K983-G985 VanDerWaalsContact O-N 3.15Å
984	D	31.8	Very low	36.1	Very low	160 Å²	160	148.2 Å²	148.2	86%	0.856	74%	0.739	S	S	*	*			trans	-68.8	95.2	145.7	-93.5	-15.2	0	0	0	106.5	E982	E982-D984 PolarHBondContact O-N 2.74Å
985	G	34.3	Very low	34.2	Very low	56 Å²	56	151.4 Å²	151.4	58%	0.577	75%	0.752	S	S	*	*			trans	177.9	81.9	-175.6	0	0	0	0	0	112.2	K983 L987	K983-G985 VanDerWaalsContact C-N 3.25Å; K983-G985 PolarHBondContact O-N 2.72Å; K983-G985 VanDerWaalsContact O-N 3.15Å; G985-L987 PolarHBondContact O-N 2.72Å; G985-L987 VanDerWaalsContact O-N 3.09Å
986	K	29.5	Very low	33.2	Very low	209 Å²	209	151.4 Å²	151.4	91%	0.909	76%	0.763	S	S	*	*			trans	-36	111.2	164	-70.7	175.1	173.9	176.9	0	111.6
987	L	30.5	Very low	32.3	Very low	169 Å²	169	154.2 Å²	154.2	89%	0.885	77%	0.769	S	S	*	*			trans	-141.1	86.9	155.9	-80.2	172.1	0	0	0	108.7	G985	G985-L987 PolarHBondContact O-N 2.72Å; G985-L987 VanDerWaalsContact O-N 3.09Å
988	S	27.3	Very low	31.7	Very low	96 Å²	96	157.3 Å²	157.3	67%	0.671	78%	0.776	S	S	*	*			trans	-75.1	142.2	143	-177.3	0	0	0	0	106.5
989	P	32.1	Very low	31.6	Very low	95 Å²	95	151.9 Å²	151.9	62%	0.617	78%	0.778	S	S	*	*				-158.7	105.7	86.9	36.4	-13.2	0	0	0	114.9
990	Y	34.6	Very low	31.6	Very low	213 Å²	213	152 Å²	152	84%	0.835	78%	0.782	S	S	*	*			trans	-152	69.4	152.5	-76.3	-69.7	0	0	0	109.6
991	Y	29.8	Very low	31.2	Very low	206 Å²	206	146.5 Å²	146.5	81%	0.808	78%	0.778	S	S	*	*			trans	-98.8	109.5	155.9	-111.5	-97.9	0	0	0	106.1	E993	Y991-E993 HydrophobicContact CD1-CG 4.3Å
992	Y	31.9	Very low	31.8	Very low	201 Å²	201	149 Å²	149	79%	0.788	80%	0.8	S	S	*	*			trans	-101.2	99.4	158.9	-98.1	-89.3	0	0	0	106.2
993	E	28.5	Very low	31.9	Very low	151 Å²	151	147.7 Å²	147.7	71%	0.706	80%	0.799	S	S	*	*			trans	-80.2	109.9	156.4	-78.5	-178.3	154.6	0	0	107	Y991	Y991-E993 HydrophobicContact CD1-CG 4.3Å
994	D	32	Very low	31.8	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	80%	0.796	S	S	*	*			trans	-103.2	100.1	154.9	-88.1	-30.3	0	0	0	107.5
995	T	26.6	Very low	31.8	Very low	124 Å²	124	144.3 Å²	144.3	76%	0.761	79%	0.792	S	S	*	*			trans	-92.2	107.8	164.1	47.1	0	0	0	0	109.4
996	S	34.1	Very low	31.7	Very low	100 Å²	100	149.5 Å²	149.5	70%	0.699	81%	0.805	S	S	*	*			trans	-179.8	135.4	155.3	56.9	0	0	0	0	106.1
997	D	32.4	Very low	31.8	Very low	130 Å²	130	145.8 Å²	145.8	70%	0.695	80%	0.798	S	S	*	*			cis	-167.2	147.3	11.2	-117.9	-36.3	0	0	0	106.2
998	Q	32.3	Very low	31.9	Very low	177 Å²	177	144.2 Å²	144.2	83%	0.827	79%	0.793	S	S	*	*			trans	43.3	113.8	141.5	-59.7	179.9	30.1	0	0	120.4
999	G	31.3	Very low	32.2	Very low	73 Å²	73	147.6 Å²	147.6	75%	0.753	80%	0.801	S	S	*	*				124.2	139.9	109.6	0	0	0	0	0	109
1000	S	35.1	Very low	32.2	Very low	120 Å²	120	151.7 Å²	151.7	84%	0.839	82%	0.815	S	S	*	*			cis	-154.9	150.6	27	-58.6	0	0	0	0	110.1
1001	S	25.6	Very low	32	Very low	113 Å²	113	146.6 Å²	146.6	79%	0.79	81%	0.814	S	S	*	*			trans	-52.2	131.7	161.7	49.6	0	0	0	0	113.6
1002	V	45	Very low	32.2	Very low	215 Å²	215	141.2 Å²	141.2	100%	1.303	81%	0.814	S	S	*	*				-156.8	0	96	168.2	0	0	0	0	107.5

Retrieved 1,002 of 1,002 residues in 4873.5 ms (Link to these results)

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