A0A087XYL6_POEFO Loading...

Calcium-transporting ATPase

Catalyzes the hydrolysis of ATP coupled with the transport of calcium.

AlphaFold DB , UniProt , Accession A0A087XYL6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,004 aa.

						>A0A087XYL6_POEFO|A0A087XYL6
MENAHTKSASEVLDNFGVNEITGLTLEQVHASLQKYGPNELPAEEGKSLWELVVEQFEDLLVRILLLAACVSFVLALFEEGEETTTAFVEPLVILLILIANAVIGVWQERNAESAIEALKEYEPEMGKVYRMDRKAVQRIKARDIVPGDIVEVAVGDKVPADIRVTSIKSTTLRVDQSILTGESVSVIKHSDPVPDPRAVNQDKKNMLFSGTNIAAGRAIGVVVATGVNTEIGKIRNQMAATEQEKTPLQQKLDEFGQQLSKVISLICVAVWVINIGHFGDPVHGGSWVRGAIYYFKIAVALAVAAIPEGLPAVITTCLALGTRRMAKKNAIVRSLPSVETLGCTSVICSDKTGTLTTNQMSVCRMFVADKVEDSSCTLHEFSITGSTYAPEGQILKGNRPVQCGDYDGLLELATVCSMCNDSSLDYNESKGVYEKVGEATETALTTLVEKMNVFKTDLSGLTKVERAGACNSVIRQLMKKEFTLEFSRDRKSMSVYCTPVKAGAQSKMFIKGAPESVMERCNYLRVGTTKVAMTPALREQLMVKIREWGTGKDTLRCLALATHDTPPRKEDMDLENSSKFAEYEMGLTFVGCVGMLDPPRKEVIGSVKLCNEAGIRVIMITGDNKGTAVAICRRIGIFGEEEDVKGKAYTGREFDDLTTEEQREAVKRARCFARVEPAHKSKIVGYLQSFDEITAMTGDGVNDAPALKKAEIGIAMGSGTAVAKSASEMVLSDDNFSTIVAAVEEGRAIYNNMKQFIRYLISSNVGEVVCIFLTAILGLPEALIPVQLLWVNLVTDGLPATALGFNPPDLDIMDKPPRNPKEPLISGWLFFRYLAIGGYVGLGTVSAATWWYLFDEEGPQVSFYQLRHFMQCTEDNPMFKDIDCEVFESRYPTTMALSVLVTIEMFNSLNSLSENQSLLRMPPWVNIWLLGAIILSLSLHFLILYVEPLPLIFQVTPLCWSQWVVVLKISIPVILLDEALKYISRNHLEDDEEKKYRRRWQQN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	76.3	Confident	88.1	Confident	63 Å²	63	59.2 Å²	59.2	31%	0.31	32%	0.315	S	S	.	.				0	102.6	0	177.6	-177	-178.1	0	0	107.8	A4 K7 V12 N15 F16 V224	M1-A4 HydrophobicContact CG-CB 4.33Å; M1-A4 HydrophobicContact SD-CB 4.31Å; M1-K7 HydrophobicContact CE-CB 3.97Å; M1-K7 HydrophobicContact CE-CG 3.53Å; M1-V12 HydrophobicContact CE-CG2 3.96Å; M1-V12 HydrophobicContact SD-CB 4.35Å; M1-V12 HydrophobicContact SD-CG1 4.01Å; M1-V12 HydrophobicContact SD-CG2 4.03Å; M1-N15 HydrophobicContact SD-CB 4.27Å; M1-N15 PolarHBondContact SD-ND2 2.91Å; M1-F16 HydrophobicContact CB-CE2 4.24Å; M1-F16 HydrophobicContact CB-CZ 4.07Å; M1-F16 HydrophobicContact SD-CE2 4.37Å; M1-V224 PolarHBondContact N-O 3.34Å
2	E	72.1	Confident	88.5	Confident	182 Å²	182	54.3 Å²	54.3	85%	0.85	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-39.5	-163.8	-69.3	-176.7	159.7	0	0	114.8	A4	E2-A4 PolarHBondContact O-N 2.94Å
3	N	87.6	Confident	88.9	Confident	79 Å²	79	51.7 Å²	51.7	42%	0.422	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	37	-177.9	-69.3	-32.8	0	0	0	113.5	H5 T6	N3-H5 PolarHBondContact O-N 2.98Å; N3-H5 VanDerWaalsContact O-N 3.15Å; N3-T6 HydrophobicContact CB-CG2 4.36Å; N3-T6 PolarHBondContact O-N 3.02Å; N3-T6 PolarHBondContact O-OG1 3.18Å
4	A	90.7	Very high	89.2	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.008	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-60.2	-25.7	-176.8	0	0	0	0	0	113.6	M1 E2 T6 K7 V12 R164 M207 V224	M1-A4 HydrophobicContact CG-CB 4.33Å; M1-A4 HydrophobicContact SD-CB 4.31Å; E2-A4 PolarHBondContact O-N 2.94Å; A4-T6 VanDerWaalsContact C-N 3.26Å; A4-T6 PolarHBondContact O-N 3.4Å; A4-K7 PolarHBondContact O-N 3.43Å; A4-V12 HydrophobicContact CB-CG2 4.39Å; A4-R164 WeakPolarHBondContact O-CD 3.28Å; A4-R164 PolarHBondContact O-NE 3.22Å; A4-R164 VanDerWaalsContact O-NE 3.17Å; A4-M207 HydrophobicContact CB-SD 4.5Å; A4-V224 HydrophobicContact CB-CB 4.03Å; A4-V224 HydrophobicContact CB-CG1 3.59Å; A4-V224 HydrophobicContact CB-CG2 4.24Å
5	H	90.8	Very high	89.4	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.019	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-65.3	-27.6	175.6	66.6	-75.6	0	0	0	113	N3 K7 V194 D196 K204 N206 M207	N3-H5 PolarHBondContact O-N 2.98Å; N3-H5 VanDerWaalsContact O-N 3.15Å; H5-K7 VanDerWaalsContact C-N 3.29Å; H5-V194 PolarHBondContact O-N 3.43Å; H5-D196 PolarHBondContact CD2-O 2.95Å; H5-D196 PolarHBondContact NE2-O 3.32Å; H5-K204 HydrophobicContact CB-CB 4.48Å; H5-K204 HydrophobicContact CB-CG 4.06Å; H5-N206 WeakPolarHBondContact CA-OD1 3.47Å; H5-N206 WeakPolarHBondContact CB-OD1 3.4Å; H5-N206 PolarHBondContact O-ND2 3.34Å; H5-M207 HydrophobicContact CB-CG 3.78Å; H5-M207 HydrophobicContact CB-SD 4.07Å
6	T	91.9	Very high	89.6	Confident	34 Å²	34	58.1 Å²	58.1	21%	0.209	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-79.6	-12.7	178	66	0	0	0	0	114.1	N3 A4 P193 V194 P197	N3-T6 HydrophobicContact CB-CG2 4.36Å; N3-T6 PolarHBondContact O-N 3.02Å; N3-T6 PolarHBondContact O-OG1 3.18Å; A4-T6 VanDerWaalsContact C-N 3.26Å; A4-T6 PolarHBondContact O-N 3.4Å; T6-P193 WeakPolarHBondContact O-CB 3.5Å; T6-V194 VanDerWaalsContact CA-O 3.27Å; T6-V194 WeakPolarHBondContact CA-O 3.5Å; T6-P197 HydrophobicContact CG2-CB 4.16Å
7	K	92.3	Very high	89.8	Confident	78 Å²	78	57.8 Å²	57.8	34%	0.339	32%	0.321	S	S	.	.	S	Bend	trans	-101.8	149.9	-171.2	-63.8	-64.3	-170.4	174.1	0	111.3	M1 A4 H5 E11 V12 R164	M1-K7 HydrophobicContact CE-CB 3.97Å; M1-K7 HydrophobicContact CE-CG 3.53Å; A4-K7 PolarHBondContact O-N 3.43Å; H5-K7 VanDerWaalsContact C-N 3.29Å; K7-E11 WeakPolarHBondContact CA-OE2 3.47Å; K7-E11 HydrophobicContact CB-CB 4.19Å; K7-E11 VanDerWaalsContact CD-OE2 3.24Å; K7-E11 WeakPolarHBondContact CD-OE2 3.19Å; K7-E11 IonicContact NZ-OE1 2.88Å; K7-V12 HydrophobicContact CB-CG2 3.71Å; K7-R164 PolarHBondContact O-NE 2.91Å; K7-R164 PolarHBondContact O-NH2 3.36Å
8	S	92	Very high	89.9	Confident	33 Å²	33	55.2 Å²	55.2	23%	0.231	31%	0.307	C	S	.	.			trans	-68.3	160	173	77.9	0	0	0	0	110.3	S10 E11 V12	S8-S10 PolarHBondContact O-N 3.4Å; S8-S10 PolarHBondContact OG-OG 3.43Å; S8-E11 PolarHBondContact N-OE2 2.97Å; S8-E11 PolarHBondContact O-N 3Å; S8-E11 WeakPolarHBondContact OG-CG 3.35Å; S8-E11 PolarHBondContact OG-N 3.45Å; S8-V12 WeakPolarHBondContact O-CG2 3.34Å; S8-V12 PolarHBondContact O-N 3.06Å
9	A	90.7	Very high	90.1	Very high	24 Å²	24	56.8 Å²	56.8	20%	0.198	32%	0.315	C	S	.	.	H	α-helix	trans	-57.8	-38.6	177.7	0	0	0	0	0	112	V12 L13 T166	A9-V12 PolarHBondContact O-N 3.23Å; A9-L13 VanDerWaalsContact O-CG 3.28Å; A9-L13 WeakPolarHBondContact O-CG 3.39Å; A9-L13 PolarHBondContact O-N 2.84Å; A9-T166 HydrophobicContact CB-CG2 4.16Å
10	S	91.4	Very high	90.1	Very high	70 Å²	70	56.7 Å²	56.7	49%	0.49	31%	0.312	S	S	.	.	H	α-helix	trans	-65.4	-44.9	178.5	60.3	0	0	0	0	112.3	S8 V12 L13 D14	S8-S10 PolarHBondContact O-N 3.4Å; S8-S10 PolarHBondContact OG-OG 3.43Å; S10-V12 VanDerWaalsContact C-N 3.26Å; S10-V12 PolarHBondContact O-N 3.27Å; S10-L13 PolarHBondContact O-N 2.99Å; S10-D14 WeakPolarHBondContact O-CB 3.05Å; S10-D14 PolarHBondContact O-N 3.29Å
11	E	93.3	Very high	90	Very high	83 Å²	83	60.8 Å²	60.8	39%	0.388	33%	0.332	S	S	.	.	H	α-helix	trans	-60.5	-36.6	178.4	-72.1	176.9	124.8	0	0	112.2	K7 S8 N15	K7-E11 WeakPolarHBondContact CA-OE2 3.47Å; K7-E11 HydrophobicContact CB-CB 4.19Å; K7-E11 VanDerWaalsContact CD-OE2 3.24Å; K7-E11 WeakPolarHBondContact CD-OE2 3.19Å; K7-E11 IonicContact NZ-OE1 2.88Å; S8-E11 PolarHBondContact N-OE2 2.97Å; S8-E11 PolarHBondContact O-N 3Å; S8-E11 WeakPolarHBondContact OG-CG 3.35Å; S8-E11 PolarHBondContact OG-N 3.45Å; E11-N15 WeakPolarHBondContact O-CB 3.4Å; E11-N15 PolarHBondContact O-N 3.32Å; E11-N15 VanDerWaalsContact O-N 3.09Å
12	V	93.3	Very high	90.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-72.6	-42.6	178.6	-177.7	0	0	0	0	110.8	M1 A4 K7 S8 A9 S10 N15 F16 R164 V222 V224	M1-V12 HydrophobicContact CE-CG2 3.96Å; M1-V12 HydrophobicContact SD-CB 4.35Å; M1-V12 HydrophobicContact SD-CG1 4.01Å; M1-V12 HydrophobicContact SD-CG2 4.03Å; A4-V12 HydrophobicContact CB-CG2 4.39Å; K7-V12 HydrophobicContact CB-CG2 3.71Å; S8-V12 WeakPolarHBondContact O-CG2 3.34Å; S8-V12 PolarHBondContact O-N 3.06Å; A9-V12 PolarHBondContact O-N 3.23Å; S10-V12 VanDerWaalsContact C-N 3.26Å; S10-V12 PolarHBondContact O-N 3.27Å; V12-N15 PolarHBondContact O-N 2.88Å; V12-F16 HydrophobicContact CG1-CD2 4.12Å; V12-F16 HydrophobicContact CG1-CE2 4.05Å; V12-F16 VanDerWaalsContact O-CD2 3.29Å; V12-F16 WeakPolarHBondContact O-CD2 3.45Å; V12-F16 PolarHBondContact O-N 3.25Å; V12-R164 HydrophobicContact CG1-CB 4.44Å; V12-R164 HydrophobicContact CG1-CG 4.47Å; V12-R164 HydrophobicContact CG2-CG 4.21Å; V12-V222 HydrophobicContact CB-CG1 4.31Å; V12-V222 HydrophobicContact CG1-CG1 3.49Å; V12-V222 VanDerWaalsContact CG1-CG1 3.49Å; V12-V224 HydrophobicContact CG1-CG1 4.05Å
13	L	93.3	Very high	91.6	Very high	21 Å²	21	52.1 Å²	52.1	11%	0.11	30%	0.295	C	S	.	.	H	α-helix	trans	-61.9	-43.4	175.5	-70.4	169.6	0	0	0	111.7	A9 S10 N15 F16 G17 V18 E20 I150 T166 V222	A9-L13 VanDerWaalsContact O-CG 3.28Å; A9-L13 WeakPolarHBondContact O-CG 3.39Å; A9-L13 PolarHBondContact O-N 2.84Å; S10-L13 PolarHBondContact O-N 2.99Å; L13-N15 PolarHBondContact O-N 2.93Å; L13-F16 PolarHBondContact O-N 3.48Å; L13-G17 PolarHBondContact O-N 2.8Å; L13-V18 HydrophobicContact CD2-CG1 3.73Å; L13-V18 PolarHBondContact O-N 3.39Å; L13-V18 VanDerWaalsContact O-N 3.08Å; L13-E20 HydrophobicContact CD1-CB 4.1Å; L13-E20 HydrophobicContact CD2-CB 4.44Å; L13-I150 HydrophobicContact CD2-CD1 3.66Å; L13-T166 HydrophobicContact CD1-CG2 4.48Å; L13-T166 HydrophobicContact CD2-CG2 4.44Å; L13-T166 HydrophobicContact CG-CG2 4.47Å; L13-V222 HydrophobicContact CD2-CB 4.3Å
14	D	92.9	Very high	91.9	Very high	127 Å²	127	48.5 Å²	48.5	68%	0.679	28%	0.276	S	S	*	.	H	α-helix	trans	-64	-40	178	-70.5	-22.7	0	0	0	111.7	S10 F16 G17	S10-D14 WeakPolarHBondContact O-CB 3.05Å; S10-D14 PolarHBondContact O-N 3.29Å; D14-F16 VanDerWaalsContact C-N 3.3Å; D14-F16 PolarHBondContact O-N 3.11Å; D14-G17 PolarHBondContact O-N 2.83Å; D14-G17 VanDerWaalsContact O-N 3.08Å
15	N	93.1	Very high	92.1	Very high	97 Å²	97	50.5 Å²	50.5	52%	0.519	29%	0.288	S	S	.	.	H	α-helix	trans	-62.9	-34.8	178.3	-175.4	38.5	0	0	0	112.9	M1 E11 V12 L13	M1-N15 HydrophobicContact SD-CB 4.27Å; M1-N15 PolarHBondContact SD-ND2 2.91Å; E11-N15 WeakPolarHBondContact O-CB 3.4Å; E11-N15 PolarHBondContact O-N 3.32Å; E11-N15 VanDerWaalsContact O-N 3.09Å; V12-N15 PolarHBondContact O-N 2.88Å; L13-N15 PolarHBondContact O-N 2.93Å
16	F	92.1	Very high	92.2	Very high	34 Å²	34	54.6 Å²	54.6	15%	0.149	31%	0.31	C	S	.	.	H	α-helix	trans	-90.1	-6	174.6	-70.1	-73	0	0	0	113.2	M1 V12 L13 D14 V18 P147 V222 V224	M1-F16 HydrophobicContact CB-CE2 4.24Å; M1-F16 HydrophobicContact CB-CZ 4.07Å; M1-F16 HydrophobicContact SD-CE2 4.37Å; V12-F16 HydrophobicContact CG1-CD2 4.12Å; V12-F16 HydrophobicContact CG1-CE2 4.05Å; V12-F16 VanDerWaalsContact O-CD2 3.29Å; V12-F16 WeakPolarHBondContact O-CD2 3.45Å; V12-F16 PolarHBondContact O-N 3.25Å; L13-F16 PolarHBondContact O-N 3.48Å; D14-F16 VanDerWaalsContact C-N 3.3Å; D14-F16 PolarHBondContact O-N 3.11Å; F16-V18 VanDerWaalsContact C-N 3.32Å; F16-V18 HydrophobicContact CB-CG1 3.99Å; F16-V18 PolarHBondContact O-N 3.07Å; F16-P147 HydrophobicContact CE1-CB 3.91Å; F16-P147 HydrophobicContact CZ-CB 4.31Å; F16-V222 HydrophobicContact CD2-CG2 4.25Å; F16-V224 HydrophobicContact CE2-CG1 4.38Å
17	G	92.3	Very high	92.2	Very high	52 Å²	52	60.8 Å²	60.8	54%	0.536	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	40.1	-177.6	0	0	0	0	0	112.8	L13 D14 Q28	L13-G17 PolarHBondContact O-N 2.8Å; D14-G17 PolarHBondContact O-N 2.83Å; D14-G17 VanDerWaalsContact O-N 3.08Å; G17-Q28 PolarHBondContact O-NE2 3.29Å
18	V	93.2	Very high	92.3	Very high	12 Å²	12	60 Å²	60	7%	0.073	33%	0.334	C	S	.	.			trans	-122.2	142.9	-173	68.9	0	0	0	0	111.9	L13 F16 G23 L24 I150 V222	L13-V18 HydrophobicContact CD2-CG1 3.73Å; L13-V18 PolarHBondContact O-N 3.39Å; L13-V18 VanDerWaalsContact O-N 3.08Å; F16-V18 VanDerWaalsContact C-N 3.32Å; F16-V18 HydrophobicContact CB-CG1 3.99Å; F16-V18 PolarHBondContact O-N 3.07Å; V18-G23 VanDerWaalsContact CG2-C 3.46Å; V18-L24 HydrophobicContact CB-CD2 3.81Å; V18-L24 HydrophobicContact CG2-CD2 3.64Å; V18-L24 HydrophobicContact CG2-CG 4.02Å; V18-I150 HydrophobicContact CG1-CD1 4.06Å; V18-I150 HydrophobicContact CG2-CD1 4.21Å; V18-I150 HydrophobicContact CG2-CG1 3.97Å; V18-V222 HydrophobicContact CG1-CG2 4.27Å
19	N	92.1	Very high	92.3	Very high	85 Å²	85	58.9 Å²	58.9	46%	0.455	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-95.5	132.9	174.4	-176.5	-65.4	0	0	0	110.4	I21 T22 G23	N19-I21 PolarHBondContact O-N 2.97Å; N19-I21 WeakPolarHBondContact OD1-CB 3.45Å; N19-I21 PolarHBondContact OD1-N 2.8Å; N19-T22 WeakPolarHBondContact CB-OG1 3.33Å; N19-T22 PolarHBondContact O-N 3.16Å; N19-G23 WeakPolarHBondContact O-CA 3.46Å; N19-G23 PolarHBondContact O-N 3.29Å
20	E	90.1	Very high	92.5	Very high	55 Å²	55	63.6 Å²	63.6	26%	0.257	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.5	-177.6	-171.9	178.6	-169.4	0	0	113.7	L13 T166 S167 I220	L13-E20 HydrophobicContact CD1-CB 4.1Å; L13-E20 HydrophobicContact CD2-CB 4.44Å; E20-T166 VanDerWaalsContact OE1-CB 3.23Å; E20-T166 WeakPolarHBondContact OE1-CB 3.32Å; E20-T166 PolarHBondContact OE1-OG1 2.56Å; E20-S167 WeakPolarHBondContact OE1-CB 3.34Å; E20-I220 HydrophobicContact CG-CG2 4.24Å
21	I	88.6	Confident	92.6	Very high	142 Å²	142	63 Å²	63	73%	0.728	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-40.4	-176	-57.2	174.4	0	0	0	111.2	N19	N19-I21 PolarHBondContact O-N 2.97Å; N19-I21 WeakPolarHBondContact OD1-CB 3.45Å; N19-I21 PolarHBondContact OD1-N 2.8Å
22	T	88.8	Confident	92.5	Very high	61 Å²	61	60 Å²	60	37%	0.374	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-23.1	-171.7	63.2	0	0	0	0	113.6	N19 R131 M132	N19-T22 WeakPolarHBondContact CB-OG1 3.33Å; N19-T22 PolarHBondContact O-N 3.16Å; T22-R131 CarbonylContact O-C 3.54Å; T22-R131 WeakPolarHBondContact O-CA 3.35Å; T22-M132 WeakPolarHBondContact O-CA 3.42Å; T22-M132 PolarHBondContact O-N 3.2Å
23	G	93.4	Very high	92.5	Very high	2 Å²	2	62.8 Å²	62.8	2%	0.021	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	69.5	-163	-175.8	0	0	0	0	0	114.2	V18 N19 Y130	V18-G23 VanDerWaalsContact CG2-C 3.46Å; N19-G23 WeakPolarHBondContact O-CA 3.46Å; N19-G23 PolarHBondContact O-N 3.29Å; G23-Y130 WeakPolarHBondContact CA-O 3.32Å
24	L	94.5	Very high	92.5	Very high	3 Å²	3	70.2 Å²	70.2	2%	0.016	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-76.8	153.9	-177.1	-67.5	179.7	0	0	0	113	V18 Q28 V29 R131 M132 V146 G148	V18-L24 HydrophobicContact CB-CD2 3.81Å; V18-L24 HydrophobicContact CG2-CD2 3.64Å; V18-L24 HydrophobicContact CG2-CG 4.02Å; L24-Q28 HydrophobicContact CB-CB 4.28Å; L24-Q28 HydrophobicContact CD2-CB 4.11Å; L24-V29 HydrophobicContact CB-CG2 3.96Å; L24-V29 HydrophobicContact CD1-CG2 4.24Å; L24-R131 WeakPolarHBondContact O-CA 3.36Å; L24-M132 PolarHBondContact O-N 3.07Å; L24-V146 HydrophobicContact CD1-CG2 3.99Å; L24-G148 WeakPolarHBondContact CG-O 3.41Å
25	T	94.5	Very high	92.5	Very high	43 Å²	43	71.5 Å²	71.5	26%	0.264	38%	0.379	S	S	.	.			trans	-78.1	158.1	165.2	68.6	0	0	0	0	111.6	E27 Q28 V29 M132	T25-E27 PolarHBondContact O-N 2.68Å; T25-Q28 PolarHBondContact O-N 2.85Å; T25-Q28 VanDerWaalsContact O-N 3.13Å; T25-Q28 VanDerWaalsContact OG1-CG 3.32Å; T25-Q28 WeakPolarHBondContact OG1-CG 3.3Å; T25-Q28 PolarHBondContact OG1-N 3.19Å; T25-Q28 PolarHBondContact OG1-OE1 3.04Å; T25-V29 WeakPolarHBondContact O-CG2 3.48Å; T25-V29 PolarHBondContact O-N 3.32Å; T25-M132 HydrophobicContact CG2-CB 4.42Å; T25-M132 HydrophobicContact CG2-CE 4.38Å; T25-M132 HydrophobicContact CG2-CG 4.44Å; T25-M132 HydrophobicContact CG2-SD 3.45Å; T25-M132 WeakPolarHBondContact CG2-SD 3.32Å
26	L	91.6	Very high	92.4	Very high	91 Å²	91	70.8 Å²	70.8	48%	0.476	37%	0.37	S	S	.	.	H	α-helix	trans	-59.6	-34	175.8	-69.3	172	0	0	0	112.7	V29 H30 D133	L26-V29 PolarHBondContact O-N 3.18Å; L26-H30 PolarHBondContact O-N 3.26Å; L26-D133 HydrophobicContact CD1-CB 4.1Å; L26-D133 HydrophobicContact CG-CB 4.24Å
27	E	93.4	Very high	92.5	Very high	164 Å²	164	70.2 Å²	70.2	77%	0.766	37%	0.373	S	S	*	.	H	α-helix	trans	-65.1	-43.9	174.6	-67.2	179.7	-179.5	0	0	111.7	T25 V29 H30 A31	T25-E27 PolarHBondContact O-N 2.68Å; E27-V29 VanDerWaalsContact C-N 3.32Å; E27-V29 PolarHBondContact O-N 3.26Å; E27-H30 PolarHBondContact O-N 2.89Å; E27-A31 WeakPolarHBondContact O-CB 3.39Å; E27-A31 PolarHBondContact O-N 3.26Å
28	Q	93	Very high	92.5	Very high	62 Å²	62	70.4 Å²	70.4	29%	0.29	37%	0.365	S	S	.	.	H	α-helix	trans	-64.2	-36.9	175.1	-73.6	173.1	-44.4	0	0	111.9	G17 L24 T25 S32	G17-Q28 PolarHBondContact O-NE2 3.29Å; L24-Q28 HydrophobicContact CB-CB 4.28Å; L24-Q28 HydrophobicContact CD2-CB 4.11Å; T25-Q28 PolarHBondContact O-N 2.85Å; T25-Q28 VanDerWaalsContact O-N 3.13Å; T25-Q28 VanDerWaalsContact OG1-CG 3.32Å; T25-Q28 WeakPolarHBondContact OG1-CG 3.3Å; T25-Q28 PolarHBondContact OG1-N 3.19Å; T25-Q28 PolarHBondContact OG1-OE1 3.04Å; Q28-S32 VanDerWaalsContact O-CB 3.23Å; Q28-S32 WeakPolarHBondContact O-CB 3.41Å; Q28-S32 PolarHBondContact O-N 3.41Å; Q28-S32 PolarHBondContact O-OG 3.05Å
29	V	93.8	Very high	92.6	Very high	9 Å²	9	70.2 Å²	70.2	6%	0.055	36%	0.364	C	S	.	.	H	α-helix	trans	-63.3	-49	175.6	172.5	0	0	0	0	110.5	L24 T25 L26 E27 A31 S32 L33 V146	L24-V29 HydrophobicContact CB-CG2 3.96Å; L24-V29 HydrophobicContact CD1-CG2 4.24Å; T25-V29 WeakPolarHBondContact O-CG2 3.48Å; T25-V29 PolarHBondContact O-N 3.32Å; L26-V29 PolarHBondContact O-N 3.18Å; E27-V29 VanDerWaalsContact C-N 3.32Å; E27-V29 PolarHBondContact O-N 3.26Å; V29-A31 PolarHBondContact O-N 3.45Å; V29-S32 PolarHBondContact O-N 3.48Å; V29-L33 WeakPolarHBondContact O-CB 3.08Å; V29-L33 PolarHBondContact O-N 3.43Å; V29-V146 HydrophobicContact CG1-CG2 4.37Å
30	H	93.1	Very high	92.4	Very high	123 Å²	123	69.7 Å²	69.7	57%	0.569	36%	0.358	S	S	*	.	H	α-helix	trans	-61.9	-44	177.4	-74.6	-179.5	0	0	0	112.4	L26 E27 S32 L33 Q34	L26-H30 PolarHBondContact O-N 3.26Å; E27-H30 PolarHBondContact O-N 2.89Å; H30-S32 VanDerWaalsContact C-N 3.33Å; H30-S32 PolarHBondContact O-N 3.41Å; H30-L33 PolarHBondContact O-N 3.21Å; H30-Q34 WeakPolarHBondContact O-CG 3.2Å; H30-Q34 PolarHBondContact O-N 2.92Å
31	A	93.8	Very high	92.1	Very high	56 Å²	56	67.6 Å²	67.6	46%	0.463	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-40.3	177	0	0	0	0	0	112	E27 V29 K35	E27-A31 WeakPolarHBondContact O-CB 3.39Å; E27-A31 PolarHBondContact O-N 3.26Å; V29-A31 PolarHBondContact O-N 3.45Å; A31-K35 WeakPolarHBondContact O-CB 3.2Å; A31-K35 PolarHBondContact O-N 2.94Å
32	S	92.3	Very high	91.6	Very high	21 Å²	21	64 Å²	64	15%	0.147	34%	0.335	C	S	.	.	H	α-helix	trans	-70.5	-38.8	177.7	-59.9	0	0	0	0	111.9	Q28 V29 H30 K35 Y36	Q28-S32 VanDerWaalsContact O-CB 3.23Å; Q28-S32 WeakPolarHBondContact O-CB 3.41Å; Q28-S32 PolarHBondContact O-N 3.41Å; Q28-S32 PolarHBondContact O-OG 3.05Å; V29-S32 PolarHBondContact O-N 3.48Å; H30-S32 VanDerWaalsContact C-N 3.33Å; H30-S32 PolarHBondContact O-N 3.41Å; S32-K35 PolarHBondContact O-N 3.01Å; S32-Y36 WeakPolarHBondContact O-CB 3.4Å; S32-Y36 VanDerWaalsContact O-CD2 3.27Å; S32-Y36 WeakPolarHBondContact O-CD2 3.45Å; S32-Y36 PolarHBondContact O-N 2.8Å
33	L	92.9	Very high	90.6	Very high	59 Å²	59	64.4 Å²	64.4	31%	0.309	35%	0.345	S	S	.	.	H	α-helix	trans	-64.5	-39.9	175.9	-167.2	72.3	0	0	0	111.4	V29 H30 K35 G37 V146	V29-L33 WeakPolarHBondContact O-CB 3.08Å; V29-L33 PolarHBondContact O-N 3.43Å; H30-L33 PolarHBondContact O-N 3.21Å; L33-K35 VanDerWaalsContact C-N 3.35Å; L33-G37 WeakPolarHBondContact O-CA 3.47Å; L33-G37 PolarHBondContact O-N 2.81Å; L33-V146 HydrophobicContact CB-CG1 3.98Å; L33-V146 HydrophobicContact CD1-CG1 3.76Å
34	Q	92.9	Very high	89.2	Confident	177 Å²	177	68.7 Å²	68.7	83%	0.827	36%	0.364	S	S	*	.	H	α-helix	trans	-66.4	-36	173.7	-75.7	-176.7	-10.2	0	0	112.6	H30	H30-Q34 WeakPolarHBondContact O-CG 3.2Å; H30-Q34 PolarHBondContact O-N 2.92Å
35	K	93.1	Very high	87.8	Confident	154 Å²	154	77.8 Å²	77.8	67%	0.67	41%	0.407	S	S	*	.	H	α-helix	trans	-77.6	-43.4	-177.8	-177.3	176.2	178.4	-176	0	113.3	A31 S32 L33	A31-K35 WeakPolarHBondContact O-CB 3.2Å; A31-K35 PolarHBondContact O-N 2.94Å; S32-K35 PolarHBondContact O-N 3.01Å; L33-K35 VanDerWaalsContact C-N 3.35Å
36	Y	91.6	Very high	86.3	Confident	82 Å²	82	78.3 Å²	78.3	32%	0.322	42%	0.42	S	S	.	.	H	α-helix	trans	-105.8	-13.6	-171.5	-60.5	-71.2	0	0	0	113.5	S32 P147	S32-Y36 WeakPolarHBondContact O-CB 3.4Å; S32-Y36 VanDerWaalsContact O-CD2 3.27Å; S32-Y36 WeakPolarHBondContact O-CD2 3.45Å; S32-Y36 PolarHBondContact O-N 2.8Å; Y36-P147 HydrophobicContact CD1-CG 4.14Å; Y36-P147 HydrophobicContact CD2-CB 4.04Å; Y36-P147 HydrophobicContact CD2-CG 3.7Å; Y36-P147 HydrophobicContact CE2-CB 4Å; Y36-P147 HydrophobicContact CE2-CG 4.14Å; Y36-P147 HydrophobicContact CG-CB 4.46Å; Y36-P147 HydrophobicContact CG-CG 3.71Å
37	G	93.7	Very high	85.3	Confident	22 Å²	22	78.2 Å²	78.2	23%	0.227	42%	0.416	C	S	.	.			trans	77.4	179.2	-173.4	0	0	0	0	0	113.3	L33	L33-G37 WeakPolarHBondContact O-CA 3.47Å; L33-G37 PolarHBondContact O-N 2.81Å
38	P	93	Very high	84.8	Confident	55 Å²	55	72.9 Å²	72.9	36%	0.357	40%	0.396	S	S	.	.			trans	-67.1	151.5	174.6	29.6	-34.4	0	0	0	111.6	E40 R143	P38-E40 HydrophobicContact CB-CG 4.08Å; P38-E40 HydrophobicContact CG-CG 3.97Å; P38-E40 PolarHBondContact O-N 2.85Å; P38-R143 WeakPolarHBondContact CA-O 3.48Å
39	N	94.2	Very high	84.2	Confident	9 Å²	9	74.7 Å²	74.7	5%	0.048	41%	0.408	C	S	.	.	S	Bend	trans	-82.4	66.6	174.1	179.3	46.1	0	0	0	111	A142 R143 I145 P160 T226 G227	N39-A142 WeakPolarHBondContact CB-O 3.41Å; N39-A142 PolarHBondContact ND2-O 3.3Å; N39-R143 PolarHBondContact N-O 2.88Å; N39-R143 WeakPolarHBondContact O-CA 3.41Å; N39-I145 VanDerWaalsContact CB-O 3.26Å; N39-I145 WeakPolarHBondContact CB-O 3.45Å; N39-P160 PolarHBondContact ND2-O 3.02Å; N39-T226 HydrophobicContact CB-CG2 3.91Å; N39-T226 VanDerWaalsContact OD1-CA 3.31Å; N39-T226 WeakPolarHBondContact OD1-CA 3.48Å; N39-T226 VanDerWaalsContact OD1-CB 3.27Å; N39-T226 WeakPolarHBondContact OD1-CB 3.41Å; N39-G227 PolarHBondContact OD1-N 3.03Å
40	E	88.1	Confident	83.8	Confident	73 Å²	73	83.1 Å²	83.1	34%	0.341	44%	0.439	S	S	.	.	S	Bend	trans	-141.4	150.7	175.2	65.4	-168.5	-176.3	0	0	109.8	P38 R143	P38-E40 HydrophobicContact CB-CG 4.08Å; P38-E40 HydrophobicContact CG-CG 3.97Å; P38-E40 PolarHBondContact O-N 2.85Å; E40-R143 HydrophobicContact CB-CB 4.36Å; E40-R143 IonicContact OE2-NH1 2.79Å
41	L	83.8	Confident	83.4	Confident	12 Å²	12	82 Å²	82	6%	0.063	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-78.2	125.3	171.2	-71.3	-179.7	0	0	0	108.6	E123 V228 R236	L41-E123 WeakPolarHBondContact CB-OE1 3.36Å; L41-E123 WeakPolarHBondContact CG-OE1 3.49Å; L41-E123 PolarHBondContact N-OE1 2.8Å; L41-V228 HydrophobicContact CD2-CG1 4.5Å; L41-R236 HydrophobicContact CD1-CB 4.43Å; L41-R236 HydrophobicContact CD1-CG 4.42Å; L41-R236 HydrophobicContact CD2-CB 4.31Å; L41-R236 HydrophobicContact CD2-CG 4.33Å
42	P	78.4	Confident	82.8	Confident	66 Å²	66	79.4 Å²	79.4	43%	0.429	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-51.7	152.6	179.6	10.9	-22.5	0	0	0	113.6	V228 R236	P42-V228 HydrophobicContact CG-CG1 4.06Å; P42-R236 PolarHBondContact O-NH1 3.21Å; P42-R236 PolarHBondContact O-NH2 3.48Å
43	A	68.1	Low	82.5	Confident	70 Å²	70	80.8 Å²	80.8	58%	0.579	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-76.3	143.4	166.3	0	0	0	0	0	109.4
44	E	63.7	Low	82.3	Confident	92 Å²	92	80.8 Å²	80.8	43%	0.43	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-79.9	138.5	165.3	-112	173.3	-159.1	0	0	109.1	G46 I116	E44-G46 PolarHBondContact O-N 3.12Å; E44-I116 WeakPolarHBondContact OE2-CD1 3.35Å
45	E	64.4	Low	81.8	Confident	194 Å²	194	75.5 Å²	75.5	91%	0.907	40%	0.397	S	S	*	.			trans	-80.3	99.1	171.9	-65.4	-177.6	174.9	0	0	107.3
46	G	63.3	Low	81.4	Confident	53 Å²	53	70.8 Å²	70.8	55%	0.546	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-65.2	151.9	173.8	0	0	0	0	0	111.1	E44	E44-G46 PolarHBondContact O-N 3.12Å
47	K	70.5	Confident	81.2	Confident	90 Å²	90	69.7 Å²	69.7	39%	0.391	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-62	141.5	176.7	-67.4	-174.9	-173.8	179	0	109.9	L52 E55	K47-L52 HydrophobicContact CB-CD2 4.28Å; K47-L52 HydrophobicContact CB-CG 4.17Å; K47-L52 HydrophobicContact CD-CD2 4Å; K47-E55 WeakPolarHBondContact CE-OE1 3.4Å; K47-E55 IonicContact NZ-OE1 2.89Å; K47-E55 PolarHBondContact NZ-OE1 3.35Å; K47-E55 IonicContact NZ-OE2 3.63Å; K47-E55 PolarHBondContact NZ-OE2 3.26Å
48	S	82.3	Confident	80.7	Confident	51 Å²	51	73.9 Å²	73.9	36%	0.357	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-69.3	152.2	173.5	67.1	0	0	0	0	110.6	W50 E51 L52	S48-W50 PolarHBondContact O-N 3.14Å; S48-W50 VanDerWaalsContact O-N 3.09Å; S48-E51 WeakPolarHBondContact CB-OE2 3.41Å; S48-E51 PolarHBondContact N-OE2 2.7Å; S48-E51 PolarHBondContact O-N 2.71Å; S48-E51 VanDerWaalsContact O-N 3.09Å; S48-E51 VanDerWaalsContact OG-CG 3.27Å; S48-E51 WeakPolarHBondContact OG-CG 3.31Å; S48-E51 PolarHBondContact OG-N 3.02Å; S48-E51 PolarHBondContact OG-OE2 3.05Å; S48-L52 PolarHBondContact O-N 3.13Å; S48-L52 VanDerWaalsContact O-N 3.12Å
49	L	81	Confident	80	Confident	100 Å²	100	74.5 Å²	74.5	52%	0.524	39%	0.388	S	S	.	.	H	α-helix	trans	-55.2	-30.2	174.3	-72.6	171.8	0	0	0	112.4	V53 V106	L49-V53 VanDerWaalsContact O-CG2 3.28Å; L49-V53 WeakPolarHBondContact O-CG2 3.4Å; L49-V53 PolarHBondContact O-N 3.19Å; L49-V106 HydrophobicContact CD2-CG1 4.28Å
50	W	85.4	Confident	79.3	Confident	187 Å²	187	77.7 Å²	77.7	71%	0.708	41%	0.405	S	S	*	.	H	α-helix	trans	-70.7	-44	177.8	179.1	-106.8	0	0	0	112.2	S48 L52 V53 V54	S48-W50 PolarHBondContact O-N 3.14Å; S48-W50 VanDerWaalsContact O-N 3.09Å; W50-L52 VanDerWaalsContact C-N 3.34Å; W50-L52 PolarHBondContact O-N 3.48Å; W50-V53 PolarHBondContact O-N 2.86Å; W50-V54 HydrophobicContact CD2-CG2 4.45Å; W50-V54 HydrophobicContact CZ2-CG2 4.19Å; W50-V54 WeakPolarHBondContact O-CG2 3.43Å; W50-V54 PolarHBondContact O-N 3.33Å
51	E	84.5	Confident	78.8	Confident	98 Å²	98	75.5 Å²	75.5	46%	0.458	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-43.7	176	-73.5	158.8	162.2	0	0	111.2	S48 V53 V54 E55	S48-E51 WeakPolarHBondContact CB-OE2 3.41Å; S48-E51 PolarHBondContact N-OE2 2.7Å; S48-E51 PolarHBondContact O-N 2.71Å; S48-E51 VanDerWaalsContact O-N 3.09Å; S48-E51 VanDerWaalsContact OG-CG 3.27Å; S48-E51 WeakPolarHBondContact OG-CG 3.31Å; S48-E51 PolarHBondContact OG-N 3.02Å; S48-E51 PolarHBondContact OG-OE2 3.05Å; E51-V53 VanDerWaalsContact C-N 3.3Å; E51-V53 PolarHBondContact O-N 3.38Å; E51-V54 PolarHBondContact O-N 3.1Å; E51-V54 VanDerWaalsContact O-N 3.12Å; E51-E55 WeakPolarHBondContact O-CG 3.42Å; E51-E55 PolarHBondContact O-N 3.36Å
52	L	80.9	Confident	78.7	Confident	3 Å²	3	76.3 Å²	76.3	2%	0.016	40%	0.401	C	S	.	.	H	α-helix	trans	-59.1	-39.8	175.2	-70.5	173.2	0	0	0	112.4	K47 S48 W50 Q56 V106 E109	K47-L52 HydrophobicContact CB-CD2 4.28Å; K47-L52 HydrophobicContact CB-CG 4.17Å; K47-L52 HydrophobicContact CD-CD2 4Å; S48-L52 PolarHBondContact O-N 3.13Å; S48-L52 VanDerWaalsContact O-N 3.12Å; W50-L52 VanDerWaalsContact C-N 3.34Å; W50-L52 PolarHBondContact O-N 3.48Å; L52-Q56 WeakPolarHBondContact O-CG 3.19Å; L52-Q56 PolarHBondContact O-N 3.12Å; L52-V106 HydrophobicContact CB-CG1 4.34Å; L52-V106 HydrophobicContact CB-CG2 4.16Å; L52-E109 HydrophobicContact CD2-CB 4.34Å; L52-E109 HydrophobicContact CD2-CG 3.8Å
53	V	86.6	Confident	79	Confident	50 Å²	50	79.3 Å²	79.3	30%	0.303	40%	0.403	S	S	.	.	H	α-helix	trans	-64.7	-44.6	175.2	170.7	0	0	0	0	110.8	L49 W50 E51 E55 Q56 F57 V106	L49-V53 VanDerWaalsContact O-CG2 3.28Å; L49-V53 WeakPolarHBondContact O-CG2 3.4Å; L49-V53 PolarHBondContact O-N 3.19Å; W50-V53 PolarHBondContact O-N 2.86Å; E51-V53 VanDerWaalsContact C-N 3.3Å; E51-V53 PolarHBondContact O-N 3.38Å; V53-E55 VanDerWaalsContact C-N 3.32Å; V53-E55 PolarHBondContact O-N 3.14Å; V53-Q56 PolarHBondContact O-N 2.79Å; V53-F57 HydrophobicContact CG1-CE2 4.2Å; V53-F57 VanDerWaalsContact O-CD2 3.31Å; V53-F57 WeakPolarHBondContact O-CD2 3.49Å; V53-V106 HydrophobicContact CB-CG2 4.49Å; V53-V106 HydrophobicContact CG2-CG2 3.8Å
54	V	88.3	Confident	79.7	Confident	58 Å²	58	77.4 Å²	77.4	35%	0.352	38%	0.383	S	S	.	.	H	α-helix	trans	-61.7	-41.1	-179.5	171.5	0	0	0	0	111.3	W50 E51 Q56 F57 E58	W50-V54 HydrophobicContact CD2-CG2 4.45Å; W50-V54 HydrophobicContact CZ2-CG2 4.19Å; W50-V54 WeakPolarHBondContact O-CG2 3.43Å; W50-V54 PolarHBondContact O-N 3.33Å; E51-V54 PolarHBondContact O-N 3.1Å; E51-V54 VanDerWaalsContact O-N 3.12Å; V54-Q56 VanDerWaalsContact C-N 3.26Å; V54-Q56 PolarHBondContact O-N 3.23Å; V54-F57 PolarHBondContact O-N 2.87Å; V54-E58 PolarHBondContact O-N 3.43Å
55	E	83.6	Confident	80.5	Confident	66 Å²	66	73.5 Å²	73.5	31%	0.308	37%	0.366	S	S	.	.	H	α-helix	trans	-58.9	-34.8	178.2	-75	179.6	175.7	0	0	112.7	K47 E51 V53 F57 E58	K47-E55 WeakPolarHBondContact CE-OE1 3.4Å; K47-E55 IonicContact NZ-OE1 2.89Å; K47-E55 PolarHBondContact NZ-OE1 3.35Å; K47-E55 IonicContact NZ-OE2 3.63Å; K47-E55 PolarHBondContact NZ-OE2 3.26Å; E51-E55 WeakPolarHBondContact O-CG 3.42Å; E51-E55 PolarHBondContact O-N 3.36Å; V53-E55 VanDerWaalsContact C-N 3.32Å; V53-E55 PolarHBondContact O-N 3.14Å; E55-F57 PolarHBondContact O-N 3.28Å; E55-E58 WeakPolarHBondContact O-CB 3.37Å; E55-E58 PolarHBondContact O-N 3.31Å
56	Q	83.2	Confident	81.5	Confident	56 Å²	56	67.1 Å²	67.1	26%	0.262	34%	0.337	S	S	.	.	H	α-helix	trans	-63.7	-23.3	175.7	-60	-58.6	-48.3	0	0	113.2	L52 V53 V54 A102 V106	L52-Q56 WeakPolarHBondContact O-CG 3.19Å; L52-Q56 PolarHBondContact O-N 3.12Å; V53-Q56 PolarHBondContact O-N 2.79Å; V54-Q56 VanDerWaalsContact C-N 3.26Å; V54-Q56 PolarHBondContact O-N 3.23Å; Q56-A102 HydrophobicContact CB-CB 4.05Å; Q56-A102 HydrophobicContact CG-CB 4.41Å; Q56-V106 HydrophobicContact CG-CG2 4.14Å
57	F	87.4	Confident	82.5	Confident	58 Å²	58	70 Å²	70	25%	0.254	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	4.7	176.4	-67.2	-87.3	0	0	0	113.3	V53 V54 E55 V62 R63 L66 L98 A102	V53-F57 HydrophobicContact CG1-CE2 4.2Å; V53-F57 VanDerWaalsContact O-CD2 3.31Å; V53-F57 WeakPolarHBondContact O-CD2 3.49Å; V54-F57 PolarHBondContact O-N 2.87Å; E55-F57 PolarHBondContact O-N 3.28Å; F57-V62 HydrophobicContact CD1-CG1 3.77Å; F57-V62 HydrophobicContact CE1-CG1 4.4Å; F57-V62 HydrophobicContact CG-CG1 4.39Å; F57-R63 WeakPolarHBondContact O-CG 3.22Å; F57-R63 PolarHBondContact O-NE 3.31Å; F57-L66 HydrophobicContact CD1-CD2 4.42Å; F57-L98 HydrophobicContact CE1-CB 4.18Å; F57-A102 HydrophobicContact CE2-CB 3.88Å; F57-A102 HydrophobicContact CZ-CB 4.12Å
58	E	83.4	Confident	83	Confident	111 Å²	111	65.9 Å²	65.9	52%	0.519	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-22.3	175.1	-67.6	-161.8	154.2	0	0	113.7	V54 E55 R63	V54-E58 PolarHBondContact O-N 3.43Å; E55-E58 WeakPolarHBondContact O-CB 3.37Å; E55-E58 PolarHBondContact O-N 3.31Å; E58-R63 PolarHBondContact O-NE 3.08Å
59	D	79.5	Confident	83.1	Confident	67 Å²	67	63.8 Å²	63.8	36%	0.358	31%	0.308	S	S	.	.	S	Bend	trans	-60.5	140	178.3	-179.1	-99.5	0	0	0	112.3	L61 V62 R63	D59-L61 PolarHBondContact O-N 3.27Å; D59-L61 VanDerWaalsContact OD1-CB 3.31Å; D59-L61 WeakPolarHBondContact OD1-CB 3.07Å; D59-L61 PolarHBondContact OD1-N 3.14Å; D59-V62 HydrophobicContact CB-CB 4.25Å; D59-V62 HydrophobicContact CB-CG2 4.07Å; D59-V62 PolarHBondContact O-N 3.45Å; D59-V62 PolarHBondContact OD1-N 3.05Å; D59-R63 WeakPolarHBondContact O-CG 3.46Å; D59-R63 PolarHBondContact O-N 2.83Å
60	L	79.9	Confident	83.4	Confident	77 Å²	77	62.3 Å²	62.3	40%	0.403	31%	0.306	S	S	.	.	H	α-helix	trans	-66.2	-36.5	-173.6	-173.4	65.8	0	0	0	112.5	R63 I64 S261	L60-R63 PolarHBondContact O-N 3.31Å; L60-I64 WeakPolarHBondContact O-CG1 3.35Å; L60-I64 PolarHBondContact O-N 2.88Å; L60-I64 VanDerWaalsContact O-N 3.09Å; L60-S261 WeakPolarHBondContact CD2-OG 3.23Å
61	L	76.3	Confident	83.1	Confident	26 Å²	26	54.3 Å²	54.3	14%	0.136	28%	0.277	C	S	.	.	H	α-helix	trans	-70.3	-42.3	178.3	-61.6	178.7	0	0	0	110.5	D59 R63 I64 L65 L260 I307	D59-L61 PolarHBondContact O-N 3.27Å; D59-L61 VanDerWaalsContact OD1-CB 3.31Å; D59-L61 WeakPolarHBondContact OD1-CB 3.07Å; D59-L61 PolarHBondContact OD1-N 3.14Å; L61-R63 VanDerWaalsContact C-N 3.28Å; L61-R63 PolarHBondContact O-N 3.35Å; L61-I64 PolarHBondContact O-N 2.98Å; L61-I64 VanDerWaalsContact O-N 3.13Å; L61-L65 PolarHBondContact O-N 3.34Å; L61-L260 HydrophobicContact CD2-CD2 4.41Å; L61-I307 HydrophobicContact CD2-CG1 4.47Å
62	V	82.1	Confident	82.8	Confident	29 Å²	29	50 Å²	50	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-40	175	174.7	0	0	0	0	111	F57 D59 I64 L65 L66 L98	F57-V62 HydrophobicContact CD1-CG1 3.77Å; F57-V62 HydrophobicContact CE1-CG1 4.4Å; F57-V62 HydrophobicContact CG-CG1 4.39Å; D59-V62 HydrophobicContact CB-CB 4.25Å; D59-V62 HydrophobicContact CB-CG2 4.07Å; D59-V62 PolarHBondContact O-N 3.45Å; D59-V62 PolarHBondContact OD1-N 3.05Å; V62-I64 PolarHBondContact O-N 3.01Å; V62-L65 PolarHBondContact O-N 3.3Å; V62-L66 VanDerWaalsContact O-CB 3.32Å; V62-L66 WeakPolarHBondContact O-CB 3.37Å; V62-L66 PolarHBondContact O-N 2.88Å; V62-L98 HydrophobicContact CG1-CD2 3.96Å
63	R	85.2	Confident	83	Confident	129 Å²	129	54.4 Å²	54.4	49%	0.487	28%	0.277	S	S	.	.	H	α-helix	trans	-64.3	-37.1	174.6	-73.6	174.2	177	177.7	3.2	113.1	F57 E58 D59 L60 L61 L66 L67	F57-R63 WeakPolarHBondContact O-CG 3.22Å; F57-R63 PolarHBondContact O-NE 3.31Å; E58-R63 PolarHBondContact O-NE 3.08Å; D59-R63 WeakPolarHBondContact O-CG 3.46Å; D59-R63 PolarHBondContact O-N 2.83Å; L60-R63 PolarHBondContact O-N 3.31Å; L61-R63 VanDerWaalsContact C-N 3.28Å; L61-R63 PolarHBondContact O-N 3.35Å; R63-L66 PolarHBondContact O-N 3.13Å; R63-L67 WeakPolarHBondContact O-CB 3.25Å; R63-L67 PolarHBondContact O-N 2.92Å
64	I	81.3	Confident	82.8	Confident	31 Å²	31	55.4 Å²	55.4	16%	0.159	28%	0.283	C	S	.	.	H	α-helix	trans	-66.5	-44.2	175.2	-70.7	168.9	0	0	0	110.4	L60 L61 V62 L67 A68 S261 A303 I307	L60-I64 WeakPolarHBondContact O-CG1 3.35Å; L60-I64 PolarHBondContact O-N 2.88Å; L60-I64 VanDerWaalsContact O-N 3.09Å; L61-I64 PolarHBondContact O-N 2.98Å; L61-I64 VanDerWaalsContact O-N 3.13Å; V62-I64 PolarHBondContact O-N 3.01Å; I64-L67 WeakPolarHBondContact O-CB 3.48Å; I64-L67 PolarHBondContact O-N 3.47Å; I64-A68 WeakPolarHBondContact O-CB 3.33Å; I64-A68 PolarHBondContact O-N 3.36Å; I64-S261 VanDerWaalsContact CD1-OG 3.28Å; I64-S261 WeakPolarHBondContact CD1-OG 3.34Å; I64-A303 HydrophobicContact CG2-CB 4.12Å; I64-I307 HydrophobicContact CB-CD1 4.49Å; I64-I307 HydrophobicContact CG2-CD1 4.11Å
65	L	80.9	Confident	82.2	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.052	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-39.7	174.6	-82.5	165.7	0	0	0	112.3	L61 V62 L67 A68 A69 I94 L98 V304 I307 E309	L61-L65 PolarHBondContact O-N 3.34Å; V62-L65 PolarHBondContact O-N 3.3Å; L65-L67 VanDerWaalsContact C-N 3.34Å; L65-A68 WeakPolarHBondContact O-CB 3.49Å; L65-A68 PolarHBondContact O-N 3.43Å; L65-A69 WeakPolarHBondContact O-CB 3.38Å; L65-A69 PolarHBondContact O-N 2.92Å; L65-I94 HydrophobicContact CD2-CG2 4.35Å; L65-L98 HydrophobicContact CB-CD1 4.48Å; L65-L98 HydrophobicContact CB-CD2 3.99Å; L65-L98 HydrophobicContact CD1-CD2 4.28Å; L65-V304 HydrophobicContact CD2-CG2 4.39Å; L65-I307 HydrophobicContact CD1-CD1 4.15Å; L65-I307 HydrophobicContact CD1-CG2 3.95Å; L65-I307 HydrophobicContact CD2-CD1 4.19Å; L65-I307 HydrophobicContact CG-CD1 3.68Å; L65-E309 HydrophobicContact CD1-CG 4.2Å
66	L	86.4	Confident	82	Confident	59 Å²	59	51.7 Å²	51.7	31%	0.309	27%	0.265	S	S	.	.	H	α-helix	trans	-64.7	-41.1	175.8	-174.8	65.8	0	0	0	111	F57 V62 R63 A69 C70 L98	F57-L66 HydrophobicContact CD1-CD2 4.42Å; V62-L66 VanDerWaalsContact O-CB 3.32Å; V62-L66 WeakPolarHBondContact O-CB 3.37Å; V62-L66 PolarHBondContact O-N 2.88Å; R63-L66 PolarHBondContact O-N 3.13Å; L66-A69 PolarHBondContact O-N 3.14Å; L66-C70 PolarHBondContact O-N 3.27Å; L66-C70 PolarHBondContact O-SG 2.89Å; L66-L98 HydrophobicContact CB-CD1 4.06Å; L66-L98 HydrophobicContact CD1-CD1 3.93Å
67	L	84.3	Confident	81.8	Confident	113 Å²	113	54 Å²	54	59%	0.592	28%	0.278	S	S	*	.	H	α-helix	trans	-61.1	-45.9	172.9	179.7	65.2	0	0	0	110.9	R63 I64 L65 A69 C70 V71	R63-L67 WeakPolarHBondContact O-CB 3.25Å; R63-L67 PolarHBondContact O-N 2.92Å; I64-L67 WeakPolarHBondContact O-CB 3.48Å; I64-L67 PolarHBondContact O-N 3.47Å; L65-L67 VanDerWaalsContact C-N 3.34Å; L67-A69 VanDerWaalsContact C-N 3.35Å; L67-A69 PolarHBondContact O-N 3.2Å; L67-C70 PolarHBondContact O-N 3.1Å; L67-V71 HydrophobicContact CD1-CG2 4.41Å; L67-V71 WeakPolarHBondContact O-CB 3.21Å; L67-V71 VanDerWaalsContact O-CG2 3.26Å; L67-V71 WeakPolarHBondContact O-CG2 3.49Å; L67-V71 PolarHBondContact O-N 2.96Å
68	A	80.8	Confident	81.1	Confident	5 Å²	5	58.9 Å²	58.9	4%	0.041	30%	0.299	C	S	.	.	H	α-helix	trans	-58.8	-43.5	174.9	0	0	0	0	0	112	I64 L65 V71 S72 V300	I64-A68 WeakPolarHBondContact O-CB 3.33Å; I64-A68 PolarHBondContact O-N 3.36Å; L65-A68 WeakPolarHBondContact O-CB 3.49Å; L65-A68 PolarHBondContact O-N 3.43Å; A68-V71 PolarHBondContact O-N 2.89Å; A68-S72 WeakPolarHBondContact O-CB 3.22Å; A68-S72 PolarHBondContact O-N 2.81Å; A68-V300 HydrophobicContact CB-CG1 4.02Å
69	A	84.8	Confident	80.4	Confident	6 Å²	6	59 Å²	59	5%	0.05	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-45.9	175.8	0	0	0	0	0	112	L65 L66 L67 V71 S72 F73 I94	L65-A69 WeakPolarHBondContact O-CB 3.38Å; L65-A69 PolarHBondContact O-N 2.92Å; L66-A69 PolarHBondContact O-N 3.14Å; L67-A69 VanDerWaalsContact C-N 3.35Å; L67-A69 PolarHBondContact O-N 3.2Å; A69-V71 VanDerWaalsContact C-N 3.35Å; A69-V71 PolarHBondContact O-N 3.29Å; A69-S72 PolarHBondContact O-N 2.98Å; A69-F73 VanDerWaalsContact O-CB 3.29Å; A69-F73 WeakPolarHBondContact O-CB 3.37Å; A69-F73 PolarHBondContact O-N 3.18Å; A69-I94 HydrophobicContact CB-CB 4.12Å; A69-I94 HydrophobicContact CB-CG2 3.7Å
70	C	85.8	Confident	79.5	Confident	70 Å²	70	64.3 Å²	64.3	47%	0.473	32%	0.323	S	S	.	.	H	α-helix	trans	-61.9	-43.3	176.6	-71.5	0	0	0	0	111.6	L66 L67 F73 V74	L66-C70 PolarHBondContact O-N 3.27Å; L66-C70 PolarHBondContact O-SG 2.89Å; L67-C70 PolarHBondContact O-N 3.1Å; C70-F73 PolarHBondContact O-N 3.08Å; C70-V74 VanDerWaalsContact O-CG2 3.31Å; C70-V74 WeakPolarHBondContact O-CG2 3.25Å; C70-V74 PolarHBondContact O-N 2.9Å
71	V	79.9	Confident	78.5	Confident	19 Å²	19	63.2 Å²	63.2	12%	0.115	33%	0.33	C	S	.	.	H	α-helix	trans	-63.1	-50.8	176.6	163.4	0	0	0	0	111.1	L67 A68 A69 F73 V74 L75 F296 V300	L67-V71 HydrophobicContact CD1-CG2 4.41Å; L67-V71 WeakPolarHBondContact O-CB 3.21Å; L67-V71 VanDerWaalsContact O-CG2 3.26Å; L67-V71 WeakPolarHBondContact O-CG2 3.49Å; L67-V71 PolarHBondContact O-N 2.96Å; A68-V71 PolarHBondContact O-N 2.89Å; A69-V71 VanDerWaalsContact C-N 3.35Å; A69-V71 PolarHBondContact O-N 3.29Å; V71-F73 VanDerWaalsContact C-N 3.25Å; V71-F73 PolarHBondContact O-N 3.37Å; V71-V74 PolarHBondContact O-N 2.89Å; V71-L75 HydrophobicContact CG1-CD1 4.02Å; V71-L75 HydrophobicContact CG1-CG 4.34Å; V71-L75 WeakPolarHBondContact O-CG 3.36Å; V71-L75 PolarHBondContact O-N 2.93Å; V71-F296 HydrophobicContact CB-CE1 3.9Å; V71-F296 HydrophobicContact CB-CZ 4.49Å; V71-F296 HydrophobicContact CG1-CD1 3.49Å; V71-F296 VanDerWaalsContact CG1-CD1 3.49Å; V71-F296 HydrophobicContact CG1-CE1 3.11Å; V71-F296 HydrophobicContact CG1-CZ 4.04Å; V71-F296 HydrophobicContact CG2-CE1 3.44Å; V71-F296 VanDerWaalsContact CG2-CE1 3.44Å; V71-F296 HydrophobicContact CG2-CZ 3.65Å; V71-V300 HydrophobicContact CB-CG2 4.18Å; V71-V300 HydrophobicContact CG1-CG2 3.57Å
72	S	78.9	Confident	77.2	Confident	6 Å²	6	71.5 Å²	71.5	4%	0.042	37%	0.368	C	S	.	.	H	α-helix	trans	-58.2	-40.6	179.3	-174.3	0	0	0	0	110.8	A68 A69 V74 L75 A76 E90 P91	A68-S72 WeakPolarHBondContact O-CB 3.22Å; A68-S72 PolarHBondContact O-N 2.81Å; A69-S72 PolarHBondContact O-N 2.98Å; S72-V74 PolarHBondContact O-N 3.44Å; S72-L75 PolarHBondContact O-N 3.02Å; S72-A76 WeakPolarHBondContact O-CB 3.31Å; S72-A76 PolarHBondContact O-N 3.12Å; S72-E90 WeakPolarHBondContact CB-OE1 3.47Å; S72-E90 WeakPolarHBondContact OG-CG 3.41Å; S72-E90 PolarHBondContact OG-OE1 3.18Å; S72-P91 WeakPolarHBondContact OG-CD 3.17Å
73	F	85.1	Confident	75.9	Confident	96 Å²	96	75.2 Å²	75.2	42%	0.421	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-41.3	174.4	-167.8	-94.3	0	0	0	112.8	A69 C70 V71 L77 F88 P91	A69-F73 VanDerWaalsContact O-CB 3.29Å; A69-F73 WeakPolarHBondContact O-CB 3.37Å; A69-F73 PolarHBondContact O-N 3.18Å; C70-F73 PolarHBondContact O-N 3.08Å; V71-F73 VanDerWaalsContact C-N 3.25Å; V71-F73 PolarHBondContact O-N 3.37Å; F73-L77 HydrophobicContact CD1-CD1 4Å; F73-L77 HydrophobicContact CD1-CG 4.46Å; F73-L77 HydrophobicContact CE1-CD1 3.82Å; F73-L77 HydrophobicContact CE1-CG 4.29Å; F73-L77 WeakPolarHBondContact O-CG 3.24Å; F73-L77 PolarHBondContact O-N 3.38Å; F73-F88 HydrophobicContact CD2-CD1 4.33Å; F73-F88 HydrophobicContact CD2-CE1 4.5Å; F73-F88 HydrophobicContact CE2-CD1 4.05Å; F73-F88 HydrophobicContact CE2-CE1 4.09Å; F73-F88 HydrophobicContact CZ-CE1 4.39Å; F73-P91 HydrophobicContact CB-CB 3.88Å; F73-P91 HydrophobicContact CB-CG 4.39Å; F73-P91 HydrophobicContact CD2-CB 4.1Å; F73-P91 HydrophobicContact CD2-CG 4.17Å
74	V	82.6	Confident	74.7	Confident	72 Å²	72	73.2 Å²	73.2	44%	0.436	39%	0.385	S	S	.	.	H	α-helix	trans	-65.7	-43.1	175.6	170.8	0	0	0	0	110.8	C70 V71 S72 L77 F78	C70-V74 VanDerWaalsContact O-CG2 3.31Å; C70-V74 WeakPolarHBondContact O-CG2 3.25Å; C70-V74 PolarHBondContact O-N 2.9Å; V71-V74 PolarHBondContact O-N 2.89Å; S72-V74 PolarHBondContact O-N 3.44Å; V74-L77 WeakPolarHBondContact O-CB 3.22Å; V74-L77 PolarHBondContact O-N 2.88Å; V74-L77 VanDerWaalsContact O-N 3.16Å; V74-F78 HydrophobicContact CG1-CD2 3.87Å; V74-F78 HydrophobicContact CG1-CE2 3.78Å; V74-F78 WeakPolarHBondContact O-CD2 3.43Å; V74-F78 PolarHBondContact O-N 3.46Å
75	L	75.7	Confident	73.8	Confident	36 Å²	36	77.5 Å²	77.5	19%	0.188	41%	0.413	C	S	.	.	H	α-helix	trans	-61.8	-44.4	177.9	-69.7	178.4	0	0	0	111.6	V71 S72 L77 F78 E79 I293 K297	V71-L75 HydrophobicContact CG1-CD1 4.02Å; V71-L75 HydrophobicContact CG1-CG 4.34Å; V71-L75 WeakPolarHBondContact O-CG 3.36Å; V71-L75 PolarHBondContact O-N 2.93Å; S72-L75 PolarHBondContact O-N 3.02Å; L75-L77 PolarHBondContact O-N 2.85Å; L75-F78 PolarHBondContact O-N 2.94Å; L75-E79 PolarHBondContact O-N 2.96Å; L75-E79 VanDerWaalsContact O-N 3.16Å; L75-I293 HydrophobicContact CD2-CB 4.37Å; L75-I293 HydrophobicContact CD2-CG1 4.18Å; L75-I293 HydrophobicContact CD2-CG2 3.52Å; L75-K297 HydrophobicContact CD1-CB 4.39Å
76	A	78.3	Confident	73.2	Confident	10 Å²	10	78.6 Å²	78.6	8%	0.083	42%	0.42	C	S	.	.	H	α-helix	trans	-60.9	-28	175.6	0	0	0	0	0	113.3	S72 A87 F88	S72-A76 WeakPolarHBondContact O-CB 3.31Å; S72-A76 PolarHBondContact O-N 3.12Å; A76-A87 HydrophobicContact CB-CB 4.28Å; A76-F88 HydrophobicContact CB-CD1 4.16Å; A76-F88 HydrophobicContact CB-CE1 4.15Å
77	L	78.4	Confident	72.5	Confident	105 Å²	105	76.7 Å²	76.7	55%	0.55	41%	0.413	S	S	.	.	H	α-helix	trans	-74.5	-24.7	174.8	-72.3	171.7	0	0	0	113.6	F73 V74 L75 F88	F73-L77 HydrophobicContact CD1-CD1 4Å; F73-L77 HydrophobicContact CD1-CG 4.46Å; F73-L77 HydrophobicContact CE1-CD1 3.82Å; F73-L77 HydrophobicContact CE1-CG 4.29Å; F73-L77 WeakPolarHBondContact O-CG 3.24Å; F73-L77 PolarHBondContact O-N 3.38Å; V74-L77 WeakPolarHBondContact O-CB 3.22Å; V74-L77 PolarHBondContact O-N 2.88Å; V74-L77 VanDerWaalsContact O-N 3.16Å; L75-L77 PolarHBondContact O-N 2.85Å; L77-F88 HydrophobicContact CD2-CE1 4.16Å; L77-F88 HydrophobicContact CD2-CZ 4.04Å
78	F	74.5	Confident	72.5	Confident	159 Å²	159	74.4 Å²	74.4	70%	0.697	40%	0.399	S	S	*	.	S	Bend	trans	-103	3.1	-178	-73.1	-70.6	0	0	0	113.3	V74 L75	V74-F78 HydrophobicContact CG1-CD2 3.87Å; V74-F78 HydrophobicContact CG1-CE2 3.78Å; V74-F78 WeakPolarHBondContact O-CD2 3.43Å; V74-F78 PolarHBondContact O-N 3.46Å; L75-F78 PolarHBondContact O-N 2.94Å
79	E	68.6	Low	72.5	Confident	113 Å²	113	76 Å²	76	53%	0.528	41%	0.407	S	S	.	.			trans	-80.4	118.6	178	-159.4	159.8	-151.5	0	0	110	L75 A87	L75-E79 PolarHBondContact O-N 2.96Å; L75-E79 VanDerWaalsContact O-N 3.16Å; E79-A87 WeakPolarHBondContact OE2-CB 3.17Å
80	E	59.7	Low	72	Confident	180 Å²	180	77.2 Å²	77.2	84%	0.841	41%	0.412	S	S	*	.			trans	-101.4	110.4	-179.9	-68.1	178.9	162.2	0	0	109.3
81	G	58.7	Low	72	Confident	53 Å²	53	74.1 Å²	74.1	55%	0.546	39%	0.391	S	S	.	.	S	Bend	trans	173.6	177.6	179.7	0	0	0	0	0	116.2	E83	G81-E83 VanDerWaalsContact C-N 3.3Å; G81-E83 PolarHBondContact O-N 2.88Å
82	E	48.9	Very low	72.3	Confident	201 Å²	201	78 Å²	78	94%	0.939	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-15.6	-179.3	-73.7	-172.4	159.3	0	0	114	T84	E82-T84 VanDerWaalsContact C-N 3.34Å; E82-T84 PolarHBondContact O-N 3.09Å
83	E	56.1	Low	72.5	Confident	107 Å²	107	80 Å²	80	50%	0.5	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	28	-178.3	-72.7	-156.8	165.6	0	0	115	G81 T85 T86 A87	G81-E83 VanDerWaalsContact C-N 3.3Å; G81-E83 PolarHBondContact O-N 2.88Å; E83-T85 PolarHBondContact O-N 2.93Å; E83-T86 PolarHBondContact O-N 2.77Å; E83-T86 VanDerWaalsContact O-N 3.14Å; E83-T86 PolarHBondContact O-OG1 3.07Å; E83-T86 VanDerWaalsContact O-OG1 3.12Å; E83-A87 PolarHBondContact O-N 2.94Å
84	T	59.8	Low	72.4	Confident	86 Å²	86	75.6 Å²	75.6	53%	0.528	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-22.5	-178.9	44.4	0	0	0	0	115.1	E82	E82-T84 VanDerWaalsContact C-N 3.34Å; E82-T84 PolarHBondContact O-N 3.09Å
85	T	62	Low	72.7	Confident	121 Å²	121	75.8 Å²	75.8	74%	0.742	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-29	179.7	53.7	0	0	0	0	113.6	E83	E83-T85 PolarHBondContact O-N 2.93Å
86	T	68.3	Low	73.2	Confident	33 Å²	33	79.6 Å²	79.6	20%	0.202	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-24.2	-180	44.5	0	0	0	0	112.8	E83 F88 V89	E83-T86 PolarHBondContact O-N 2.77Å; E83-T86 VanDerWaalsContact O-N 3.14Å; E83-T86 PolarHBondContact O-OG1 3.07Å; E83-T86 VanDerWaalsContact O-OG1 3.12Å; T86-F88 VanDerWaalsContact C-N 3.26Å; T86-F88 PolarHBondContact O-N 3.13Å; T86-V89 VanDerWaalsContact O-CB 3.27Å; T86-V89 WeakPolarHBondContact O-CB 3.27Å; T86-V89 VanDerWaalsContact O-CG2 3.29Å; T86-V89 WeakPolarHBondContact O-CG2 3.45Å; T86-V89 PolarHBondContact O-N 3.27Å
87	A	72.8	Confident	73.4	Confident	20 Å²	20	79.7 Å²	79.7	17%	0.165	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-33.8	178.9	0	0	0	0	0	114.1	A76 E79 E83 V89	A76-A87 HydrophobicContact CB-CB 4.28Å; E79-A87 WeakPolarHBondContact OE2-CB 3.17Å; E83-A87 PolarHBondContact O-N 2.94Å; A87-V89 VanDerWaalsContact C-N 3.32Å; A87-V89 PolarHBondContact O-N 2.98Å
88	F	82.6	Confident	73.8	Confident	65 Å²	65	75 Å²	75	29%	0.285	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.1	178.5	-70	-77.6	0	0	0	114.5	F73 A76 L77 T86 P91 L92	F73-F88 HydrophobicContact CD2-CD1 4.33Å; F73-F88 HydrophobicContact CD2-CE1 4.5Å; F73-F88 HydrophobicContact CE2-CD1 4.05Å; F73-F88 HydrophobicContact CE2-CE1 4.09Å; F73-F88 HydrophobicContact CZ-CE1 4.39Å; A76-F88 HydrophobicContact CB-CD1 4.16Å; A76-F88 HydrophobicContact CB-CE1 4.15Å; L77-F88 HydrophobicContact CD2-CE1 4.16Å; L77-F88 HydrophobicContact CD2-CZ 4.04Å; T86-F88 VanDerWaalsContact C-N 3.26Å; T86-F88 PolarHBondContact O-N 3.13Å; F88-P91 WeakPolarHBondContact O-CD 3.35Å; F88-P91 WeakPolarHBondContact O-CG 3.42Å; F88-L92 HydrophobicContact CB-CD1 4.22Å; F88-L92 VanDerWaalsContact O-CB 3.29Å; F88-L92 WeakPolarHBondContact O-CB 3.35Å; F88-L92 WeakPolarHBondContact O-CD1 3.18Å; F88-L92 VanDerWaalsContact O-CG 3.24Å; F88-L92 WeakPolarHBondContact O-CG 3.41Å; F88-L92 PolarHBondContact O-N 3.46Å
89	V	80.6	Confident	74.4	Confident	37 Å²	37	71.7 Å²	71.7	22%	0.224	39%	0.385	C	S	.	.	H	α-helix	trans	-63.7	-46.5	-178.1	174	0	0	0	0	110.6	T86 A87 L92 V93 I953	T86-V89 VanDerWaalsContact O-CB 3.27Å; T86-V89 WeakPolarHBondContact O-CB 3.27Å; T86-V89 VanDerWaalsContact O-CG2 3.29Å; T86-V89 WeakPolarHBondContact O-CG2 3.45Å; T86-V89 PolarHBondContact O-N 3.27Å; A87-V89 VanDerWaalsContact C-N 3.32Å; A87-V89 PolarHBondContact O-N 2.98Å; V89-L92 PolarHBondContact O-N 3.35Å; V89-V93 HydrophobicContact CG1-CG2 3.99Å; V89-V93 WeakPolarHBondContact O-CB 3.34Å; V89-V93 WeakPolarHBondContact O-CG2 3.46Å; V89-V93 PolarHBondContact O-N 3.3Å; V89-I953 HydrophobicContact CG1-CG2 4.13Å
90	E	75.6	Confident	75.1	Confident	32 Å²	32	68.3 Å²	68.3	15%	0.15	38%	0.376	C	S	.	.	H	α-helix	trans	-56.7	-56.7	-178.7	-172.2	-170	129.4	0	0	113	S72 L92 V93 I94 P786 V787	S72-E90 WeakPolarHBondContact CB-OE1 3.47Å; S72-E90 WeakPolarHBondContact OG-CG 3.41Å; S72-E90 PolarHBondContact OG-OE1 3.18Å; E90-L92 VanDerWaalsContact C-N 3.32Å; E90-L92 PolarHBondContact O-N 2.94Å; E90-V93 PolarHBondContact O-N 3.06Å; E90-I94 HydrophobicContact CG-CD1 4.26Å; E90-I94 WeakPolarHBondContact O-CG1 3.44Å; E90-I94 PolarHBondContact O-N 3.11Å; E90-I94 VanDerWaalsContact O-N 3.14Å; E90-P786 HydrophobicContact CG-CB 4.22Å; E90-V787 HydrophobicContact CB-CG2 4.07Å; E90-V787 HydrophobicContact CG-CG2 4.32Å
91	P	84.9	Confident	75.9	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.032	35%	0.347	C	S	.	.	H	α-helix	trans	-66.7	-31.7	-179.6	25.7	-34.9	0	0	0	113.1	S72 F73 F88 L95	S72-P91 WeakPolarHBondContact OG-CD 3.17Å; F73-P91 HydrophobicContact CB-CB 3.88Å; F73-P91 HydrophobicContact CB-CG 4.39Å; F73-P91 HydrophobicContact CD2-CB 4.1Å; F73-P91 HydrophobicContact CD2-CG 4.17Å; F88-P91 WeakPolarHBondContact O-CD 3.35Å; F88-P91 WeakPolarHBondContact O-CG 3.42Å; P91-L95 WeakPolarHBondContact O-CB 3.15Å; P91-L95 PolarHBondContact O-N 3.2Å
92	L	86.8	Confident	77	Confident	102 Å²	102	59.7 Å²	59.7	53%	0.534	33%	0.325	S	S	.	.	H	α-helix	trans	-68.7	-40.2	176.8	-77.3	172	0	0	0	112.3	F88 V89 E90 L95 L96	F88-L92 HydrophobicContact CB-CD1 4.22Å; F88-L92 VanDerWaalsContact O-CB 3.29Å; F88-L92 WeakPolarHBondContact O-CB 3.35Å; F88-L92 WeakPolarHBondContact O-CD1 3.18Å; F88-L92 VanDerWaalsContact O-CG 3.24Å; F88-L92 WeakPolarHBondContact O-CG 3.41Å; F88-L92 PolarHBondContact O-N 3.46Å; V89-L92 PolarHBondContact O-N 3.35Å; E90-L92 VanDerWaalsContact C-N 3.32Å; E90-L92 PolarHBondContact O-N 2.94Å; L92-L95 PolarHBondContact O-N 3.22Å; L92-L96 VanDerWaalsContact O-CB 3.28Å; L92-L96 WeakPolarHBondContact O-CB 3.46Å; L92-L96 PolarHBondContact O-N 3.24Å
93	V	83.3	Confident	78.7	Confident	48 Å²	48	54.5 Å²	54.5	29%	0.291	31%	0.307	S	S	.	.	H	α-helix	trans	-66.4	-44.5	177.7	173	0	0	0	0	110.3	V89 E90 L95 L96 I97 L790	V89-V93 HydrophobicContact CG1-CG2 3.99Å; V89-V93 WeakPolarHBondContact O-CB 3.34Å; V89-V93 WeakPolarHBondContact O-CG2 3.46Å; V89-V93 PolarHBondContact O-N 3.3Å; E90-V93 PolarHBondContact O-N 3.06Å; V93-L95 PolarHBondContact O-N 3.49Å; V93-L96 PolarHBondContact O-N 3.3Å; V93-I97 HydrophobicContact CG1-CD1 4.11Å; V93-I97 WeakPolarHBondContact O-CG1 3.41Å; V93-I97 PolarHBondContact O-N 2.84Å; V93-L790 HydrophobicContact CG1-CD1 3.9Å
94	I	83.3	Confident	79.6	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-46.6	176.5	-60	167.2	0	0	0	110.3	L65 A69 E90 L96 I97 L98 V304 L790	L65-I94 HydrophobicContact CD2-CG2 4.35Å; A69-I94 HydrophobicContact CB-CB 4.12Å; A69-I94 HydrophobicContact CB-CG2 3.7Å; E90-I94 HydrophobicContact CG-CD1 4.26Å; E90-I94 WeakPolarHBondContact O-CG1 3.44Å; E90-I94 PolarHBondContact O-N 3.11Å; E90-I94 VanDerWaalsContact O-N 3.14Å; I94-L96 VanDerWaalsContact C-N 3.34Å; I94-L96 PolarHBondContact O-N 3.27Å; I94-I97 PolarHBondContact O-N 2.99Å; I94-L98 WeakPolarHBondContact O-CG 3.39Å; I94-L98 PolarHBondContact O-N 3.49Å; I94-V304 HydrophobicContact CD1-CG2 4.41Å; I94-L790 HydrophobicContact CG1-CD1 3.89Å
95	L	87.9	Confident	80.1	Confident	76 Å²	76	49 Å²	49	40%	0.398	28%	0.279	S	S	.	.	H	α-helix	trans	-62.6	-40.1	178.6	-171	71.5	0	0	0	112.2	P91 L92 V93 I97 L98 I99	P91-L95 WeakPolarHBondContact O-CB 3.15Å; P91-L95 PolarHBondContact O-N 3.2Å; L92-L95 PolarHBondContact O-N 3.22Å; V93-L95 PolarHBondContact O-N 3.49Å; L95-I97 VanDerWaalsContact C-N 3.33Å; L95-I97 PolarHBondContact O-N 3.2Å; L95-L98 PolarHBondContact O-N 2.82Å; L95-I99 HydrophobicContact CG-CD1 4.09Å; L95-I99 VanDerWaalsContact O-CG1 3.32Å; L95-I99 WeakPolarHBondContact O-CG1 3.38Å; L95-I99 PolarHBondContact O-N 3.14Å
96	L	87.1	Confident	80.9	Confident	116 Å²	116	44.1 Å²	44.1	61%	0.607	25%	0.249	S	C	*	.	H	α-helix	trans	-61.6	-42.1	177.2	-176.4	151.2	0	0	0	111.4	L92 V93 I94 I99 A100	L92-L96 VanDerWaalsContact O-CB 3.28Å; L92-L96 WeakPolarHBondContact O-CB 3.46Å; L92-L96 PolarHBondContact O-N 3.24Å; V93-L96 PolarHBondContact O-N 3.3Å; I94-L96 VanDerWaalsContact C-N 3.34Å; I94-L96 PolarHBondContact O-N 3.27Å; L96-I99 PolarHBondContact O-N 3.48Å; L96-A100 WeakPolarHBondContact O-CB 3.39Å; L96-A100 PolarHBondContact O-N 3.21Å
97	I	82.6	Confident	81	Confident	12 Å²	12	50.9 Å²	50.9	6%	0.062	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-45.2	176.3	-69.1	169.6	0	0	0	110.5	V93 I94 L95 I99 A100 N101 E309 L790 L794	V93-I97 HydrophobicContact CG1-CD1 4.11Å; V93-I97 WeakPolarHBondContact O-CG1 3.41Å; V93-I97 PolarHBondContact O-N 2.84Å; I94-I97 PolarHBondContact O-N 2.99Å; L95-I97 VanDerWaalsContact C-N 3.33Å; L95-I97 PolarHBondContact O-N 3.2Å; I97-I99 VanDerWaalsContact C-N 3.33Å; I97-I99 PolarHBondContact O-N 3.1Å; I97-A100 PolarHBondContact O-N 3.24Å; I97-N101 WeakPolarHBondContact O-CB 3.39Å; I97-N101 PolarHBondContact O-N 3.04Å; I97-E309 HydrophobicContact CG2-CB 4.44Å; I97-L790 HydrophobicContact CD1-CB 4.49Å; I97-L790 HydrophobicContact CD1-CD1 4.42Å; I97-L790 HydrophobicContact CD1-CD2 3.89Å; I97-L794 HydrophobicContact CD1-CD2 4.38Å; I97-L794 HydrophobicContact CG1-CD2 4.41Å
98	L	84.9	Confident	80.5	Confident	6 Å²	6	53.3 Å²	53.3	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-60.1	-42.8	177.2	-69.8	-177.5	0	0	0	112.2	F57 V62 L65 L66 I94 L95 A102	F57-L98 HydrophobicContact CE1-CB 4.18Å; V62-L98 HydrophobicContact CG1-CD2 3.96Å; L65-L98 HydrophobicContact CB-CD1 4.48Å; L65-L98 HydrophobicContact CB-CD2 3.99Å; L65-L98 HydrophobicContact CD1-CD2 4.28Å; L66-L98 HydrophobicContact CB-CD1 4.06Å; L66-L98 HydrophobicContact CD1-CD1 3.93Å; I94-L98 WeakPolarHBondContact O-CG 3.39Å; I94-L98 PolarHBondContact O-N 3.49Å; L95-L98 PolarHBondContact O-N 2.82Å; L98-A102 WeakPolarHBondContact O-CB 3.46Å; L98-A102 PolarHBondContact O-N 3.27Å
99	I	87.9	Confident	79.6	Confident	91 Å²	91	53.6 Å²	53.6	47%	0.467	28%	0.281	S	S	.	.	H	α-helix	trans	-64.4	-46.3	175.9	-68.6	167.5	0	0	0	110.7	L95 L96 I97 N101 A102 V103	L95-I99 HydrophobicContact CG-CD1 4.09Å; L95-I99 VanDerWaalsContact O-CG1 3.32Å; L95-I99 WeakPolarHBondContact O-CG1 3.38Å; L95-I99 PolarHBondContact O-N 3.14Å; L96-I99 PolarHBondContact O-N 3.48Å; I97-I99 VanDerWaalsContact C-N 3.33Å; I97-I99 PolarHBondContact O-N 3.1Å; I99-N101 VanDerWaalsContact C-N 3.34Å; I99-N101 PolarHBondContact O-N 2.87Å; I99-A102 PolarHBondContact O-N 3Å; I99-V103 HydrophobicContact CG2-CG2 4.33Å; I99-V103 VanDerWaalsContact O-CG2 3.29Å; I99-V103 WeakPolarHBondContact O-CG2 3.34Å; I99-V103 PolarHBondContact O-N 2.79Å
100	A	82.6	Confident	78.8	Confident	41 Å²	41	59.5 Å²	59.5	34%	0.339	30%	0.299	S	S	.	.	H	α-helix	trans	-60.3	-44.7	179.2	0	0	0	0	0	111.4	L96 I97 V103 I104	L96-A100 WeakPolarHBondContact O-CB 3.39Å; L96-A100 PolarHBondContact O-N 3.21Å; I97-A100 PolarHBondContact O-N 3.24Å; A100-V103 PolarHBondContact O-N 2.82Å; A100-I104 VanDerWaalsContact O-CG1 3.28Å; A100-I104 WeakPolarHBondContact O-CG1 3.35Å; A100-I104 PolarHBondContact O-N 3.32Å
101	N	77.1	Confident	77.8	Confident	42 Å²	42	62.8 Å²	62.8	23%	0.225	32%	0.318	C	S	.	.	H	α-helix	trans	-62.6	-44.9	176.7	-74.9	-10.6	0	0	0	111.7	I97 I99 V103 I104 G105	I97-N101 WeakPolarHBondContact O-CB 3.39Å; I97-N101 PolarHBondContact O-N 3.04Å; I99-N101 VanDerWaalsContact C-N 3.34Å; I99-N101 PolarHBondContact O-N 2.87Å; N101-V103 PolarHBondContact O-N 2.63Å; N101-I104 PolarHBondContact O-N 2.69Å; N101-G105 PolarHBondContact O-N 2.78Å
102	A	83.1	Confident	76.2	Confident	11 Å²	11	65.4 Å²	65.4	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-41.5	177.1	0	0	0	0	0	112.3	Q56 F57 L98 I99 G105 V106	Q56-A102 HydrophobicContact CB-CB 4.05Å; Q56-A102 HydrophobicContact CG-CB 4.41Å; F57-A102 HydrophobicContact CE2-CB 3.88Å; F57-A102 HydrophobicContact CZ-CB 4.12Å; L98-A102 WeakPolarHBondContact O-CB 3.46Å; L98-A102 PolarHBondContact O-N 3.27Å; I99-A102 PolarHBondContact O-N 3Å; A102-G105 PolarHBondContact O-N 3.31Å; A102-V106 VanDerWaalsContact O-CG2 3.29Å; A102-V106 WeakPolarHBondContact O-CG2 3.47Å; A102-V106 PolarHBondContact O-N 3.27Å
103	V	84.1	Confident	74.6	Confident	92 Å²	92	64.9 Å²	64.9	56%	0.558	34%	0.335	S	S	*	.	H	α-helix	trans	-63.1	-44.5	176.5	169.4	0	0	0	0	111.2	I99 A100 N101 W107	I99-V103 HydrophobicContact CG2-CG2 4.33Å; I99-V103 VanDerWaalsContact O-CG2 3.29Å; I99-V103 WeakPolarHBondContact O-CG2 3.34Å; I99-V103 PolarHBondContact O-N 2.79Å; A100-V103 PolarHBondContact O-N 2.82Å; N101-V103 PolarHBondContact O-N 2.63Å; V103-W107 VanDerWaalsContact O-CB 3.28Å; V103-W107 WeakPolarHBondContact O-CB 3.25Å; V103-W107 PolarHBondContact O-N 3.4Å
104	I	74.1	Confident	73.2	Confident	66 Å²	66	65.8 Å²	65.8	34%	0.338	34%	0.343	S	S	.	.	H	α-helix	trans	-62	-44.9	176.4	-68.9	167.6	0	0	0	110.1	A100 N101 W107 Q108	A100-I104 VanDerWaalsContact O-CG1 3.28Å; A100-I104 WeakPolarHBondContact O-CG1 3.35Å; A100-I104 PolarHBondContact O-N 3.32Å; N101-I104 PolarHBondContact O-N 2.69Å; I104-W107 PolarHBondContact O-N 3Å; I104-Q108 VanDerWaalsContact O-CG 3.28Å; I104-Q108 WeakPolarHBondContact O-CG 3.34Å; I104-Q108 PolarHBondContact O-N 2.89Å; I104-Q108 VanDerWaalsContact O-N 3.13Å
105	G	71.5	Confident	71.5	Confident	10 Å²	10	66.5 Å²	66.5	10%	0.103	35%	0.349	C	S	.	.	H	α-helix	trans	-59.5	-52.1	177.7	0	0	0	0	0	113	N101 A102 W107 Q108 E109	N101-G105 PolarHBondContact O-N 2.78Å; A102-G105 PolarHBondContact O-N 3.31Å; G105-W107 VanDerWaalsContact C-N 3.32Å; G105-W107 PolarHBondContact O-N 3.21Å; G105-Q108 WeakPolarHBondContact O-CB 3.09Å; G105-Q108 PolarHBondContact O-N 3.05Å; G105-Q108 VanDerWaalsContact O-N 3.15Å; G105-E109 PolarHBondContact O-N 2.84Å; G105-E109 VanDerWaalsContact O-N 3.17Å
106	V	77	Confident	69.8	Low	19 Å²	19	65 Å²	65	12%	0.115	34%	0.341	C	S	.	.	H	α-helix	trans	-62.8	-38.1	179.4	174	0	0	0	0	112	L49 L52 V53 Q56 A102 Q108 E109 R110	L49-V106 HydrophobicContact CD2-CG1 4.28Å; L52-V106 HydrophobicContact CB-CG1 4.34Å; L52-V106 HydrophobicContact CB-CG2 4.16Å; V53-V106 HydrophobicContact CB-CG2 4.49Å; V53-V106 HydrophobicContact CG2-CG2 3.8Å; Q56-V106 HydrophobicContact CG-CG2 4.14Å; A102-V106 VanDerWaalsContact O-CG2 3.29Å; A102-V106 WeakPolarHBondContact O-CG2 3.47Å; A102-V106 PolarHBondContact O-N 3.27Å; V106-Q108 VanDerWaalsContact C-N 3.3Å; V106-Q108 PolarHBondContact O-N 3.07Å; V106-E109 PolarHBondContact O-N 2.91Å; V106-R110 PolarHBondContact O-N 3.38Å
107	W	70.9	Confident	68.5	Low	175 Å²	175	66.2 Å²	66.2	66%	0.663	34%	0.344	S	S	*	.	H	α-helix	trans	-65.1	-34.4	177.8	-178.6	58.8	0	0	0	112.6	V103 I104 G105 N111	V103-W107 VanDerWaalsContact O-CB 3.28Å; V103-W107 WeakPolarHBondContact O-CB 3.25Å; V103-W107 PolarHBondContact O-N 3.4Å; I104-W107 PolarHBondContact O-N 3Å; G105-W107 VanDerWaalsContact C-N 3.32Å; G105-W107 PolarHBondContact O-N 3.21Å; W107-N111 PolarHBondContact O-ND2 2.8Å
108	Q	63	Low	67.5	Low	72 Å²	72	66.4 Å²	66.4	34%	0.336	35%	0.347	S	S	.	.	H	α-helix	trans	-68.2	-45.5	176	-71.1	173	12.7	0	0	111.7	I104 G105 V106 N111 T316	I104-Q108 VanDerWaalsContact O-CG 3.28Å; I104-Q108 WeakPolarHBondContact O-CG 3.34Å; I104-Q108 PolarHBondContact O-N 2.89Å; I104-Q108 VanDerWaalsContact O-N 3.13Å; G105-Q108 WeakPolarHBondContact O-CB 3.09Å; G105-Q108 PolarHBondContact O-N 3.05Å; G105-Q108 VanDerWaalsContact O-N 3.15Å; V106-Q108 VanDerWaalsContact C-N 3.3Å; V106-Q108 PolarHBondContact O-N 3.07Å; Q108-N111 PolarHBondContact O-N 2.94Å; Q108-T316 PolarHBondContact NE2-OG1 3.26Å
109	E	63.3	Low	66	Low	71 Å²	71	66.5 Å²	66.5	33%	0.332	35%	0.348	S	S	.	.	H	α-helix	trans	-69.3	-38	-173	-159.5	147.5	-163.4	0	0	112.4	L52 G105 V106 N111 A112	L52-E109 HydrophobicContact CD2-CB 4.34Å; L52-E109 HydrophobicContact CD2-CG 3.8Å; G105-E109 PolarHBondContact O-N 2.84Å; G105-E109 VanDerWaalsContact O-N 3.17Å; V106-E109 PolarHBondContact O-N 2.91Å; E109-N111 VanDerWaalsContact C-N 3.27Å; E109-N111 PolarHBondContact O-N 2.95Å; E109-A112 WeakPolarHBondContact O-CB 3.37Å; E109-A112 PolarHBondContact O-N 3.4Å; E109-A112 VanDerWaalsContact O-N 3.09Å
110	R	64.5	Low	64.7	Low	161 Å²	161	66.7 Å²	66.7	61%	0.608	35%	0.345	S	S	*	.	H	α-helix	trans	-61.3	-30.6	178.1	-173.5	177.9	175.2	177.8	-0.5	114	V106 A112	V106-R110 PolarHBondContact O-N 3.38Å; R110-A112 VanDerWaalsContact C-N 3.26Å; R110-A112 PolarHBondContact O-N 3.16Å
111	N	54.2	Low	63.8	Low	101 Å²	101	71.5 Å²	71.5	54%	0.54	36%	0.361	S	S	.	.	H	α-helix	trans	-73.7	-18.9	179.9	-72.1	-34	0	0	0	112.6	W107 Q108 E109	W107-N111 PolarHBondContact O-ND2 2.8Å; Q108-N111 PolarHBondContact O-N 2.94Å; E109-N111 VanDerWaalsContact C-N 3.27Å; E109-N111 PolarHBondContact O-N 2.95Å
112	A	50.7	Low	63	Low	60 Å²	60	71.5 Å²	71.5	50%	0.496	36%	0.358	S	S	.	.	H	α-helix	trans	-81.9	-33.5	-177.9	0	0	0	0	0	113.7	E109 R110 S114	E109-A112 WeakPolarHBondContact O-CB 3.37Å; E109-A112 PolarHBondContact O-N 3.4Å; E109-A112 VanDerWaalsContact O-N 3.09Å; R110-A112 VanDerWaalsContact C-N 3.26Å; R110-A112 PolarHBondContact O-N 3.16Å; A112-S114 VanDerWaalsContact C-N 3.3Å; A112-S114 PolarHBondContact O-N 2.91Å
113	E	53.3	Low	62.2	Low	91 Å²	91	74.1 Å²	74.1	43%	0.425	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-71.2	-10.1	-170.5	-75.9	-173.5	152.2	0	0	116	A115	E113-A115 PolarHBondContact O-N 3.11Å
114	S	53.3	Low	61.6	Low	67 Å²	67	70.8 Å²	70.8	47%	0.469	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-64.8	-1.8	-176.6	60.9	0	0	0	0	115.6	A112	A112-S114 VanDerWaalsContact C-N 3.3Å; A112-S114 PolarHBondContact O-N 2.91Å
115	A	48.4	Very low	61.8	Low	16 Å²	16	75.4 Å²	75.4	13%	0.132	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-76.1	-32.6	-166.7	0	0	0	0	0	115.7	E113 S726	E113-A115 PolarHBondContact O-N 3.11Å; A115-S726 WeakPolarHBondContact CB-O 3.29Å; A115-S726 WeakPolarHBondContact O-CB 3.2Å; A115-S726 PolarHBondContact O-OG 3.48Å
116	I	52.1	Low	62.7	Low	44 Å²	44	77.6 Å²	77.6	23%	0.226	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-20.6	-169.9	-69	171	0	0	0	111.7	E44 A118 L119	E44-I116 WeakPolarHBondContact OE2-CD1 3.35Å; I116-A118 VanDerWaalsContact C-N 3.28Å; I116-A118 PolarHBondContact O-N 3.35Å; I116-L119 PolarHBondContact O-N 2.91Å
117	E	60.5	Low	63.4	Low	142 Å²	142	77 Å²	77	66%	0.664	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-64.9	-29.8	172.9	-67.4	-168.9	149.9	0	0	113	L119 K120	E117-L119 PolarHBondContact O-N 2.99Å; E117-K120 WeakPolarHBondContact O-CB 3.32Å; E117-K120 PolarHBondContact O-N 3.18Å
118	A	60.1	Low	64.5	Low	16 Å²	16	70.8 Å²	70.8	13%	0.132	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-64	-23	-179.7	0	0	0	0	0	113.9	I116 K120 E121 Y122 A722	I116-A118 VanDerWaalsContact C-N 3.28Å; I116-A118 PolarHBondContact O-N 3.35Å; A118-K120 VanDerWaalsContact C-N 3.31Å; A118-K120 PolarHBondContact O-N 3.38Å; A118-E121 PolarHBondContact O-N 3Å; A118-Y122 WeakPolarHBondContact O-CD2 3.46Å; A118-A722 HydrophobicContact CB-CB 4.24Å
119	L	54.8	Low	66	Low	8 Å²	8	67.4 Å²	67.4	4%	0.042	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-67.7	-31	174.7	-84.2	162.4	0	0	0	112.3	I116 E117 E121 Y122 M239 V702 V723	I116-L119 PolarHBondContact O-N 2.91Å; E117-L119 PolarHBondContact O-N 2.99Å; L119-E121 VanDerWaalsContact C-N 3.25Å; L119-E121 PolarHBondContact O-N 2.84Å; L119-Y122 PolarHBondContact O-N 2.94Å; L119-M239 HydrophobicContact CD1-CE 4.32Å; L119-M239 HydrophobicContact CD1-SD 4.07Å; L119-V702 HydrophobicContact CD2-CG1 4.27Å; L119-V723 HydrophobicContact CD1-CG1 4.46Å; L119-V723 HydrophobicContact CD2-CB 4.2Å; L119-V723 HydrophobicContact CD2-CG1 3.5Å; L119-V723 HydrophobicContact CD2-CG2 3.56Å; L119-V723 HydrophobicContact CG-CB 4.49Å; L119-V723 HydrophobicContact CG-CG1 3.82Å; L119-V723 HydrophobicContact CG-CG2 3.89Å
120	K	60.7	Low	67.5	Low	96 Å²	96	65.9 Å²	65.9	42%	0.417	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-68.8	-23.5	-179.1	-67.2	-178.7	178	173.2	0	112.7	E117 A118 Y122 E123	E117-K120 WeakPolarHBondContact O-CB 3.32Å; E117-K120 PolarHBondContact O-N 3.18Å; A118-K120 VanDerWaalsContact C-N 3.31Å; A118-K120 PolarHBondContact O-N 3.38Å; K120-Y122 PolarHBondContact O-N 2.99Å; K120-Y122 VanDerWaalsContact O-N 3.15Å; K120-E123 PolarHBondContact O-N 2.8Å
121	E	64.3	Low	68.8	Low	142 Å²	142	59.2 Å²	59.2	66%	0.664	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-64.1	-17	175.5	-64.9	-172.2	161.4	0	0	113.1	A118 L119	A118-E121 PolarHBondContact O-N 3Å; L119-E121 VanDerWaalsContact C-N 3.25Å; L119-E121 PolarHBondContact O-N 2.84Å
122	Y	59.9	Low	70.6	Confident	41 Å²	41	59.8 Å²	59.8	16%	0.161	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-92	-12	-179.5	-66.8	-88	0	0	0	113.9	A118 L119 K120 K158 A722 V723	A118-Y122 WeakPolarHBondContact O-CD2 3.46Å; L119-Y122 PolarHBondContact O-N 2.94Å; K120-Y122 PolarHBondContact O-N 2.99Å; K120-Y122 VanDerWaalsContact O-N 3.15Å; Y122-K158 WeakPolarHBondContact O-CD 3.49Å; Y122-K158 PolarHBondContact O-NZ 3.47Å; Y122-A722 HydrophobicContact CE2-CB 4.45Å; Y122-A722 PolarHBondContact OH-N 2.76Å; Y122-V723 HydrophobicContact CD2-CG2 3.75Å; Y122-V723 HydrophobicContact CE2-CG2 3.46Å; Y122-V723 VanDerWaalsContact CE2-CG2 3.46Å
123	E	65.5	Low	72.4	Confident	66 Å²	66	60.3 Å²	60.3	31%	0.308	30%	0.298	S	S	.	.	S	Bend	trans	-75.5	125.2	171.9	-66.8	-174.2	162.9	0	0	109.6	L41 K120	L41-E123 WeakPolarHBondContact CB-OE1 3.36Å; L41-E123 WeakPolarHBondContact CG-OE1 3.49Å; L41-E123 PolarHBondContact N-OE1 2.8Å; K120-E123 PolarHBondContact O-N 2.8Å
124	P	70.8	Confident	74	Confident	22 Å²	22	63.3 Å²	63.3	14%	0.143	31%	0.305	C	S	.	.			trans	-67	138.4	172.8	27.1	-30.5	0	0	0	109.5	M126 A142 K158 P160	P124-M126 PolarHBondContact O-N 3.44Å; P124-A142 HydrophobicContact CG-CB 4.19Å; P124-A142 WeakPolarHBondContact O-CB 3.42Å; P124-K158 HydrophobicContact CB-CB 4.26Å; P124-P160 HydrophobicContact CG-CB 3.88Å
125	E	79.9	Confident	75.3	Confident	164 Å²	164	70.5 Å²	70.5	77%	0.766	33%	0.328	S	S	*	.	S	Bend	trans	-63.7	-30.3	176.3	-166.1	-176.8	175.2	0	0	111.7	K141 A142	E125-K141 WeakPolarHBondContact O-CA 3.19Å; E125-A142 PolarHBondContact O-N 2.87Å; E125-A142 VanDerWaalsContact O-N 3.09Å
126	M	88.9	Confident	77	Confident	56 Å²	56	73 Å²	73	28%	0.276	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150.1	-173.1	-57.2	-67	-73.1	0	0	112.5	P124 R139 I140 K141	P124-M126 PolarHBondContact O-N 3.44Å; M126-R139 HydrophobicContact CB-CG 4.01Å; M126-R139 HydrophobicContact CE-CG 3.96Å; M126-I140 CarbonylContact C-O 3.57Å; M126-I140 WeakPolarHBondContact CA-O 3.47Å; M126-I140 VanDerWaalsContact CE-C 3.46Å; M126-I140 WeakPolarHBondContact CE-O 3.37Å; M126-K141 HydrophobicContact SD-CB 4.43Å; M126-K141 HydrophobicContact SD-CG 3.94Å
127	G	91.5	Very high	78.8	Confident	7 Å²	7	73.8 Å²	73.8	7%	0.072	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	167.1	170.2	0	0	0	0	0	112.5	R139 I140	G127-R139 CarbonylContact O-C 3.55Å; G127-R139 VanDerWaalsContact O-CA 3.32Å; G127-R139 WeakPolarHBondContact O-CA 3.34Å; G127-I140 PolarHBondContact N-O 3.17Å; G127-I140 PolarHBondContact O-N 3.19Å
128	K	94.8	Very high	80.3	Confident	44 Å²	44	67.9 Å²	67.9	19%	0.191	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	125.3	-177.5	-72	177.9	-71	179.3	0	110.9	V137 Q138 V151 E152 D157	K128-V137 HydrophobicContact CB-CG2 3.83Å; K128-V137 HydrophobicContact CG-CG2 4.38Å; K128-Q138 CarbonylContact C-O 3.57Å; K128-Q138 VanDerWaalsContact CA-O 3.32Å; K128-Q138 WeakPolarHBondContact CA-O 3.18Å; K128-V151 VanDerWaalsContact O-CA 3.28Å; K128-V151 WeakPolarHBondContact O-CA 3.37Å; K128-E152 HydrophobicContact CB-CB 4.34Å; K128-E152 WeakPolarHBondContact CB-O 3.3Å; K128-E152 WeakPolarHBondContact CE-O 3.48Å; K128-E152 PolarHBondContact O-N 2.95Å; K128-D157 WeakPolarHBondContact CE-OD2 3.2Å; K128-D157 IonicContact NZ-OD1 3.59Å; K128-D157 IonicContact NZ-OD2 3.53Å; K128-D157 PolarHBondContact NZ-OD2 2.62Å
129	V	95.7	Very high	81.8	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	154.4	-176.6	-49.9	0	0	0	0	112.4	R131 Q138 I140 I145 I150 V151	V129-R131 HydrophobicContact CG2-CG 4.01Å; V129-Q138 HydrophobicContact CG2-CB 4.23Å; V129-Q138 PolarHBondContact N-O 3.26Å; V129-Q138 PolarHBondContact O-N 3.38Å; V129-I140 HydrophobicContact CB-CD1 4.48Å; V129-I140 HydrophobicContact CG1-CD1 3.79Å; V129-I140 HydrophobicContact CG1-CG1 4.01Å; V129-I140 HydrophobicContact CG2-CD1 3.78Å; V129-I140 HydrophobicContact CG2-CG1 4.07Å; V129-I140 HydrophobicContact CG2-CG2 4.41Å; V129-I145 HydrophobicContact CG1-CD1 4.2Å; V129-I145 HydrophobicContact CG1-CG1 3.96Å; V129-I150 CarbonylContact C-O 3.53Å; V129-I150 VanDerWaalsContact CA-O 3.24Å; V129-I150 WeakPolarHBondContact CA-O 3.16Å; V129-V151 HydrophobicContact CG1-CG1 4.09Å
130	Y	93.6	Very high	83.7	Confident	39 Å²	39	76.7 Å²	76.7	15%	0.153	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128	161.9	-66	-84.3	0	0	0	108.7	G23 V137 I150 E152 I220	G23-Y130 WeakPolarHBondContact CA-O 3.32Å; Y130-V137 HydrophobicContact CD1-CB 4.46Å; Y130-V137 HydrophobicContact CE1-CB 3.88Å; Y130-V137 HydrophobicContact CE1-CG2 4.47Å; Y130-V137 HydrophobicContact CE2-CG2 4.35Å; Y130-I150 HydrophobicContact CD2-CG2 4.08Å; Y130-I150 PolarHBondContact N-O 2.68Å; Y130-E152 HydrophobicContact CE2-CB 4.01Å; Y130-E152 PolarHBondContact OH-OE2 2.63Å; Y130-I220 HydrophobicContact CE2-CD1 4.3Å
131	R	93.1	Very high	85.2	Confident	22 Å²	22	77.6 Å²	77.6	8%	0.083	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-138.9	148.2	177.3	-72.3	179.7	176.5	172.5	1.2	108.9	T22 L24 V129 D133 R134 D144 D149	T22-R131 CarbonylContact O-C 3.54Å; T22-R131 WeakPolarHBondContact O-CA 3.35Å; L24-R131 WeakPolarHBondContact O-CA 3.36Å; V129-R131 HydrophobicContact CG2-CG 4.01Å; R131-D133 WeakPolarHBondContact CB-OD1 3.33Å; R131-D133 PolarHBondContact O-N 2.93Å; R131-R134 PolarHBondContact O-N 2.92Å; R131-R134 VanDerWaalsContact O-N 3.11Å; R131-D144 PolarHBondContact NH2-O 3.38Å; R131-D149 IonicContact CZ-OD1 2.71Å; R131-D149 IonicContact CZ-OD2 3.75Å; R131-D149 IonicContact NE-OD1 3.58Å; R131-D149 PolarHBondContact NE-OD1 3.26Å; R131-D149 IonicContact NE-OD2 3.04Å; R131-D149 IonicContact NH2-OD1 2.7Å; R131-D149 IonicContact NH2-OD2 3.54Å; R131-D149 PolarHBondContact NH2-OD2 3.38Å
132	M	90.9	Very high	86.5	Confident	112 Å²	112	71.1 Å²	71.1	55%	0.552	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.5	-169.6	-87.5	-175.1	72.9	0	0	114.3	T22 L24 T25 R134	T22-M132 WeakPolarHBondContact O-CA 3.42Å; T22-M132 PolarHBondContact O-N 3.2Å; L24-M132 PolarHBondContact O-N 3.07Å; T25-M132 HydrophobicContact CG2-CB 4.42Å; T25-M132 HydrophobicContact CG2-CE 4.38Å; T25-M132 HydrophobicContact CG2-CG 4.44Å; T25-M132 HydrophobicContact CG2-SD 3.45Å; T25-M132 WeakPolarHBondContact CG2-SD 3.32Å; M132-R134 PolarHBondContact O-N 2.96Å
133	D	88	Confident	88.1	Confident	71 Å²	71	74.7 Å²	74.7	38%	0.38	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-19.6	178.8	70.6	-54.2	0	0	0	112.9	L26 R131 Q138	L26-D133 HydrophobicContact CD1-CB 4.1Å; L26-D133 HydrophobicContact CG-CB 4.24Å; R131-D133 WeakPolarHBondContact CB-OD1 3.33Å; R131-D133 PolarHBondContact O-N 2.93Å; D133-Q138 VanDerWaalsContact CG-NE2 3.35Å; D133-Q138 PolarHBondContact OD1-NE2 2.75Å; D133-Q138 PolarHBondContact OD2-NE2 3.43Å
134	R	86.5	Confident	89.5	Confident	155 Å²	155	74.2 Å²	74.2	59%	0.585	35%	0.346	S	S	*	.			trans	-140	144.1	174.9	-51.8	-177.9	-163.9	-175.8	-5.1	112.6	R131 M132 Q138	R131-R134 PolarHBondContact O-N 2.92Å; R131-R134 VanDerWaalsContact O-N 3.11Å; M132-R134 PolarHBondContact O-N 2.96Å; R134-Q138 HydrophobicContact CB-CG 4.23Å; R134-Q138 VanDerWaalsContact CB-NE2 3.27Å; R134-Q138 VanDerWaalsContact CD-CD 3.45Å; R134-Q138 HydrophobicContact CG-CG 4.42Å
135	K	80.8	Confident	90.7	Very high	218 Å²	218	73.2 Å²	73.2	95%	0.948	34%	0.339	S	S	*	.	S	Bend	trans	-74.3	-28.1	174.7	-77.2	-175.1	174.8	-179.4	0	114.2
136	A	85.3	Confident	91.5	Very high	69 Å²	69	65.4 Å²	65.4	57%	0.57	30%	0.303	S	S	*	.	S	Bend	trans	-91.9	153.6	-179.4	0	0	0	0	0	110.9	Q138	A136-Q138 PolarHBondContact O-N 2.92Å
137	V	89.9	Confident	91.9	Very high	59 Å²	59	62.9 Å²	62.9	36%	0.358	29%	0.291	S	S	.	.			trans	-56.7	134.7	174	67.7	0	0	0	0	110.2	K128 Y130 E152	K128-V137 HydrophobicContact CB-CG2 3.83Å; K128-V137 HydrophobicContact CG-CG2 4.38Å; Y130-V137 HydrophobicContact CD1-CB 4.46Å; Y130-V137 HydrophobicContact CE1-CB 3.88Å; Y130-V137 HydrophobicContact CE1-CG2 4.47Å; Y130-V137 HydrophobicContact CE2-CG2 4.35Å; V137-E152 HydrophobicContact CG2-CB 4.41Å
138	Q	91.4	Very high	92	Very high	18 Å²	18	62.5 Å²	62.5	8%	0.084	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.1	-179.5	-49.3	-171.8	29.6	0	0	109.6	K128 V129 D133 R134 A136 I140	K128-Q138 CarbonylContact C-O 3.57Å; K128-Q138 VanDerWaalsContact CA-O 3.32Å; K128-Q138 WeakPolarHBondContact CA-O 3.18Å; V129-Q138 HydrophobicContact CG2-CB 4.23Å; V129-Q138 PolarHBondContact N-O 3.26Å; V129-Q138 PolarHBondContact O-N 3.38Å; D133-Q138 VanDerWaalsContact CG-NE2 3.35Å; D133-Q138 PolarHBondContact OD1-NE2 2.75Å; D133-Q138 PolarHBondContact OD2-NE2 3.43Å; R134-Q138 HydrophobicContact CB-CG 4.23Å; R134-Q138 VanDerWaalsContact CB-NE2 3.27Å; R134-Q138 VanDerWaalsContact CD-CD 3.45Å; R134-Q138 HydrophobicContact CG-CG 4.42Å; A136-Q138 PolarHBondContact O-N 2.92Å; Q138-I140 HydrophobicContact CB-CG2 4.36Å
139	R	91.8	Very high	92.1	Very high	185 Å²	185	60.4 Å²	60.4	70%	0.698	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	114	171.3	-168.4	177.2	166.9	-168	-5.3	108.6	M126 G127	M126-R139 HydrophobicContact CB-CG 4.01Å; M126-R139 HydrophobicContact CE-CG 3.96Å; G127-R139 CarbonylContact O-C 3.55Å; G127-R139 VanDerWaalsContact O-CA 3.32Å; G127-R139 WeakPolarHBondContact O-CA 3.34Å
140	I	93.8	Very high	92.2	Very high	25 Å²	25	60.4 Å²	60.4	13%	0.128	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	169.4	-177.5	63.5	168.8	0	0	0	110.3	M126 G127 V129 Q138 D144 I145	M126-I140 CarbonylContact C-O 3.57Å; M126-I140 WeakPolarHBondContact CA-O 3.47Å; M126-I140 VanDerWaalsContact CE-C 3.46Å; M126-I140 WeakPolarHBondContact CE-O 3.37Å; G127-I140 PolarHBondContact N-O 3.17Å; G127-I140 PolarHBondContact O-N 3.19Å; V129-I140 HydrophobicContact CB-CD1 4.48Å; V129-I140 HydrophobicContact CG1-CD1 3.79Å; V129-I140 HydrophobicContact CG1-CG1 4.01Å; V129-I140 HydrophobicContact CG2-CD1 3.78Å; V129-I140 HydrophobicContact CG2-CG1 4.07Å; V129-I140 HydrophobicContact CG2-CG2 4.41Å; Q138-I140 HydrophobicContact CB-CG2 4.36Å; I140-D144 HydrophobicContact CD1-CB 4.37Å; I140-I145 HydrophobicContact CD1-CG1 3.97Å; I140-I145 HydrophobicContact CG1-CG1 4.26Å
141	K	92.9	Very high	92.3	Very high	115 Å²	115	58.7 Å²	58.7	50%	0.5	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	139.5	173.7	-63.8	-176.3	175.4	-174.4	0	109.9	E125 M126 R143 D144	E125-K141 WeakPolarHBondContact O-CA 3.19Å; M126-K141 HydrophobicContact SD-CB 4.43Å; M126-K141 HydrophobicContact SD-CG 3.94Å; K141-R143 HydrophobicContact CB-CG 3.88Å; K141-R143 PolarHBondContact O-N 3.42Å; K141-D144 PolarHBondContact O-N 3.01Å
142	A	92.6	Very high	92.4	Very high	5 Å²	5	58.2 Å²	58.2	4%	0.041	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-62.1	-32.9	-177.7	0	0	0	0	0	112.6	N39 P124 E125 D144 I145 P160	N39-A142 WeakPolarHBondContact CB-O 3.41Å; N39-A142 PolarHBondContact ND2-O 3.3Å; P124-A142 HydrophobicContact CG-CB 4.19Å; P124-A142 WeakPolarHBondContact O-CB 3.42Å; E125-A142 PolarHBondContact O-N 2.87Å; E125-A142 VanDerWaalsContact O-N 3.09Å; A142-D144 PolarHBondContact O-N 3.08Å; A142-I145 WeakPolarHBondContact O-CB 3.25Å; A142-I145 PolarHBondContact O-N 2.95Å; A142-I145 VanDerWaalsContact O-N 3.13Å; A142-P160 HydrophobicContact CB-CB 4.17Å
143	R	92.9	Very high	92.7	Very high	117 Å²	117	53.1 Å²	53.1	44%	0.442	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-59.2	-22.7	173.8	59.7	169	-93.3	162.2	-4	115.1	P38 N39 E40 K141	P38-R143 WeakPolarHBondContact CA-O 3.48Å; N39-R143 PolarHBondContact N-O 2.88Å; N39-R143 WeakPolarHBondContact O-CA 3.41Å; E40-R143 HydrophobicContact CB-CB 4.36Å; E40-R143 IonicContact OE2-NH1 2.79Å; K141-R143 HydrophobicContact CB-CG 3.88Å; K141-R143 PolarHBondContact O-N 3.42Å
144	D	94.8	Very high	92.9	Very high	56 Å²	56	50.7 Å²	50.7	30%	0.299	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-94.2	2.2	-178.1	-57.2	-27	0	0	0	112.2	R131 I140 K141 A142	R131-D144 PolarHBondContact NH2-O 3.38Å; I140-D144 HydrophobicContact CD1-CB 4.37Å; K141-D144 PolarHBondContact O-N 3.01Å; A142-D144 PolarHBondContact O-N 3.08Å
145	I	96.1	Very high	93.1	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.			trans	-77.8	137	172.7	-65.3	176.1	0	0	0	109.1	N39 V129 I140 A142 D149 V151 P160 A161 V223	N39-I145 VanDerWaalsContact CB-O 3.26Å; N39-I145 WeakPolarHBondContact CB-O 3.45Å; V129-I145 HydrophobicContact CG1-CD1 4.2Å; V129-I145 HydrophobicContact CG1-CG1 3.96Å; I140-I145 HydrophobicContact CD1-CG1 3.97Å; I140-I145 HydrophobicContact CG1-CG1 4.26Å; A142-I145 WeakPolarHBondContact O-CB 3.25Å; A142-I145 PolarHBondContact O-N 2.95Å; A142-I145 VanDerWaalsContact O-N 3.13Å; I145-D149 WeakPolarHBondContact CA-OD2 3.28Å; I145-D149 HydrophobicContact CG2-CB 4.31Å; I145-V151 HydrophobicContact CG2-CG1 4.46Å; I145-P160 HydrophobicContact CD1-CB 3.74Å; I145-P160 HydrophobicContact CD1-CG 3.72Å; I145-A161 HydrophobicContact CG2-CB 4.47Å; I145-V223 HydrophobicContact CG2-CG1 4.35Å; I145-V223 HydrophobicContact CG2-CG2 3.71Å
146	V	96.4	Very high	93.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.222	C	C	.	.			trans	-127	156.5	-177.4	-64.5	0	0	0	0	112	L24 V29 L33 G148 D149	L24-V146 HydrophobicContact CD1-CG2 3.99Å; V29-V146 HydrophobicContact CG1-CG2 4.37Å; L33-V146 HydrophobicContact CB-CG1 3.98Å; L33-V146 HydrophobicContact CD1-CG1 3.76Å; V146-G148 PolarHBondContact O-N 3.22Å; V146-D149 PolarHBondContact N-OD2 3.11Å; V146-D149 WeakPolarHBondContact O-CB 3.27Å; V146-D149 PolarHBondContact O-N 2.9Å
147	P	96.4	Very high	93.6	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.019	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	129.5	172.2	-26.5	37	0	0	0	111.7	F16 Y36 T226	F16-P147 HydrophobicContact CE1-CB 3.91Å; F16-P147 HydrophobicContact CZ-CB 4.31Å; Y36-P147 HydrophobicContact CD1-CG 4.14Å; Y36-P147 HydrophobicContact CD2-CB 4.04Å; Y36-P147 HydrophobicContact CD2-CG 3.7Å; Y36-P147 HydrophobicContact CE2-CB 4Å; Y36-P147 HydrophobicContact CE2-CG 4.14Å; Y36-P147 HydrophobicContact CG-CB 4.46Å; Y36-P147 HydrophobicContact CG-CG 3.71Å; P147-T226 WeakPolarHBondContact CD-OG1 3.49Å; P147-T226 HydrophobicContact CG-CG2 4.07Å
148	G	94.3	Very high	93.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.1	-16	-173	0	0	0	0	0	114.9	L24 V146 I150 V223	L24-G148 WeakPolarHBondContact CG-O 3.41Å; V146-G148 PolarHBondContact O-N 3.22Å; G148-I150 PolarHBondContact O-N 2.88Å; G148-V223 PolarHBondContact N-O 3.48Å
149	D	96.5	Very high	93.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.			trans	-59.8	139.5	173.6	-90.8	-35.8	0	0	0	110.2	R131 I145 V146 V151 V222 V223	R131-D149 IonicContact CZ-OD1 2.71Å; R131-D149 IonicContact CZ-OD2 3.75Å; R131-D149 IonicContact NE-OD1 3.58Å; R131-D149 PolarHBondContact NE-OD1 3.26Å; R131-D149 IonicContact NE-OD2 3.04Å; R131-D149 IonicContact NH2-OD1 2.7Å; R131-D149 IonicContact NH2-OD2 3.54Å; R131-D149 PolarHBondContact NH2-OD2 3.38Å; I145-D149 WeakPolarHBondContact CA-OD2 3.28Å; I145-D149 HydrophobicContact CG2-CB 4.31Å; V146-D149 PolarHBondContact N-OD2 3.11Å; V146-D149 WeakPolarHBondContact O-CB 3.27Å; V146-D149 PolarHBondContact O-N 2.9Å; D149-V151 HydrophobicContact CB-CG1 4.37Å; D149-V222 WeakPolarHBondContact O-CA 3.41Å; D149-V223 HydrophobicContact CB-CG2 4.17Å; D149-V223 PolarHBondContact O-N 3.27Å
150	I	97.3	Very high	93.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	123.1	170.2	-56.4	-59.6	0	0	0	108	L13 V18 V129 Y130 G148 I220 G221 V222	L13-I150 HydrophobicContact CD2-CD1 3.66Å; V18-I150 HydrophobicContact CG1-CD1 4.06Å; V18-I150 HydrophobicContact CG2-CD1 4.21Å; V18-I150 HydrophobicContact CG2-CG1 3.97Å; V129-I150 CarbonylContact C-O 3.53Å; V129-I150 VanDerWaalsContact CA-O 3.24Å; V129-I150 WeakPolarHBondContact CA-O 3.16Å; Y130-I150 HydrophobicContact CD2-CG2 4.08Å; Y130-I150 PolarHBondContact N-O 2.68Å; G148-I150 PolarHBondContact O-N 2.88Å; I150-I220 HydrophobicContact CG2-CG2 3.52Å; I150-G221 CarbonylContact C-O 3.49Å; I150-G221 WeakPolarHBondContact CA-O 3.46Å; I150-V222 HydrophobicContact CD1-CB 3.89Å; I150-V222 HydrophobicContact CD1-CG2 4.05Å
151	V	96.5	Very high	94	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.012	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	146.6	-172.5	-62.7	0	0	0	0	111.4	K128 V129 I145 D149 I163 I220 G221 V223	K128-V151 VanDerWaalsContact O-CA 3.28Å; K128-V151 WeakPolarHBondContact O-CA 3.37Å; V129-V151 HydrophobicContact CG1-CG1 4.09Å; I145-V151 HydrophobicContact CG2-CG1 4.46Å; D149-V151 HydrophobicContact CB-CG1 4.37Å; V151-I163 HydrophobicContact CB-CD1 4.45Å; V151-I163 HydrophobicContact CG2-CB 4.29Å; V151-I163 HydrophobicContact CG2-CD1 3.42Å; V151-I163 VanDerWaalsContact CG2-CD1 3.42Å; V151-I163 HydrophobicContact CG2-CG1 3.58Å; V151-I163 HydrophobicContact CG2-CG2 3.67Å; V151-I220 WeakPolarHBondContact O-CA 3.31Å; V151-G221 WeakPolarHBondContact CG2-O 3.39Å; V151-G221 PolarHBondContact N-O 3.28Å; V151-G221 PolarHBondContact O-N 2.88Å; V151-V223 HydrophobicContact CB-CG2 4.45Å; V151-V223 HydrophobicContact CG1-CG2 3.45Å; V151-V223 VanDerWaalsContact CG1-CG2 3.45Å; V151-V223 HydrophobicContact CG2-CG2 4.08Å
152	E	96.3	Very high	94.1	Very high	13 Å²	13	24 Å²	24	6%	0.061	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133	173.4	-179.1	173.8	97.7	0	0	110.4	K128 Y130 V137 R218	K128-E152 HydrophobicContact CB-CB 4.34Å; K128-E152 WeakPolarHBondContact CB-O 3.3Å; K128-E152 WeakPolarHBondContact CE-O 3.48Å; K128-E152 PolarHBondContact O-N 2.95Å; Y130-E152 HydrophobicContact CE2-CB 4.01Å; Y130-E152 PolarHBondContact OH-OE2 2.63Å; V137-E152 HydrophobicContact CG2-CB 4.41Å; E152-R218 VanDerWaalsContact CD-NH2 3.34Å; E152-R218 IonicContact OE1-CZ 3.82Å; E152-R218 IonicContact OE1-NE 2.79Å; E152-R218 IonicContact OE1-NH2 2.66Å; E152-R218 PolarHBondContact OE1-NH2 3.22Å; E152-R218 IonicContact OE2-CZ 3.43Å; E152-R218 VanDerWaalsContact OE2-CZ 3.22Å; E152-R218 IonicContact OE2-NE 2.64Å; E152-R218 PolarHBondContact OE2-NE 3.23Å; E152-R218 IonicContact OE2-NH2 3.62Å; E152-R218 PolarHBondContact OE2-NH2 3.1Å
153	V	95.8	Very high	94.3	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.024	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.7	171.7	-64.5	0	0	0	0	110.3	L208 I214 R218 A219	V153-L208 HydrophobicContact CG2-CD1 3.53Å; V153-I214 HydrophobicContact CB-CD1 4.18Å; V153-I214 HydrophobicContact CB-CG1 3.86Å; V153-I214 HydrophobicContact CG2-CD1 3.92Å; V153-I214 HydrophobicContact CG2-CG1 4.07Å; V153-R218 WeakPolarHBondContact O-CA 3.49Å; V153-A219 HydrophobicContact CG2-CB 4.35Å; V153-A219 PolarHBondContact N-O 3.3Å; V153-A219 PolarHBondContact O-N 3.49Å
154	A	93.1	Very high	94.5	Very high	20 Å²	20	18.3 Å²	18.3	17%	0.165	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	169.2	178.8	0	0	0	0	0	110.3	G156 D157 I214 G217 R218	A154-G156 PolarHBondContact O-N 3.34Å; A154-D157 PolarHBondContact N-OD2 2.83Å; A154-D157 VanDerWaalsContact O-CB 3.23Å; A154-D157 WeakPolarHBondContact O-CB 3.47Å; A154-D157 PolarHBondContact O-N 3.17Å; A154-I214 VanDerWaalsContact O-CB 3.3Å; A154-I214 WeakPolarHBondContact O-CB 3.13Å; A154-G217 CarbonylContact C-O 3.55Å; A154-G217 WeakPolarHBondContact CA-O 3.3Å; A154-R218 HydrophobicContact CB-CB 4.48Å; A154-R218 HydrophobicContact CB-CG 4.33Å
155	V	91.3	Very high	94.6	Very high	98 Å²	98	15.6 Å²	15.6	59%	0.594	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.8	130.5	178.5	62.8	0	0	0	0	112.4	D157 A215 G217	V155-D157 VanDerWaalsContact C-N 3.29Å; V155-D157 PolarHBondContact O-N 2.91Å; V155-A215 WeakPolarHBondContact CG2-O 3.36Å; V155-G217 PolarHBondContact N-O 3.43Å
156	G	85.8	Confident	94.4	Very high	65 Å²	65	16.2 Å²	16.2	67%	0.67	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.8	-14.3	-177.4	0	0	0	0	0	114.9	A154 I214	A154-G156 PolarHBondContact O-N 3.34Å; G156-I214 PolarHBondContact N-O 3.46Å
157	D	89.7	Confident	94.2	Very high	50 Å²	50	17.7 Å²	17.7	27%	0.267	12%	0.116	S	C	.	.	P	Polyproline II helix	trans	-71.6	142.1	174.9	-65.5	-35.2	0	0	0	111.1	K128 A154 V155 N213 I214	K128-D157 WeakPolarHBondContact CE-OD2 3.2Å; K128-D157 IonicContact NZ-OD1 3.59Å; K128-D157 IonicContact NZ-OD2 3.53Å; K128-D157 PolarHBondContact NZ-OD2 2.62Å; A154-D157 PolarHBondContact N-OD2 2.83Å; A154-D157 VanDerWaalsContact O-CB 3.23Å; A154-D157 WeakPolarHBondContact O-CB 3.47Å; A154-D157 PolarHBondContact O-N 3.17Å; V155-D157 VanDerWaalsContact C-N 3.29Å; V155-D157 PolarHBondContact O-N 2.91Å; D157-N213 WeakPolarHBondContact O-CA 3.24Å; D157-I214 PolarHBondContact O-N 3.24Å
158	K	90.6	Very high	93.9	Very high	60 Å²	60	19.7 Å²	19.7	26%	0.261	13%	0.126	S	C	.	.	B	Isolated β-bridge	trans	-89.1	132.7	164.7	-171.2	174.5	-61.3	179.4	0	109	Y122 P124 T212 N213	Y122-K158 WeakPolarHBondContact O-CD 3.49Å; Y122-K158 PolarHBondContact O-NZ 3.47Å; P124-K158 HydrophobicContact CB-CB 4.26Å; K158-T212 CarbonylContact C-O 3.6Å; K158-T212 WeakPolarHBondContact CA-O 3.43Å; K158-N213 WeakPolarHBondContact CB-OD1 3.39Å; K158-N213 WeakPolarHBondContact CE-OD1 3.38Å; K158-N213 VanDerWaalsContact CG-OD1 3.23Å; K158-N213 WeakPolarHBondContact CG-OD1 3.22Å
159	V	95.3	Very high	93.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-71.1	122.7	-175.5	179.6	0	0	0	0	108.8	A161 I163 L208 F209 S210 G211 T212 I214	V159-A161 VanDerWaalsContact CG1-O 3.25Å; V159-A161 WeakPolarHBondContact CG1-O 3.43Å; V159-I163 HydrophobicContact CG1-CD1 3.72Å; V159-L208 HydrophobicContact CG1-CB 3.8Å; V159-L208 HydrophobicContact CG2-CB 4.23Å; V159-F209 VanDerWaalsContact CB-O 3.28Å; V159-F209 WeakPolarHBondContact CB-O 3.29Å; V159-F209 VanDerWaalsContact CG1-O 3.27Å; V159-F209 WeakPolarHBondContact CG1-O 3.5Å; V159-S210 WeakPolarHBondContact O-CA 3.36Å; V159-G211 PolarHBondContact O-N 2.99Å; V159-T212 WeakPolarHBondContact CB-O 3.27Å; V159-T212 VanDerWaalsContact CG2-O 3.32Å; V159-T212 WeakPolarHBondContact CG2-O 3.4Å; V159-T212 WeakPolarHBondContact CG2-OG1 3.3Å; V159-T212 PolarHBondContact N-O 3.25Å; V159-I214 HydrophobicContact CG2-CD1 3.78Å; V159-I214 HydrophobicContact CG2-CG1 4.4Å
160	P	94.3	Very high	93	Very high	6 Å²	6	27.1 Å²	27.1	4%	0.039	16%	0.164	C	C	.	.			trans	-87.4	-16.2	-168.2	33.3	-37.4	0	0	0	115.1	N39 P124 A142 I145 I163 S210	N39-P160 PolarHBondContact ND2-O 3.02Å; P124-P160 HydrophobicContact CG-CB 3.88Å; A142-P160 HydrophobicContact CB-CB 4.17Å; I145-P160 HydrophobicContact CD1-CB 3.74Å; I145-P160 HydrophobicContact CD1-CG 3.72Å; P160-I163 HydrophobicContact CG-CD1 4.45Å; P160-S210 PolarHBondContact O-OG 3.13Å
161	A	95.1	Very high	92	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	-157.7	172.1	-177.4	0	0	0	0	0	109.2	I145 V159 I163 V223 T226	I145-A161 HydrophobicContact CG2-CB 4.47Å; V159-A161 VanDerWaalsContact CG1-O 3.25Å; V159-A161 WeakPolarHBondContact CG1-O 3.43Å; A161-I163 WeakPolarHBondContact O-CD1 3.28Å; A161-I163 WeakPolarHBondContact O-CG1 3.18Å; A161-I163 PolarHBondContact O-N 3.49Å; A161-V223 HydrophobicContact CB-CG1 3.7Å; A161-V223 HydrophobicContact CB-CG2 4.33Å; A161-T226 HydrophobicContact CB-CG2 4.1Å
162	D	96.1	Very high	91.3	Very high	6 Å²	6	31 Å²	31	3%	0.032	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	123	172.2	-74.7	3.2	0	0	0	109.5	L208 F209 S210 V224 A225 T230 E231	D162-L208 CarbonylContact C-O 3.55Å; D162-L208 WeakPolarHBondContact CA-O 3.33Å; D162-F209 VanDerWaalsContact OD1-CA 3.31Å; D162-F209 WeakPolarHBondContact OD1-CA 3.05Å; D162-S210 PolarHBondContact OD1-N 3.4Å; D162-V224 HydrophobicContact CB-CG2 4.22Å; D162-V224 WeakPolarHBondContact O-CG2 3.46Å; D162-V224 PolarHBondContact O-N 2.67Å; D162-A225 HydrophobicContact CB-CB 4.2Å; D162-A225 PolarHBondContact N-O 2.89Å; D162-A225 VanDerWaalsContact N-O 3.14Å; D162-A225 PolarHBondContact O-N 2.93Å; D162-T230 HydrophobicContact CB-CG2 4.23Å; D162-T230 VanDerWaalsContact OD2-CA 3.24Å; D162-T230 WeakPolarHBondContact OD2-CA 3.43Å; D162-E231 PolarHBondContact OD2-N 3.09Å
163	I	96.8	Very high	90.8	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134.2	-166.4	-64.7	150.3	0	0	0	110	V151 V159 P160 A161 M207 L208 V222 V223	V151-I163 HydrophobicContact CB-CD1 4.45Å; V151-I163 HydrophobicContact CG2-CB 4.29Å; V151-I163 HydrophobicContact CG2-CD1 3.42Å; V151-I163 VanDerWaalsContact CG2-CD1 3.42Å; V151-I163 HydrophobicContact CG2-CG1 3.58Å; V151-I163 HydrophobicContact CG2-CG2 3.67Å; V159-I163 HydrophobicContact CG1-CD1 3.72Å; P160-I163 HydrophobicContact CG-CD1 4.45Å; A161-I163 WeakPolarHBondContact O-CD1 3.28Å; A161-I163 WeakPolarHBondContact O-CG1 3.18Å; A161-I163 PolarHBondContact O-N 3.49Å; I163-M207 CarbonylContact O-C 3.22Å; I163-M207 WeakPolarHBondContact O-CA 3.33Å; I163-L208 HydrophobicContact CB-CB 4.21Å; I163-L208 HydrophobicContact CG2-CD1 4.37Å; I163-L208 PolarHBondContact N-O 2.82Å; I163-L208 PolarHBondContact O-N 2.79Å; I163-V222 CarbonylContact C-O 3.46Å; I163-V222 WeakPolarHBondContact CA-O 3.32Å; I163-V223 HydrophobicContact CG1-CG2 4.02Å
164	R	96.9	Very high	90.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.1	168.3	177.4	67.8	173.7	80.6	0.4	109.2	A4 K7 V12 T166 S191 N206 M207 G221 V222 V224	A4-R164 WeakPolarHBondContact O-CD 3.28Å; A4-R164 PolarHBondContact O-NE 3.22Å; A4-R164 VanDerWaalsContact O-NE 3.17Å; K7-R164 PolarHBondContact O-NE 2.91Å; K7-R164 PolarHBondContact O-NH2 3.36Å; V12-R164 HydrophobicContact CG1-CB 4.44Å; V12-R164 HydrophobicContact CG1-CG 4.47Å; V12-R164 HydrophobicContact CG2-CG 4.21Å; R164-T166 PolarHBondContact O-N 3.06Å; R164-S191 VanDerWaalsContact CZ-O 3.29Å; R164-S191 PolarHBondContact NH1-O 3.4Å; R164-S191 PolarHBondContact NH2-O 3Å; R164-N206 VanDerWaalsContact CZ-ND2 3.26Å; R164-N206 PolarHBondContact NE-ND2 3.38Å; R164-N206 PolarHBondContact NH2-ND2 3.28Å; R164-M207 HydrophobicContact CB-SD 4.12Å; R164-G221 CarbonylContact O-C 3.57Å; R164-G221 WeakPolarHBondContact O-CA 3.28Å; R164-V222 HydrophobicContact CB-CG1 3.95Å; R164-V222 HydrophobicContact CG-CG1 4.49Å; R164-V222 PolarHBondContact N-O 3.25Å; R164-V222 PolarHBondContact O-N 2.86Å; R164-V224 HydrophobicContact CB-CG1 3.73Å
165	V	95.8	Very high	90.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	119.3	-179.6	179.6	0	0	0	0	110.1	I168 L173 N206 L208 A219	V165-I168 HydrophobicContact CG1-CD1 4.36Å; V165-I168 HydrophobicContact CG1-CG1 3.75Å; V165-L173 HydrophobicContact CG2-CD2 4.44Å; V165-N206 PolarHBondContact N-O 2.7Å; V165-L208 HydrophobicContact CG2-CD1 4.09Å; V165-L208 HydrophobicContact CG2-CD2 3.96Å; V165-L208 HydrophobicContact CG2-CG 3.66Å; V165-A219 HydrophobicContact CG1-CB 4.4Å
166	T	93.3	Very high	89.9	Confident	12 Å²	12	28.6 Å²	28.6	7%	0.074	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-45.5	178.2	54.8	0	0	0	0	110.9	A9 L13 E20 R164 I220 V222	A9-T166 HydrophobicContact CB-CG2 4.16Å; L13-T166 HydrophobicContact CD1-CG2 4.48Å; L13-T166 HydrophobicContact CD2-CG2 4.44Å; L13-T166 HydrophobicContact CG-CG2 4.47Å; E20-T166 VanDerWaalsContact OE1-CB 3.23Å; E20-T166 WeakPolarHBondContact OE1-CB 3.32Å; E20-T166 PolarHBondContact OE1-OG1 2.56Å; R164-T166 PolarHBondContact O-N 3.06Å; T166-I220 PolarHBondContact N-O 2.92Å; T166-I220 PolarHBondContact OG1-O 2.84Å; T166-I220 VanDerWaalsContact OG1-O 3.09Å; T166-V222 HydrophobicContact CG2-CB 4.45Å; T166-V222 HydrophobicContact CG2-CG1 4.05Å
167	S	91.6	Very high	89.9	Confident	31 Å²	31	25.6 Å²	25.6	22%	0.217	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	127.2	-176.2	-175.4	0	0	0	0	111.4	E20 K169 A219 I220	E20-S167 WeakPolarHBondContact OE1-CB 3.34Å; S167-K169 WeakPolarHBondContact OG-CE 3.47Å; S167-K169 PolarHBondContact OG-NZ 3.12Å; S167-A219 WeakPolarHBondContact O-CA 3.45Å; S167-I220 PolarHBondContact N-O 3.44Å; S167-I220 VanDerWaalsContact N-O 3.16Å; S167-I220 PolarHBondContact O-N 3.47Å
168	I	90.1	Very high	89.4	Confident	45 Å²	45	24.7 Å²	24.7	23%	0.231	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.6	171.1	-57.3	174.9	0	0	0	107.4	V165 S170 L173 K189 A219	V165-I168 HydrophobicContact CG1-CD1 4.36Å; V165-I168 HydrophobicContact CG1-CG1 3.75Å; I168-S170 WeakPolarHBondContact CG2-O 3.47Å; I168-L173 HydrophobicContact CD1-CB 4.06Å; I168-L173 HydrophobicContact CG1-CB 4.31Å; I168-L173 HydrophobicContact CG2-CB 3.91Å; I168-K189 WeakPolarHBondContact CD1-O 3.45Å; I168-A219 HydrophobicContact CG1-CB 4.35Å
169	K	87.8	Confident	88.9	Confident	117 Å²	117	22.6 Å²	22.6	51%	0.509	12%	0.124	S	C	.	.			trans	-95.1	-21.6	-176.4	-58.7	-54.8	-174.3	-166.1	0	113	S167 R218 I220	S167-K169 WeakPolarHBondContact OG-CE 3.47Å; S167-K169 PolarHBondContact OG-NZ 3.12Å; K169-R218 HydrophobicContact CB-CB 4.47Å; K169-R218 HydrophobicContact CB-CG 4.36Å; K169-R218 PolarHBondContact N-O 3.27Å; K169-I220 HydrophobicContact CG-CG1 4.42Å
170	S	84.2	Confident	88.1	Confident	40 Å²	40	22.7 Å²	22.7	28%	0.28	13%	0.125	S	C	.	.	S	Bend	trans	-90.3	171.9	170.7	51.1	0	0	0	0	111.7	I168 T172 G217 R218	I168-S170 WeakPolarHBondContact CG2-O 3.47Å; S170-T172 VanDerWaalsContact C-N 3.29Å; S170-T172 PolarHBondContact O-N 2.8Å; S170-T172 PolarHBondContact OG-O 3.27Å; S170-G217 WeakPolarHBondContact OG-CA 3.39Å; S170-R218 PolarHBondContact N-O 3.45Å; S170-R218 PolarHBondContact OG-N 3.16Å; S170-R218 PolarHBondContact OG-O 2.97Å
171	T	76.4	Confident	87.1	Confident	64 Å²	64	23 Å²	23	39%	0.393	13%	0.127	S	C	.	.	S	Bend	trans	-56.6	-44.8	173.5	-41.2	0	0	0	0	112.2	E486	T171-E486 WeakPolarHBondContact CB-OE2 3.38Å; T171-E486 WeakPolarHBondContact CG2-OE2 3.16Å; T171-E486 PolarHBondContact OG1-OE2 3.36Å
172	T	80.5	Confident	85.9	Confident	20 Å²	20	23.3 Å²	23.3	12%	0.123	13%	0.13	C	C	.	.			trans	-138.3	152.2	176	60.1	0	0	0	0	110	S170 G217 F487	S170-T172 VanDerWaalsContact C-N 3.29Å; S170-T172 PolarHBondContact O-N 2.8Å; S170-T172 PolarHBondContact OG-O 3.27Å; T172-G217 WeakPolarHBondContact O-CA 3.28Å; T172-F487 WeakPolarHBondContact CG2-O 3.31Å
173	L	87.2	Confident	84.6	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.1	167.4	-176.5	71.7	0	0	0	107.8	V165 I168 V175 I188 K189 L208 I214 A219	V165-L173 HydrophobicContact CG2-CD2 4.44Å; I168-L173 HydrophobicContact CD1-CB 4.06Å; I168-L173 HydrophobicContact CG1-CB 4.31Å; I168-L173 HydrophobicContact CG2-CB 3.91Å; L173-V175 HydrophobicContact CD2-CG2 4.4Å; L173-V175 HydrophobicContact CG-CG2 4.26Å; L173-I188 WeakPolarHBondContact O-CA 3.47Å; L173-K189 HydrophobicContact CB-CB 4.27Å; L173-K189 HydrophobicContact CD2-CB 3.92Å; L173-K189 HydrophobicContact CD2-CG 4.24Å; L173-K189 HydrophobicContact CG-CB 4.35Å; L173-K189 PolarHBondContact O-N 3.34Å; L173-L208 HydrophobicContact CD2-CD2 3.87Å; L173-I214 HydrophobicContact CD1-CG2 3.86Å; L173-A219 HydrophobicContact CD1-CB 3.94Å; L173-A219 HydrophobicContact CD2-CB 3.51Å; L173-A219 HydrophobicContact CG-CB 4.26Å
174	R	86.3	Confident	83.3	Confident	33 Å²	33	27.2 Å²	27.2	13%	0.125	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.3	176.9	-61	-171	-176.7	-157.2	7.1	109.5	S186 V187 I188 A215 A216 E439	R174-S186 WeakPolarHBondContact CD-OG 3.17Å; R174-V187 WeakPolarHBondContact CA-O 3.4Å; R174-I188 HydrophobicContact CG-CG1 4.16Å; R174-A215 HydrophobicContact CB-CB 4.27Å; R174-A215 PolarHBondContact O-N 3.23Å; R174-A216 HydrophobicContact CB-CB 4.07Å; R174-A216 HydrophobicContact CG-CB 4.33Å; R174-A216 PolarHBondContact N-O 3.03Å; R174-A216 PolarHBondContact O-N 3.46Å; R174-A216 VanDerWaalsContact O-N 3.13Å; R174-E439 IonicContact CZ-OE1 3.46Å; R174-E439 IonicContact NH1-OE1 3.21Å; R174-E439 PolarHBondContact NH1-OE1 2.99Å; R174-E439 IonicContact NH1-OE2 3Å; R174-E439 PolarHBondContact NH1-OE2 3.29Å; R174-E439 VanDerWaalsContact NH1-OE2 3.12Å
175	V	88.6	Confident	82	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.9	-176.1	-173.7	0	0	0	0	108.8	L173 Q177 S186 V187 K189 L208 N213 I214	L173-V175 HydrophobicContact CD2-CG2 4.4Å; L173-V175 HydrophobicContact CG-CG2 4.26Å; V175-Q177 HydrophobicContact CB-CG 4.23Å; V175-Q177 HydrophobicContact CG1-CG 3.84Å; V175-Q177 PolarHBondContact O-N 3.23Å; V175-S186 WeakPolarHBondContact O-CA 3.28Å; V175-V187 PolarHBondContact N-O 3.42Å; V175-V187 PolarHBondContact O-N 3.35Å; V175-K189 HydrophobicContact CB-CG 4.4Å; V175-K189 HydrophobicContact CG2-CD 4.43Å; V175-K189 HydrophobicContact CG2-CG 3.57Å; V175-L208 HydrophobicContact CG2-CD2 3.55Å; V175-N213 WeakPolarHBondContact CA-O 3.19Å; V175-N213 WeakPolarHBondContact CG1-O 3.22Å; V175-I214 HydrophobicContact CG1-CD1 4.41Å; V175-I214 HydrophobicContact CG2-CD1 3.91Å
176	D	86.4	Confident	81.3	Confident	51 Å²	51	30.2 Å²	30.2	27%	0.273	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	110.6	166.8	-174.9	-10.5	0	0	0	108.6	S178 T212 N213	D176-S178 WeakPolarHBondContact OD1-CB 3.29Å; D176-S178 PolarHBondContact OD1-N 3Å; D176-S178 PolarHBondContact OD1-OG 3.42Å; D176-T212 WeakPolarHBondContact O-CB 3.47Å; D176-N213 PolarHBondContact N-O 3.34Å; D176-N213 PolarHBondContact O-N 2.91Å
177	Q	85.9	Confident	80.7	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	18%	0.177	C	C	.	.			trans	-109.6	19.7	179.5	-52.1	-169.6	131.6	0	0	112.2	V175 I179 L180 T181 V187 T212	V175-Q177 HydrophobicContact CB-CG 4.23Å; V175-Q177 HydrophobicContact CG1-CG 3.84Å; V175-Q177 PolarHBondContact O-N 3.23Å; Q177-I179 PolarHBondContact O-N 3.31Å; Q177-I179 VanDerWaalsContact O-N 3.15Å; Q177-L180 PolarHBondContact O-N 3.21Å; Q177-T181 HydrophobicContact CB-CG2 4.06Å; Q177-T181 PolarHBondContact O-N 2.82Å; Q177-T181 PolarHBondContact O-OG1 2.64Å; Q177-V187 HydrophobicContact CG-CG2 4.49Å; Q177-T212 HydrophobicContact CB-CG2 4.33Å; Q177-T212 HydrophobicContact CG-CG2 4.35Å
178	S	78.3	Confident	80.3	Confident	32 Å²	32	31.3 Å²	31.3	22%	0.224	18%	0.175	C	C	.	.	H	α-helix	trans	-51.3	-38.7	-178.3	48.6	0	0	0	0	112.4	D176 L180 T181 G182 E183	D176-S178 WeakPolarHBondContact OD1-CB 3.29Å; D176-S178 PolarHBondContact OD1-N 3Å; D176-S178 PolarHBondContact OD1-OG 3.42Å; S178-L180 VanDerWaalsContact C-N 3.27Å; S178-L180 PolarHBondContact O-N 2.78Å; S178-T181 PolarHBondContact O-N 3.2Å; S178-G182 VanDerWaalsContact O-CA 3.31Å; S178-G182 WeakPolarHBondContact O-CA 3.24Å; S178-G182 PolarHBondContact O-N 2.63Å; S178-E183 WeakPolarHBondContact CA-O 3.5Å
179	I	80.7	Confident	80.1	Confident	16 Å²	16	29.5 Å²	29.5	8%	0.082	17%	0.165	C	C	.	.	H	α-helix	trans	-59.2	-32.5	179	59.3	148.1	0	0	0	114.3	Q177 G211 T212 V702 N703	Q177-I179 PolarHBondContact O-N 3.31Å; Q177-I179 VanDerWaalsContact O-N 3.15Å; I179-G211 WeakPolarHBondContact CD1-O 3.04Å; I179-T212 HydrophobicContact CD1-CG2 4.02Å; I179-T212 HydrophobicContact CG1-CG2 3.92Å; I179-V702 HydrophobicContact CB-CB 4.43Å; I179-V702 HydrophobicContact CB-CG2 4.04Å; I179-V702 HydrophobicContact CG2-CG2 4.37Å; I179-V702 VanDerWaalsContact O-CB 3.26Å; I179-V702 WeakPolarHBondContact O-CB 3.2Å; I179-V702 PolarHBondContact O-N 3.02Å; I179-V702 VanDerWaalsContact O-N 3.15Å; I179-N703 PolarHBondContact O-N 2.78Å; I179-N703 VanDerWaalsContact O-N 3.1Å; I179-N703 PolarHBondContact O-OD1 3.44Å; I179-N703 VanDerWaalsContact O-OD1 3.13Å
180	L	78.6	Confident	80	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-103.5	-16.4	-176.7	-70.3	175.3	0	0	0	113	Q177 S178 F209 T212 E231 I235 N703	Q177-L180 PolarHBondContact O-N 3.21Å; S178-L180 VanDerWaalsContact C-N 3.27Å; S178-L180 PolarHBondContact O-N 2.78Å; L180-F209 HydrophobicContact CD1-CB 3.28Å; L180-F209 HydrophobicContact CD1-CD1 4.44Å; L180-F209 HydrophobicContact CD1-CD2 3.97Å; L180-F209 HydrophobicContact CD1-CG 3.67Å; L180-T212 HydrophobicContact CD1-CG2 3.99Å; L180-T212 HydrophobicContact CG-CG2 4.48Å; L180-E231 HydrophobicContact CD1-CB 4.36Å; L180-E231 HydrophobicContact CD2-CB 4.5Å; L180-I235 HydrophobicContact CD2-CD1 3.63Å; L180-N703 WeakPolarHBondContact O-CB 3.38Å
181	T	73.2	Confident	80.2	Confident	13 Å²	13	26 Å²	26	8%	0.08	15%	0.151	C	C	.	.	H	α-helix	trans	-125.1	-11.6	-169.8	65.3	0	0	0	0	113.7	Q177 S178 E183 Q202	Q177-T181 HydrophobicContact CB-CG2 4.06Å; Q177-T181 PolarHBondContact O-N 2.82Å; Q177-T181 PolarHBondContact O-OG1 2.64Å; S178-T181 PolarHBondContact O-N 3.2Å; T181-E183 PolarHBondContact O-N 2.83Å; T181-E183 VanDerWaalsContact O-N 3.13Å; T181-E183 PolarHBondContact OG1-N 2.58Å; T181-Q202 HydrophobicContact CG2-CG 3.75Å
182	G	68.4	Low	80.6	Confident	6 Å²	6	27.9 Å²	27.9	6%	0.062	16%	0.159	C	C	.	.	S	Bend	trans	72.8	-16.3	-170.8	0	0	0	0	0	114.4	S178 S184	S178-G182 VanDerWaalsContact O-CA 3.31Å; S178-G182 WeakPolarHBondContact O-CA 3.24Å; S178-G182 PolarHBondContact O-N 2.63Å; G182-S184 PolarHBondContact O-N 2.82Å
183	E	70.4	Confident	80.9	Confident	51 Å²	51	29.8 Å²	29.8	24%	0.238	17%	0.172	C	C	.	.			trans	-87.8	116	-172.7	-65.6	-65.4	148.7	0	0	111.6	S178 T181 V185	S178-E183 WeakPolarHBondContact CA-O 3.5Å; T181-E183 PolarHBondContact O-N 2.83Å; T181-E183 VanDerWaalsContact O-N 3.13Å; T181-E183 PolarHBondContact OG1-N 2.58Å; E183-V185 PolarHBondContact O-N 2.91Å
184	S	67.8	Low	80.8	Confident	38 Å²	38	30.6 Å²	30.6	27%	0.266	18%	0.177	S	C	.	.			trans	-78.1	6	178.9	-37.8	0	0	0	0	114.3	G182 N359	G182-S184 PolarHBondContact O-N 2.82Å; S184-N359 PolarHBondContact OG-ND2 2.82Å
185	V	70.8	Confident	80.5	Confident	40 Å²	40	34.8 Å²	34.8	24%	0.242	21%	0.208	C	C	.	.	S	Bend	trans	-90.1	127.7	176.2	-180	0	0	0	0	108.7	E183 V187	E183-V185 PolarHBondContact O-N 2.91Å; V185-V187 PolarHBondContact O-N 3.48Å
186	S	79.9	Confident	80	Confident	22 Å²	22	37.7 Å²	37.7	15%	0.154	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-62.5	137.6	-179.2	81.9	0	0	0	0	111.6	R174 V175 E439	R174-S186 WeakPolarHBondContact CD-OG 3.17Å; V175-S186 WeakPolarHBondContact O-CA 3.28Å; S186-E439 PolarHBondContact OG-OE1 3.37Å
187	V	81.9	Confident	79.7	Confident	35 Å²	35	38.9 Å²	38.9	21%	0.212	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	129.1	-179.3	-177.4	0	0	0	0	109.4	R174 V175 Q177 V185	R174-V187 WeakPolarHBondContact CA-O 3.4Å; V175-V187 PolarHBondContact N-O 3.42Å; V175-V187 PolarHBondContact O-N 3.35Å; Q177-V187 HydrophobicContact CG-CG2 4.49Å; V185-V187 PolarHBondContact O-N 3.48Å
188	I	82.3	Confident	79.4	Confident	32 Å²	32	46.3 Å²	46.3	16%	0.164	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	129.7	176	-60.9	168.7	0	0	0	109.8	L173 R174 F487	L173-I188 WeakPolarHBondContact O-CA 3.47Å; R174-I188 HydrophobicContact CG-CG1 4.16Å; I188-F487 HydrophobicContact CD1-CD1 3.48Å; I188-F487 VanDerWaalsContact CD1-CD1 3.48Å; I188-F487 HydrophobicContact CD1-CE1 3.34Å; I188-F487 HydrophobicContact CD1-CZ 4.5Å
189	K	86.6	Confident	79.2	Confident	7 Å²	7	45.2 Å²	45.2	3%	0.03	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	158.9	-179.4	-61.3	-66.5	-178.3	166.4	0	113	I168 L173 V175 K204 K205 M207 L208	I168-K189 WeakPolarHBondContact CD1-O 3.45Å; L173-K189 HydrophobicContact CB-CB 4.27Å; L173-K189 HydrophobicContact CD2-CB 3.92Å; L173-K189 HydrophobicContact CD2-CG 4.24Å; L173-K189 HydrophobicContact CG-CB 4.35Å; L173-K189 PolarHBondContact O-N 3.34Å; V175-K189 HydrophobicContact CB-CG 4.4Å; V175-K189 HydrophobicContact CG2-CD 4.43Å; V175-K189 HydrophobicContact CG2-CG 3.57Å; K189-K204 PolarHBondContact NZ-O 3.45Å; K189-K204 VanDerWaalsContact NZ-O 3.1Å; K189-K205 CarbonylContact C-O 3.57Å; K189-K205 WeakPolarHBondContact CA-O 3.25Å; K189-K205 WeakPolarHBondContact CB-O 3.41Å; K189-K205 WeakPolarHBondContact CD-O 3.47Å; K189-M207 WeakPolarHBondContact CD-O 3.1Å; K189-M207 WeakPolarHBondContact CE-O 3.23Å; K189-M207 PolarHBondContact NZ-O 2.98Å; K189-L208 HydrophobicContact CG-CD2 4.09Å
190	H	84.8	Confident	79	Confident	36 Å²	36	46.3 Å²	46.3	17%	0.167	26%	0.262	C	S	.	.			trans	-142	168.1	175.6	54.5	88	0	0	0	111.8	D192 K205 N206 R489	H190-D192 PolarHBondContact ND1-O 2.79Å; H190-K205 VanDerWaalsContact CD2-CB 3.43Å; H190-K205 WeakPolarHBondContact CD2-CB 3.37Å; H190-K205 PolarHBondContact N-O 2.95Å; H190-K205 WeakPolarHBondContact NE2-CB 3.22Å; H190-N206 WeakPolarHBondContact O-CA 3.48Å; H190-N206 WeakPolarHBondContact O-CB 3.3Å; H190-R489 PolarHBondContact CD2-NH1 3.1Å; H190-R489 PolarHBondContact NE2-NH1 2.78Å; H190-R489 VanDerWaalsContact NE2-NH1 3.19Å
191	S	88.5	Confident	79.2	Confident	47 Å²	47	46.5 Å²	46.5	33%	0.329	26%	0.263	S	S	.	.	S	Bend	trans	-93.4	-15.7	177.7	51.8	0	0	0	0	113.7	R164	R164-S191 VanDerWaalsContact CZ-O 3.29Å; R164-S191 PolarHBondContact NH1-O 3.4Å; R164-S191 PolarHBondContact NH2-O 3Å
192	D	84.9	Confident	79.4	Confident	104 Å²	104	47.5 Å²	47.5	56%	0.556	27%	0.267	S	S	*	.	S	Bend	trans	-64.2	147	-177.2	-60.9	-44.5	0	0	0	112.9	H190 N206	H190-D192 PolarHBondContact ND1-O 2.79Å; D192-N206 WeakPolarHBondContact O-CB 3.44Å; D192-N206 PolarHBondContact O-ND2 3.15Å
193	P	86.5	Confident	79.9	Confident	60 Å²	60	50.5 Å²	50.5	39%	0.39	28%	0.282	S	S	.	.			trans	-63.3	144.5	174.5	26.7	-33.2	0	0	0	111.7	T6	T6-P193 WeakPolarHBondContact O-CB 3.5Å
194	V	84.9	Confident	80.6	Confident	17 Å²	17	49.3 Å²	49.3	10%	0.103	28%	0.276	C	S	.	.			trans	-98	110.7	172.8	176.1	0	0	0	0	107.3	H5 T6 D196 A199	H5-V194 PolarHBondContact O-N 3.43Å; T6-V194 VanDerWaalsContact CA-O 3.27Å; T6-V194 WeakPolarHBondContact CA-O 3.5Å; V194-D196 PolarHBondContact O-N 3.43Å; V194-D196 VanDerWaalsContact O-N 3.16Å; V194-A199 HydrophobicContact CG1-CB 3.86Å
195	P	80.5	Confident	81.5	Confident	120 Å²	120	50 Å²	50	78%	0.779	27%	0.274	S	S	*	.			trans	-63.7	-26.7	-167.7	-23.7	32.9	0	0	0	114.8	P197	P195-P197 VanDerWaalsContact O-CD 3.25Å; P195-P197 WeakPolarHBondContact O-CD 3.25Å
196	D	78.4	Confident	82.5	Confident	61 Å²	61	48 Å²	48	33%	0.326	26%	0.262	S	S	.	.			trans	-76.7	113.2	-175.4	-171.4	-10.1	0	0	0	110.9	H5 V194 R198 A199	H5-D196 PolarHBondContact CD2-O 2.95Å; H5-D196 PolarHBondContact NE2-O 3.32Å; V194-D196 PolarHBondContact O-N 3.43Å; V194-D196 VanDerWaalsContact O-N 3.16Å; D196-R198 PolarHBondContact O-N 2.91Å; D196-R198 WeakPolarHBondContact OD1-CA 3.47Å; D196-R198 PolarHBondContact OD1-N 2.92Å; D196-A199 HydrophobicContact CB-CB 4.17Å; D196-A199 VanDerWaalsContact O-CB 3.27Å; D196-A199 WeakPolarHBondContact O-CB 3.32Å; D196-A199 PolarHBondContact O-N 3.1Å
197	P	80.9	Confident	83.2	Confident	77 Å²	77	47.5 Å²	47.5	50%	0.5	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.5	176.9	28.7	-34.6	0	0	0	112.8	T6 P195	T6-P197 HydrophobicContact CG2-CB 4.16Å; P195-P197 VanDerWaalsContact O-CD 3.25Å; P195-P197 WeakPolarHBondContact O-CD 3.25Å
198	R	78.3	Confident	83.8	Confident	157 Å²	157	46 Å²	46	59%	0.592	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98	17.4	176.9	-65.5	-176.9	61.8	-171.9	-3.4	112.5	D196 V200 D656	D196-R198 PolarHBondContact O-N 2.91Å; D196-R198 WeakPolarHBondContact OD1-CA 3.47Å; D196-R198 PolarHBondContact OD1-N 2.92Å; R198-V200 PolarHBondContact O-N 2.97Å; R198-D656 IonicContact NH2-OD2 3.33Å; R198-D656 PolarHBondContact NH2-OD2 3.42Å; R198-D656 VanDerWaalsContact NH2-OD2 3.12Å
199	A	75	Confident	84.4	Confident	8 Å²	8	44.6 Å²	44.6	7%	0.066	24%	0.241	C	C	.	.			trans	-54.6	130.2	176.4	0	0	0	0	0	111.1	V194 D196 D203 K204	V194-A199 HydrophobicContact CG1-CB 3.86Å; D196-A199 HydrophobicContact CB-CB 4.17Å; D196-A199 VanDerWaalsContact O-CB 3.27Å; D196-A199 WeakPolarHBondContact O-CB 3.32Å; D196-A199 PolarHBondContact O-N 3.1Å; A199-D203 HydrophobicContact CB-CB 4.2Å; A199-K204 HydrophobicContact CB-CG 4.29Å; A199-K204 WeakPolarHBondContact O-CE 3.49Å
200	V	76.8	Confident	84.7	Confident	39 Å²	39	44.7 Å²	44.7	24%	0.236	24%	0.242	C	C	.	.			trans	-67.4	162.4	173.1	-68.5	0	0	0	0	111.9	R198 Q202 D203 K204 E677	R198-V200 PolarHBondContact O-N 2.97Å; V200-Q202 PolarHBondContact O-N 3.08Å; V200-D203 HydrophobicContact CG2-CB 3.91Å; V200-D203 WeakPolarHBondContact CG2-OD2 3.3Å; V200-D203 WeakPolarHBondContact O-CA 3.37Å; V200-D203 PolarHBondContact O-N 2.9Å; V200-K204 PolarHBondContact O-N 2.94Å; V200-K204 VanDerWaalsContact O-N 3.1Å; V200-E677 VanDerWaalsContact CB-CD 3.46Å; V200-E677 HydrophobicContact CB-CG 4.21Å; V200-E677 VanDerWaalsContact CB-OE1 3.25Å; V200-E677 WeakPolarHBondContact CB-OE1 3.42Å; V200-E677 VanDerWaalsContact CG1-CD 3.43Å; V200-E677 HydrophobicContact CG1-CG 3.57Å; V200-E677 WeakPolarHBondContact CG1-OE1 3.43Å
201	N	83.1	Confident	84.9	Confident	7 Å²	7	43.2 Å²	43.2	4%	0.037	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-30.2	-175.9	-74.8	-22.2	0	0	0	113.2	D203 K204 F209 E231 E677	N201-D203 VanDerWaalsContact C-N 3.3Å; N201-D203 PolarHBondContact O-N 3.23Å; N201-K204 PolarHBondContact OD1-NZ 3.45Å; N201-F209 HydrophobicContact CB-CE2 4.36Å; N201-F209 HydrophobicContact CB-CZ 4.14Å; N201-E231 PolarHBondContact ND2-OE2 3.05Å; N201-E231 PolarHBondContact OD1-OE2 3.38Å; N201-E677 PolarHBondContact N-OE2 3.4Å
202	Q	76.4	Confident	85.1	Confident	33 Å²	33	41 Å²	41	15%	0.154	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-27.7	174.1	-54.4	81.8	-1	0	0	112.6	T181 V200 E677	T181-Q202 HydrophobicContact CG2-CG 3.75Å; V200-Q202 PolarHBondContact O-N 3.08Å; Q202-E677 PolarHBondContact NE2-OE1 3.28Å; Q202-E677 PolarHBondContact OE1-OE1 3.13Å
203	D	78.6	Confident	85.4	Confident	69 Å²	69	39.1 Å²	39.1	37%	0.369	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-20	-178.4	-76.9	-27.8	0	0	0	113.5	A199 V200 N201 K205	A199-D203 HydrophobicContact CB-CB 4.2Å; V200-D203 HydrophobicContact CG2-CB 3.91Å; V200-D203 WeakPolarHBondContact CG2-OD2 3.3Å; V200-D203 WeakPolarHBondContact O-CA 3.37Å; V200-D203 PolarHBondContact O-N 2.9Å; N201-D203 VanDerWaalsContact C-N 3.3Å; N201-D203 PolarHBondContact O-N 3.23Å; D203-K205 PolarHBondContact O-N 3.01Å; D203-K205 IonicContact OD1-NZ 2.69Å
204	K	86.2	Confident	85.6	Confident	26 Å²	26	36.4 Å²	36.4	11%	0.113	19%	0.193	C	C	.	.			trans	-68.8	64.6	170.7	-67.9	177.2	-169.3	164.6	0	111.8	H5 K189 A199 V200 N201 N206 M207 F209 E231	H5-K204 HydrophobicContact CB-CB 4.48Å; H5-K204 HydrophobicContact CB-CG 4.06Å; K189-K204 PolarHBondContact NZ-O 3.45Å; K189-K204 VanDerWaalsContact NZ-O 3.1Å; A199-K204 HydrophobicContact CB-CG 4.29Å; A199-K204 WeakPolarHBondContact O-CE 3.49Å; V200-K204 PolarHBondContact O-N 2.94Å; V200-K204 VanDerWaalsContact O-N 3.1Å; N201-K204 PolarHBondContact OD1-NZ 3.45Å; K204-N206 PolarHBondContact O-N 3.26Å; K204-M207 HydrophobicContact CB-CB 4.12Å; K204-M207 HydrophobicContact CB-CG 3.9Å; K204-M207 HydrophobicContact CD-CG 4.4Å; K204-M207 HydrophobicContact CG-CG 4.48Å; K204-M207 PolarHBondContact O-N 3.33Å; K204-F209 HydrophobicContact CB-CZ 3.83Å; K204-F209 HydrophobicContact CD-CE1 4.16Å; K204-F209 HydrophobicContact CD-CZ 3.86Å; K204-E231 IonicContact NZ-OE1 3.71Å
205	K	85.6	Confident	85.7	Confident	52 Å²	52	37.9 Å²	37.9	23%	0.226	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-1.6	-175.6	-69.9	174	-171.9	138.9	0	113.9	K189 H190 D203	K189-K205 CarbonylContact C-O 3.57Å; K189-K205 WeakPolarHBondContact CA-O 3.25Å; K189-K205 WeakPolarHBondContact CB-O 3.41Å; K189-K205 WeakPolarHBondContact CD-O 3.47Å; H190-K205 VanDerWaalsContact CD2-CB 3.43Å; H190-K205 WeakPolarHBondContact CD2-CB 3.37Å; H190-K205 PolarHBondContact N-O 2.95Å; H190-K205 WeakPolarHBondContact NE2-CB 3.22Å; D203-K205 PolarHBondContact O-N 3.01Å; D203-K205 IonicContact OD1-NZ 2.69Å
206	N	92.1	Very high	86	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	8.4	174.1	66.6	-7.1	0	0	0	114.3	H5 R164 V165 H190 D192 K204	H5-N206 WeakPolarHBondContact CA-OD1 3.47Å; H5-N206 WeakPolarHBondContact CB-OD1 3.4Å; H5-N206 PolarHBondContact O-ND2 3.34Å; R164-N206 VanDerWaalsContact CZ-ND2 3.26Å; R164-N206 PolarHBondContact NE-ND2 3.38Å; R164-N206 PolarHBondContact NH2-ND2 3.28Å; V165-N206 PolarHBondContact N-O 2.7Å; H190-N206 WeakPolarHBondContact O-CA 3.48Å; H190-N206 WeakPolarHBondContact O-CB 3.3Å; D192-N206 WeakPolarHBondContact O-CB 3.44Å; D192-N206 PolarHBondContact O-ND2 3.15Å; K204-N206 PolarHBondContact O-N 3.26Å
207	M	94.5	Very high	86.4	Confident	11 Å²	11	32 Å²	32	5%	0.054	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	148.6	175.9	-62	-57.9	-63.5	0	0	110.6	A4 H5 I163 R164 K189 K204 F209 V224	A4-M207 HydrophobicContact CB-SD 4.5Å; H5-M207 HydrophobicContact CB-CG 3.78Å; H5-M207 HydrophobicContact CB-SD 4.07Å; I163-M207 CarbonylContact O-C 3.22Å; I163-M207 WeakPolarHBondContact O-CA 3.33Å; R164-M207 HydrophobicContact CB-SD 4.12Å; K189-M207 WeakPolarHBondContact CD-O 3.1Å; K189-M207 WeakPolarHBondContact CE-O 3.23Å; K189-M207 PolarHBondContact NZ-O 2.98Å; K204-M207 HydrophobicContact CB-CB 4.12Å; K204-M207 HydrophobicContact CB-CG 3.9Å; K204-M207 HydrophobicContact CD-CG 4.4Å; K204-M207 HydrophobicContact CG-CG 4.48Å; K204-M207 PolarHBondContact O-N 3.33Å; M207-F209 HydrophobicContact CB-CE1 3.94Å; M207-F209 HydrophobicContact CB-CE2 4.29Å; M207-F209 HydrophobicContact CB-CZ 3.77Å; M207-V224 HydrophobicContact CE-CG2 3.52Å
208	L	95.8	Very high	87	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	140.1	160.5	-49.7	173.4	0	0	0	106.9	V153 V159 D162 I163 V165 L173 V175 K189 I214	V153-L208 HydrophobicContact CG2-CD1 3.53Å; V159-L208 HydrophobicContact CG1-CB 3.8Å; V159-L208 HydrophobicContact CG2-CB 4.23Å; D162-L208 CarbonylContact C-O 3.55Å; D162-L208 WeakPolarHBondContact CA-O 3.33Å; I163-L208 HydrophobicContact CB-CB 4.21Å; I163-L208 HydrophobicContact CG2-CD1 4.37Å; I163-L208 PolarHBondContact N-O 2.82Å; I163-L208 PolarHBondContact O-N 2.79Å; V165-L208 HydrophobicContact CG2-CD1 4.09Å; V165-L208 HydrophobicContact CG2-CD2 3.96Å; V165-L208 HydrophobicContact CG2-CG 3.66Å; L173-L208 HydrophobicContact CD2-CD2 3.87Å; V175-L208 HydrophobicContact CG2-CD2 3.55Å; K189-L208 HydrophobicContact CG-CD2 4.09Å; L208-I214 HydrophobicContact CD2-CD1 4.41Å
209	F	94.5	Very high	87.8	Confident	3 Å²	3	26.1 Å²	26.1	1%	0.013	15%	0.147	C	C	.	.			trans	-112	142.3	-174.1	-57.9	-73.7	0	0	0	111.1	V159 D162 L180 N201 K204 M207 G211 T212 E231	V159-F209 VanDerWaalsContact CB-O 3.28Å; V159-F209 WeakPolarHBondContact CB-O 3.29Å; V159-F209 VanDerWaalsContact CG1-O 3.27Å; V159-F209 WeakPolarHBondContact CG1-O 3.5Å; D162-F209 VanDerWaalsContact OD1-CA 3.31Å; D162-F209 WeakPolarHBondContact OD1-CA 3.05Å; L180-F209 HydrophobicContact CD1-CB 3.28Å; L180-F209 HydrophobicContact CD1-CD1 4.44Å; L180-F209 HydrophobicContact CD1-CD2 3.97Å; L180-F209 HydrophobicContact CD1-CG 3.67Å; N201-F209 HydrophobicContact CB-CE2 4.36Å; N201-F209 HydrophobicContact CB-CZ 4.14Å; K204-F209 HydrophobicContact CB-CZ 3.83Å; K204-F209 HydrophobicContact CD-CE1 4.16Å; K204-F209 HydrophobicContact CD-CZ 3.86Å; M207-F209 HydrophobicContact CB-CE1 3.94Å; M207-F209 HydrophobicContact CB-CE2 4.29Å; M207-F209 HydrophobicContact CB-CZ 3.77Å; F209-G211 PolarHBondContact O-N 3.43Å; F209-T212 HydrophobicContact CB-CG2 3.99Å; F209-T212 WeakPolarHBondContact O-CB 3.31Å; F209-T212 PolarHBondContact O-N 2.85Å; F209-T212 VanDerWaalsContact O-N 3.15Å; F209-T212 PolarHBondContact O-OG1 2.87Å; F209-E231 HydrophobicContact CD1-CB 4.19Å; F209-E231 HydrophobicContact CD1-CG 3.58Å; F209-E231 HydrophobicContact CE1-CG 3.7Å
210	S	93.4	Very high	88.8	Confident	10 Å²	10	26.6 Å²	26.6	7%	0.07	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	137.1	178.4	-167.1	0	0	0	0	111.5	V159 P160 D162 T212	V159-S210 WeakPolarHBondContact O-CA 3.36Å; P160-S210 PolarHBondContact O-OG 3.13Å; D162-S210 PolarHBondContact OD1-N 3.4Å; S210-T212 VanDerWaalsContact C-N 3.28Å; S210-T212 PolarHBondContact O-N 3.41Å
211	G	89.2	Confident	89.7	Confident	4 Å²	4	24.8 Å²	24.8	4%	0.041	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	-14.6	-178.3	0	0	0	0	0	115.5	V159 I179 F209	V159-G211 PolarHBondContact O-N 2.99Å; I179-G211 WeakPolarHBondContact CD1-O 3.04Å; F209-G211 PolarHBondContact O-N 3.43Å
212	T	91.1	Very high	90.4	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	14%	0.136	C	C	.	.			trans	-73.6	161.1	174.8	63.2	0	0	0	0	111.6	K158 V159 D176 Q177 I179 L180 F209 S210	K158-T212 CarbonylContact C-O 3.6Å; K158-T212 WeakPolarHBondContact CA-O 3.43Å; V159-T212 WeakPolarHBondContact CB-O 3.27Å; V159-T212 VanDerWaalsContact CG2-O 3.32Å; V159-T212 WeakPolarHBondContact CG2-O 3.4Å; V159-T212 WeakPolarHBondContact CG2-OG1 3.3Å; V159-T212 PolarHBondContact N-O 3.25Å; D176-T212 WeakPolarHBondContact O-CB 3.47Å; Q177-T212 HydrophobicContact CB-CG2 4.33Å; Q177-T212 HydrophobicContact CG-CG2 4.35Å; I179-T212 HydrophobicContact CD1-CG2 4.02Å; I179-T212 HydrophobicContact CG1-CG2 3.92Å; L180-T212 HydrophobicContact CD1-CG2 3.99Å; L180-T212 HydrophobicContact CG-CG2 4.48Å; F209-T212 HydrophobicContact CB-CG2 3.99Å; F209-T212 WeakPolarHBondContact O-CB 3.31Å; F209-T212 PolarHBondContact O-N 2.85Å; F209-T212 VanDerWaalsContact O-N 3.15Å; F209-T212 PolarHBondContact O-OG1 2.87Å; S210-T212 VanDerWaalsContact C-N 3.28Å; S210-T212 PolarHBondContact O-N 3.41Å
213	N	91	Very high	91.4	Very high	64 Å²	64	22.9 Å²	22.9	34%	0.342	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	144.7	-177.1	-69.9	-0.6	0	0	0	111.7	D157 K158 V175 D176 A215	D157-N213 WeakPolarHBondContact O-CA 3.24Å; K158-N213 WeakPolarHBondContact CB-OD1 3.39Å; K158-N213 WeakPolarHBondContact CE-OD1 3.38Å; K158-N213 VanDerWaalsContact CG-OD1 3.23Å; K158-N213 WeakPolarHBondContact CG-OD1 3.22Å; V175-N213 WeakPolarHBondContact CA-O 3.19Å; V175-N213 WeakPolarHBondContact CG1-O 3.22Å; D176-N213 PolarHBondContact N-O 3.34Å; D176-N213 PolarHBondContact O-N 2.91Å; N213-A215 PolarHBondContact O-N 3.26Å
214	I	92.1	Very high	92.2	Very high	3 Å²	3	20 Å²	20	2%	0.015	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	111.6	173.2	-51.6	-54	0	0	0	109.6	V153 A154 G156 D157 V159 L173 V175 L208	V153-I214 HydrophobicContact CB-CD1 4.18Å; V153-I214 HydrophobicContact CB-CG1 3.86Å; V153-I214 HydrophobicContact CG2-CD1 3.92Å; V153-I214 HydrophobicContact CG2-CG1 4.07Å; A154-I214 VanDerWaalsContact O-CB 3.3Å; A154-I214 WeakPolarHBondContact O-CB 3.13Å; G156-I214 PolarHBondContact N-O 3.46Å; D157-I214 PolarHBondContact O-N 3.24Å; V159-I214 HydrophobicContact CG2-CD1 3.78Å; V159-I214 HydrophobicContact CG2-CG1 4.4Å; L173-I214 HydrophobicContact CD1-CG2 3.86Å; V175-I214 HydrophobicContact CG1-CD1 4.41Å; V175-I214 HydrophobicContact CG2-CD1 3.91Å; L208-I214 HydrophobicContact CD2-CD1 4.41Å
215	A	86.6	Confident	92.6	Very high	49 Å²	49	19.6 Å²	19.6	41%	0.405	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-37.9	178.8	0	0	0	0	0	112.1	V155 R174 N213	V155-A215 WeakPolarHBondContact CG2-O 3.36Å; R174-A215 HydrophobicContact CB-CB 4.27Å; R174-A215 PolarHBondContact O-N 3.23Å; N213-A215 PolarHBondContact O-N 3.26Å
216	A	85.8	Confident	93	Very high	36 Å²	36	17.2 Å²	17.2	30%	0.298	11%	0.105	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	150.5	175.4	0	0	0	0	0	111.8	R174	R174-A216 HydrophobicContact CB-CB 4.07Å; R174-A216 HydrophobicContact CG-CB 4.33Å; R174-A216 PolarHBondContact N-O 3.03Å; R174-A216 PolarHBondContact O-N 3.46Å; R174-A216 VanDerWaalsContact O-N 3.13Å
217	G	88.6	Confident	93	Very high	20 Å²	20	17.5 Å²	17.5	21%	0.206	11%	0.107	C	C	.	.			trans	95.3	-174.5	174.5	0	0	0	0	0	114.9	A154 V155 S170 T172	A154-G217 CarbonylContact C-O 3.55Å; A154-G217 WeakPolarHBondContact CA-O 3.3Å; V155-G217 PolarHBondContact N-O 3.43Å; S170-G217 WeakPolarHBondContact OG-CA 3.39Å; T172-G217 WeakPolarHBondContact O-CA 3.28Å
218	R	92.3	Very high	92.7	Very high	112 Å²	112	19 Å²	19	42%	0.423	12%	0.117	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	135.8	179.9	-179.6	178.3	175.2	-178.9	1.1	109.8	E152 V153 A154 K169 S170	E152-R218 VanDerWaalsContact CD-NH2 3.34Å; E152-R218 IonicContact OE1-CZ 3.82Å; E152-R218 IonicContact OE1-NE 2.79Å; E152-R218 IonicContact OE1-NH2 2.66Å; E152-R218 PolarHBondContact OE1-NH2 3.22Å; E152-R218 IonicContact OE2-CZ 3.43Å; E152-R218 VanDerWaalsContact OE2-CZ 3.22Å; E152-R218 IonicContact OE2-NE 2.64Å; E152-R218 PolarHBondContact OE2-NE 3.23Å; E152-R218 IonicContact OE2-NH2 3.62Å; E152-R218 PolarHBondContact OE2-NH2 3.1Å; V153-R218 WeakPolarHBondContact O-CA 3.49Å; A154-R218 HydrophobicContact CB-CB 4.48Å; A154-R218 HydrophobicContact CB-CG 4.33Å; K169-R218 HydrophobicContact CB-CB 4.47Å; K169-R218 HydrophobicContact CB-CG 4.36Å; K169-R218 PolarHBondContact N-O 3.27Å; S170-R218 PolarHBondContact N-O 3.45Å; S170-R218 PolarHBondContact OG-N 3.16Å; S170-R218 PolarHBondContact OG-O 2.97Å
219	A	95.3	Very high	92.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	157	179	0	0	0	0	0	112.6	V153 V165 S167 I168 L173	V153-A219 HydrophobicContact CG2-CB 4.35Å; V153-A219 PolarHBondContact N-O 3.3Å; V153-A219 PolarHBondContact O-N 3.49Å; V165-A219 HydrophobicContact CG1-CB 4.4Å; S167-A219 WeakPolarHBondContact O-CA 3.45Å; I168-A219 HydrophobicContact CG1-CB 4.35Å; L173-A219 HydrophobicContact CD1-CB 3.94Å; L173-A219 HydrophobicContact CD2-CB 3.51Å; L173-A219 HydrophobicContact CG-CB 4.26Å
220	I	96.1	Very high	92.5	Very high	17 Å²	17	23.2 Å²	23.2	9%	0.087	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	143.6	170.8	-57.6	-177.9	0	0	0	107.5	E20 Y130 I150 V151 T166 S167 K169	E20-I220 HydrophobicContact CG-CG2 4.24Å; Y130-I220 HydrophobicContact CE2-CD1 4.3Å; I150-I220 HydrophobicContact CG2-CG2 3.52Å; V151-I220 WeakPolarHBondContact O-CA 3.31Å; T166-I220 PolarHBondContact N-O 2.92Å; T166-I220 PolarHBondContact OG1-O 2.84Å; T166-I220 VanDerWaalsContact OG1-O 3.09Å; S167-I220 PolarHBondContact N-O 3.44Å; S167-I220 VanDerWaalsContact N-O 3.16Å; S167-I220 PolarHBondContact O-N 3.47Å; K169-I220 HydrophobicContact CG-CG1 4.42Å
221	G	96.1	Very high	92.2	Very high	2 Å²	2	24.1 Å²	24.1	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	174.9	174.6	0	0	0	0	0	112.6	I150 V151 R164	I150-G221 CarbonylContact C-O 3.49Å; I150-G221 WeakPolarHBondContact CA-O 3.46Å; V151-G221 WeakPolarHBondContact CG2-O 3.39Å; V151-G221 PolarHBondContact N-O 3.28Å; V151-G221 PolarHBondContact O-N 2.88Å; R164-G221 CarbonylContact O-C 3.57Å; R164-G221 WeakPolarHBondContact O-CA 3.28Å
222	V	96.8	Very high	92.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	134.6	177.4	59.5	0	0	0	0	110	V12 L13 F16 V18 D149 I150 I163 R164 T166	V12-V222 HydrophobicContact CB-CG1 4.31Å; V12-V222 HydrophobicContact CG1-CG1 3.49Å; V12-V222 VanDerWaalsContact CG1-CG1 3.49Å; L13-V222 HydrophobicContact CD2-CB 4.3Å; F16-V222 HydrophobicContact CD2-CG2 4.25Å; V18-V222 HydrophobicContact CG1-CG2 4.27Å; D149-V222 WeakPolarHBondContact O-CA 3.41Å; I150-V222 HydrophobicContact CD1-CB 3.89Å; I150-V222 HydrophobicContact CD1-CG2 4.05Å; I163-V222 CarbonylContact C-O 3.46Å; I163-V222 WeakPolarHBondContact CA-O 3.32Å; R164-V222 HydrophobicContact CB-CG1 3.95Å; R164-V222 HydrophobicContact CG-CG1 4.49Å; R164-V222 PolarHBondContact N-O 3.25Å; R164-V222 PolarHBondContact O-N 2.86Å; T166-V222 HydrophobicContact CG2-CB 4.45Å; T166-V222 HydrophobicContact CG2-CG1 4.05Å
223	V	96.9	Very high	91.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	128.7	178.6	179.9	0	0	0	0	109.8	I145 G148 D149 V151 A161 I163 T226	I145-V223 HydrophobicContact CG2-CG1 4.35Å; I145-V223 HydrophobicContact CG2-CG2 3.71Å; G148-V223 PolarHBondContact N-O 3.48Å; D149-V223 HydrophobicContact CB-CG2 4.17Å; D149-V223 PolarHBondContact O-N 3.27Å; V151-V223 HydrophobicContact CB-CG2 4.45Å; V151-V223 HydrophobicContact CG1-CG2 3.45Å; V151-V223 VanDerWaalsContact CG1-CG2 3.45Å; V151-V223 HydrophobicContact CG2-CG2 4.08Å; A161-V223 HydrophobicContact CB-CG1 3.7Å; A161-V223 HydrophobicContact CB-CG2 4.33Å; I163-V223 HydrophobicContact CG1-CG2 4.02Å; V223-T226 HydrophobicContact CG1-CG2 3.61Å
224	V	96	Very high	91.7	Very high	8 Å²	8	25.4 Å²	25.4	5%	0.048	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-24.6	-177.6	-60.6	0	0	0	0	113.8	M1 A4 V12 F16 D162 R164 M207	M1-V224 PolarHBondContact N-O 3.34Å; A4-V224 HydrophobicContact CB-CB 4.03Å; A4-V224 HydrophobicContact CB-CG1 3.59Å; A4-V224 HydrophobicContact CB-CG2 4.24Å; V12-V224 HydrophobicContact CG1-CG1 4.05Å; F16-V224 HydrophobicContact CE2-CG1 4.38Å; D162-V224 HydrophobicContact CB-CG2 4.22Å; D162-V224 WeakPolarHBondContact O-CG2 3.46Å; D162-V224 PolarHBondContact O-N 2.67Å; R164-V224 HydrophobicContact CB-CG1 3.73Å; M207-V224 HydrophobicContact CE-CG2 3.52Å
225	A	94.9	Very high	91.2	Very high	17 Å²	17	25.6 Å²	25.6	14%	0.14	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	147.5	176.9	0	0	0	0	0	110.9	D162 N229 T230	D162-A225 HydrophobicContact CB-CB 4.2Å; D162-A225 PolarHBondContact N-O 2.89Å; D162-A225 VanDerWaalsContact N-O 3.14Å; D162-A225 PolarHBondContact O-N 2.93Å; A225-N229 HydrophobicContact CB-CB 4.17Å; A225-T230 WeakPolarHBondContact O-CG2 3.37Å
226	T	94.3	Very high	91	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.018	13%	0.13	C	C	.	.			trans	-136.1	160.2	-178	51.8	0	0	0	0	110.6	N39 P147 A161 V223 V228 N229	N39-T226 HydrophobicContact CB-CG2 3.91Å; N39-T226 VanDerWaalsContact OD1-CA 3.31Å; N39-T226 WeakPolarHBondContact OD1-CA 3.48Å; N39-T226 VanDerWaalsContact OD1-CB 3.27Å; N39-T226 WeakPolarHBondContact OD1-CB 3.41Å; P147-T226 WeakPolarHBondContact CD-OG1 3.49Å; P147-T226 HydrophobicContact CG-CG2 4.07Å; A161-T226 HydrophobicContact CB-CG2 4.1Å; V223-T226 HydrophobicContact CG1-CG2 3.61Å; T226-V228 PolarHBondContact O-N 3.27Å; T226-N229 PolarHBondContact O-N 2.79Å; T226-N229 VanDerWaalsContact O-N 3.16Å
227	G	90.9	Very high	90.9	Very high	5 Å²	5	26 Å²	26	5%	0.052	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	53.7	-131.5	177.3	0	0	0	0	0	112.6	N39 N229 T230	N39-G227 PolarHBondContact OD1-N 3.03Å; G227-N229 PolarHBondContact O-N 3.37Å; G227-N229 VanDerWaalsContact O-N 3.1Å; G227-T230 PolarHBondContact O-N 2.73Å; G227-T230 PolarHBondContact O-OG1 3.42Å
228	V	89.9	Confident	90.5	Very high	44 Å²	44	28.3 Å²	28.3	27%	0.267	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-61.4	-17	-178.8	-62.8	0	0	0	0	115	L41 P42 T226 G233 K234	L41-V228 HydrophobicContact CD2-CG1 4.5Å; P42-V228 HydrophobicContact CG-CG1 4.06Å; T226-V228 PolarHBondContact O-N 3.27Å; V228-G233 CarbonylContact O-C 3.52Å; V228-K234 PolarHBondContact O-N 3.19Å
229	N	92.4	Very high	89.8	Confident	91 Å²	91	23.3 Å²	23.3	49%	0.487	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	-87	-9.3	-178.2	-63.9	-51.1	0	0	0	113.6	A225 T226 G227	A225-N229 HydrophobicContact CB-CB 4.17Å; T226-N229 PolarHBondContact O-N 2.79Å; T226-N229 VanDerWaalsContact O-N 3.16Å; G227-N229 PolarHBondContact O-N 3.37Å; G227-N229 VanDerWaalsContact O-N 3.1Å
230	T	91.9	Very high	89	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.012	14%	0.138	C	C	.	.	S	Bend	trans	-71.8	165	173.7	60.1	0	0	0	0	111.5	D162 A225 G227 I232 G233 K234	D162-T230 HydrophobicContact CB-CG2 4.23Å; D162-T230 VanDerWaalsContact OD2-CA 3.24Å; D162-T230 WeakPolarHBondContact OD2-CA 3.43Å; A225-T230 WeakPolarHBondContact O-CG2 3.37Å; G227-T230 PolarHBondContact O-N 2.73Å; G227-T230 PolarHBondContact O-OG1 3.42Å; T230-I232 VanDerWaalsContact C-N 3.3Å; T230-I232 PolarHBondContact O-N 3.07Å; T230-I232 WeakPolarHBondContact OG1-CG2 3.45Å; T230-G233 CarbonylContact O-C 3.34Å; T230-G233 WeakPolarHBondContact O-CA 3.49Å; T230-G233 PolarHBondContact O-N 3.26Å; T230-G233 VanDerWaalsContact O-N 3.09Å; T230-G233 PolarHBondContact OG1-N 2.87Å; T230-K234 WeakPolarHBondContact O-CG 3.43Å; T230-K234 PolarHBondContact O-N 3.25Å
231	E	88	Confident	88.1	Confident	28 Å²	28	28.5 Å²	28.5	13%	0.131	17%	0.167	C	C	.	.	H	α-helix	trans	-58.6	-40.4	174.4	-66.1	-59.6	135.3	0	0	112.3	D162 L180 N201 K204 F209 K234 I235	D162-E231 PolarHBondContact OD2-N 3.09Å; L180-E231 HydrophobicContact CD1-CB 4.36Å; L180-E231 HydrophobicContact CD2-CB 4.5Å; N201-E231 PolarHBondContact ND2-OE2 3.05Å; N201-E231 PolarHBondContact OD1-OE2 3.38Å; K204-E231 IonicContact NZ-OE1 3.71Å; F209-E231 HydrophobicContact CD1-CB 4.19Å; F209-E231 HydrophobicContact CD1-CG 3.58Å; F209-E231 HydrophobicContact CE1-CG 3.7Å; E231-K234 PolarHBondContact O-N 2.98Å; E231-K234 IonicContact OE1-NZ 3.3Å; E231-K234 PolarHBondContact OE1-NZ 2.94Å; E231-I235 WeakPolarHBondContact O-CG1 3.32Å; E231-I235 PolarHBondContact O-N 3.01Å
232	I	86.5	Confident	87.1	Confident	8 Å²	8	29.7 Å²	29.7	4%	0.041	17%	0.174	C	C	.	.	H	α-helix	trans	-69	-34.1	173.7	-164.8	169.6	0	0	0	112.2	T230 I235 R236 V702	T230-I232 VanDerWaalsContact C-N 3.3Å; T230-I232 PolarHBondContact O-N 3.07Å; T230-I232 WeakPolarHBondContact OG1-CG2 3.45Å; I232-I235 WeakPolarHBondContact O-CB 3.43Å; I232-I235 PolarHBondContact O-N 3.24Å; I232-R236 PolarHBondContact O-N 3.13Å; I232-V702 HydrophobicContact CD1-CG1 4.46Å; I232-V702 HydrophobicContact CG1-CG1 4.29Å
233	G	87.1	Confident	86	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.2	-39.2	173.9	0	0	0	0	0	113.5	V228 T230 R236 N237	V228-G233 CarbonylContact O-C 3.52Å; T230-G233 CarbonylContact O-C 3.34Å; T230-G233 WeakPolarHBondContact O-CA 3.49Å; T230-G233 PolarHBondContact O-N 3.26Å; T230-G233 VanDerWaalsContact O-N 3.09Å; T230-G233 PolarHBondContact OG1-N 2.87Å; G233-R236 PolarHBondContact O-N 3.38Å; G233-N237 PolarHBondContact O-N 2.98Å
234	K	86	Confident	84.4	Confident	88 Å²	88	43.8 Å²	43.8	38%	0.383	24%	0.24	S	C	.	.	H	α-helix	trans	-62.7	-43.5	173	-68.6	171	-169.2	172	0	111.5	V228 T230 E231 R236 N237 Q238	V228-K234 PolarHBondContact O-N 3.19Å; T230-K234 WeakPolarHBondContact O-CG 3.43Å; T230-K234 PolarHBondContact O-N 3.25Å; E231-K234 PolarHBondContact O-N 2.98Å; E231-K234 IonicContact OE1-NZ 3.3Å; E231-K234 PolarHBondContact OE1-NZ 2.94Å; K234-R236 VanDerWaalsContact C-N 3.33Å; K234-R236 PolarHBondContact O-N 3.22Å; K234-N237 PolarHBondContact O-N 3.01Å; K234-Q238 WeakPolarHBondContact O-CG 3.32Å; K234-Q238 PolarHBondContact O-N 3.18Å
235	I	82.5	Confident	83.2	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.036	27%	0.27	C	S	.	.	H	α-helix	trans	-57.8	-47.8	174.1	-71.8	169.8	0	0	0	110	L180 E231 I232 N237 Q238 M239 V702 P706	L180-I235 HydrophobicContact CD2-CD1 3.63Å; E231-I235 WeakPolarHBondContact O-CG1 3.32Å; E231-I235 PolarHBondContact O-N 3.01Å; I232-I235 WeakPolarHBondContact O-CB 3.43Å; I232-I235 PolarHBondContact O-N 3.24Å; I235-N237 PolarHBondContact O-N 2.99Å; I235-Q238 WeakPolarHBondContact O-CB 3.18Å; I235-Q238 PolarHBondContact O-N 3.38Å; I235-M239 HydrophobicContact CG2-SD 4.29Å; I235-M239 WeakPolarHBondContact O-CG 3Å; I235-M239 PolarHBondContact O-N 3.15Å; I235-V702 HydrophobicContact CD1-CG1 4.44Å; I235-V702 HydrophobicContact CG2-CG1 4.11Å; I235-P706 HydrophobicContact CB-CG 4.39Å; I235-P706 HydrophobicContact CG2-CG 3.72Å
236	R	82.8	Confident	82.3	Confident	21 Å²	21	55.1 Å²	55.1	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-43.6	177.6	177.3	-95.7	166.5	90.4	0.1	112.6	L41 P42 I232 G233 K234 Q238 M239 A240	L41-R236 HydrophobicContact CD1-CB 4.43Å; L41-R236 HydrophobicContact CD1-CG 4.42Å; L41-R236 HydrophobicContact CD2-CB 4.31Å; L41-R236 HydrophobicContact CD2-CG 4.33Å; P42-R236 PolarHBondContact O-NH1 3.21Å; P42-R236 PolarHBondContact O-NH2 3.48Å; I232-R236 PolarHBondContact O-N 3.13Å; G233-R236 PolarHBondContact O-N 3.38Å; K234-R236 VanDerWaalsContact C-N 3.33Å; K234-R236 PolarHBondContact O-N 3.22Å; R236-Q238 VanDerWaalsContact C-N 3.33Å; R236-Q238 PolarHBondContact O-N 3.41Å; R236-M239 PolarHBondContact O-N 3.45Å; R236-A240 PolarHBondContact O-N 3.26Å
237	N	83.9	Confident	81.6	Confident	72 Å²	72	55.9 Å²	55.9	39%	0.385	29%	0.292	S	S	.	.	H	α-helix	trans	-64.3	-38.1	177	-77.1	-7.1	0	0	0	112.2	G233 K234 I235 M239 A240 A241	G233-N237 PolarHBondContact O-N 2.98Å; K234-N237 PolarHBondContact O-N 3.01Å; I235-N237 PolarHBondContact O-N 2.99Å; N237-M239 VanDerWaalsContact C-N 3.35Å; N237-A240 PolarHBondContact O-N 3.03Å; N237-A241 VanDerWaalsContact O-CB 3.3Å; N237-A241 WeakPolarHBondContact O-CB 3.45Å; N237-A241 PolarHBondContact O-N 2.72Å
238	Q	80.6	Confident	81	Confident	70 Å²	70	56 Å²	56	33%	0.327	29%	0.292	S	S	.	.	H	α-helix	trans	-63.6	-42.4	174	-71.6	175.6	2.2	0	0	111.3	K234 I235 R236 A241 T242 P706	K234-Q238 WeakPolarHBondContact O-CG 3.32Å; K234-Q238 PolarHBondContact O-N 3.18Å; I235-Q238 WeakPolarHBondContact O-CB 3.18Å; I235-Q238 PolarHBondContact O-N 3.38Å; R236-Q238 VanDerWaalsContact C-N 3.33Å; R236-Q238 PolarHBondContact O-N 3.41Å; Q238-A241 PolarHBondContact O-N 3.42Å; Q238-T242 PolarHBondContact O-N 3.22Å; Q238-T242 VanDerWaalsContact O-N 3.09Å; Q238-T242 PolarHBondContact O-OG1 2.69Å; Q238-P706 HydrophobicContact CB-CB 4.17Å; Q238-P706 HydrophobicContact CB-CG 4.37Å
239	M	77.4	Confident	80.4	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.03	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-42.4	175.9	-69.5	177.9	68.7	0	0	112.3	L119 I235 R236 N237 T242 A705 P706 K709 A727	L119-M239 HydrophobicContact CD1-CE 4.32Å; L119-M239 HydrophobicContact CD1-SD 4.07Å; I235-M239 HydrophobicContact CG2-SD 4.29Å; I235-M239 WeakPolarHBondContact O-CG 3Å; I235-M239 PolarHBondContact O-N 3.15Å; R236-M239 PolarHBondContact O-N 3.45Å; N237-M239 VanDerWaalsContact C-N 3.35Å; M239-T242 PolarHBondContact O-N 3.21Å; M239-A705 HydrophobicContact CE-CB 3.86Å; M239-A705 HydrophobicContact CG-CB 4.39Å; M239-A705 HydrophobicContact SD-CB 3.44Å; M239-A705 WeakPolarHBondContact SD-CB 3.2Å; M239-P706 HydrophobicContact CG-CB 4.44Å; M239-P706 HydrophobicContact CG-CG 4.14Å; M239-K709 HydrophobicContact CB-CD 4.33Å; M239-K709 WeakPolarHBondContact O-CD 3.28Å; M239-K709 WeakPolarHBondContact O-CE 3.19Å; M239-K709 PolarHBondContact O-NZ 2.97Å; M239-A727 HydrophobicContact CE-CB 3.72Å
240	A	78.3	Confident	79.8	Confident	44 Å²	44	53.3 Å²	53.3	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-66.4	-37.2	178.1	0	0	0	0	0	112	R236 N237 T242	R236-A240 PolarHBondContact O-N 3.26Å; N237-A240 PolarHBondContact O-N 3.03Å; A240-T242 VanDerWaalsContact C-N 3.31Å; A240-T242 PolarHBondContact O-N 2.65Å
241	A	77.7	Confident	79.4	Confident	82 Å²	82	57.7 Å²	57.7	68%	0.678	29%	0.294	S	S	*	.	H	α-helix	trans	-78	-12.2	178.3	0	0	0	0	0	114.3	N237 Q238 E243	N237-A241 VanDerWaalsContact O-CB 3.3Å; N237-A241 WeakPolarHBondContact O-CB 3.45Å; N237-A241 PolarHBondContact O-N 2.72Å; Q238-A241 PolarHBondContact O-N 3.42Å; A241-E243 PolarHBondContact O-N 3.34Å
242	T	75.2	Confident	79.1	Confident	28 Å²	28	57.9 Å²	57.9	17%	0.172	29%	0.294	C	S	.	.			trans	-84.2	103.2	178.9	-57.3	0	0	0	0	108.9	Q238 M239 A240 K709 K710	Q238-T242 PolarHBondContact O-N 3.22Å; Q238-T242 VanDerWaalsContact O-N 3.09Å; Q238-T242 PolarHBondContact O-OG1 2.69Å; M239-T242 PolarHBondContact O-N 3.21Å; A240-T242 VanDerWaalsContact C-N 3.31Å; A240-T242 PolarHBondContact O-N 2.65Å; T242-K709 HydrophobicContact CG2-CG 4.44Å; T242-K709 WeakPolarHBondContact O-CE 3.17Å; T242-K710 HydrophobicContact CG2-CB 3.8Å; T242-K710 HydrophobicContact CG2-CG 4.09Å
243	E	71.8	Confident	78.8	Confident	182 Å²	182	59.5 Å²	59.5	85%	0.85	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-70.5	134.9	168.1	-68.8	-178.9	-177.4	0	0	109.5	A241	A241-E243 PolarHBondContact O-N 3.34Å
244	Q	65.1	Low	78.4	Confident	114 Å²	114	62 Å²	62	53%	0.533	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-85.2	118.5	178.5	-160.4	163.5	15.3	0	0	108.4	E729	Q244-E729 PolarHBondContact NE2-OE1 3.44Å
245	E	69.6	Low	78.3	Confident	146 Å²	146	61.7 Å²	61.7	68%	0.682	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-68.7	145.6	176	-70.3	-166.4	177.9	0	0	110.7
246	K	76.2	Confident	78.2	Confident	117 Å²	117	63.2 Å²	63.2	51%	0.509	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-61.2	141.2	172.6	-71.3	-177.9	171.5	-174.5	0	110	Q250 Q251 D254	K246-Q250 HydrophobicContact CB-CB 4.23Å; K246-Q251 HydrophobicContact CB-CG 3.94Å; K246-Q251 PolarHBondContact O-NE2 3Å; K246-D254 IonicContact NZ-OD2 3.82Å; K246-D254 PolarHBondContact NZ-OD2 3.32Å
247	T	79.2	Confident	78.1	Confident	18 Å²	18	62.4 Å²	62.4	11%	0.11	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-59.3	153.5	177.3	58.4	0	0	0	0	112.2	L249 Q250 Q251 P337 T341	T247-L249 PolarHBondContact O-N 3.32Å; T247-Q250 PolarHBondContact O-N 3.4Å; T247-Q250 WeakPolarHBondContact OG1-CB 3.48Å; T247-Q250 VanDerWaalsContact OG1-CD 3.26Å; T247-Q250 WeakPolarHBondContact OG1-CG 3.48Å; T247-Q250 PolarHBondContact OG1-N 2.91Å; T247-Q250 PolarHBondContact OG1-OE1 3.22Å; T247-Q251 WeakPolarHBondContact O-CG 3.42Å; T247-Q251 PolarHBondContact O-N 3.36Å; T247-P337 HydrophobicContact CG2-CB 3.66Å; T247-T341 WeakPolarHBondContact CB-OG1 3.5Å; T247-T341 WeakPolarHBondContact CG2-OG1 3.38Å
248	P	79.9	Confident	78	Confident	9 Å²	9	64.1 Å²	64.1	6%	0.058	33%	0.327	C	S	.	.	H	α-helix	trans	-52.9	-38.9	176.6	-27.8	35.8	0	0	0	113	K252 I694 P821	P248-K252 WeakPolarHBondContact O-CB 3.49Å; P248-K252 VanDerWaalsContact O-CG 3.25Å; P248-K252 WeakPolarHBondContact O-CG 3.36Å; P248-K252 PolarHBondContact O-N 3.05Å; P248-I694 HydrophobicContact CG-CD1 3.93Å; P248-P821 HydrophobicContact CB-CB 4.45Å; P248-P821 HydrophobicContact CG-CB 4.48Å
249	L	77.3	Confident	78.1	Confident	5 Å²	5	65.8 Å²	65.8	3%	0.026	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-50.7	174.3	-179.3	73.2	0	0	0	112.3	T247 Q251 K252 L253 E340 M754	T247-L249 PolarHBondContact O-N 3.32Å; L249-Q251 VanDerWaalsContact C-N 3.31Å; L249-Q251 PolarHBondContact O-N 3.28Å; L249-K252 CarbonylContact O-C 3.59Å; L249-K252 PolarHBondContact O-N 3Å; L249-L253 HydrophobicContact CD1-CD1 4.44Å; L249-L253 HydrophobicContact CD1-CG 4.45Å; L249-L253 HydrophobicContact CD2-CD1 4.31Å; L249-L253 HydrophobicContact CG-CD1 3.95Å; L249-L253 HydrophobicContact CG-CG 4.33Å; L249-L253 WeakPolarHBondContact O-CG 2.93Å; L249-L253 PolarHBondContact O-N 2.88Å; L249-E340 HydrophobicContact CB-CG 4.11Å; L249-E340 HydrophobicContact CD2-CG 4.44Å; L249-M754 HydrophobicContact CD1-CE 3.44Å; L249-M754 VanDerWaalsContact CD1-CE 3.44Å; L249-M754 HydrophobicContact CD2-CE 3.32Å; L249-M754 HydrophobicContact CG-CE 3.96Å
250	Q	78.8	Confident	78.2	Confident	72 Å²	72	66.9 Å²	66.9	34%	0.336	34%	0.34	S	S	.	.	H	α-helix	trans	-59.3	-44	179.9	-77.2	167.7	-33.3	0	0	111.1	K246 T247 K252 L253 D254	K246-Q250 HydrophobicContact CB-CB 4.23Å; T247-Q250 PolarHBondContact O-N 3.4Å; T247-Q250 WeakPolarHBondContact OG1-CB 3.48Å; T247-Q250 VanDerWaalsContact OG1-CD 3.26Å; T247-Q250 WeakPolarHBondContact OG1-CG 3.48Å; T247-Q250 PolarHBondContact OG1-N 2.91Å; T247-Q250 PolarHBondContact OG1-OE1 3.22Å; Q250-K252 VanDerWaalsContact C-N 3.25Å; Q250-K252 PolarHBondContact O-N 3.35Å; Q250-L253 PolarHBondContact O-N 2.94Å; Q250-D254 VanDerWaalsContact O-CG 3.31Å; Q250-D254 PolarHBondContact O-N 3.18Å
251	Q	83.6	Confident	78.3	Confident	95 Å²	95	65.1 Å²	65.1	44%	0.444	33%	0.326	S	S	.	.	H	α-helix	trans	-58.2	-39.6	174.9	-65.2	-179.8	12.9	0	0	111.9	K246 T247 L249 E255	K246-Q251 HydrophobicContact CB-CG 3.94Å; K246-Q251 PolarHBondContact O-NE2 3Å; T247-Q251 WeakPolarHBondContact O-CG 3.42Å; T247-Q251 PolarHBondContact O-N 3.36Å; L249-Q251 VanDerWaalsContact C-N 3.31Å; L249-Q251 PolarHBondContact O-N 3.28Å; Q251-E255 WeakPolarHBondContact O-CB 3.43Å; Q251-E255 PolarHBondContact O-N 3.29Å
252	K	81.9	Confident	78.6	Confident	32 Å²	32	68 Å²	68	14%	0.139	32%	0.322	C	S	.	.	H	α-helix	trans	-73.6	-33.4	177.9	-69.7	-67	168.8	-163.6	0	113.6	P248 L249 Q250 E255 F256 L825	P248-K252 WeakPolarHBondContact O-CB 3.49Å; P248-K252 VanDerWaalsContact O-CG 3.25Å; P248-K252 WeakPolarHBondContact O-CG 3.36Å; P248-K252 PolarHBondContact O-N 3.05Å; L249-K252 CarbonylContact O-C 3.59Å; L249-K252 PolarHBondContact O-N 3Å; Q250-K252 VanDerWaalsContact C-N 3.25Å; Q250-K252 PolarHBondContact O-N 3.35Å; K252-E255 IonicContact NZ-OE2 3.82Å; K252-E255 PolarHBondContact NZ-OE2 3.36Å; K252-F256 WeakPolarHBondContact O-CB 3.33Å; K252-F256 PolarHBondContact O-N 2.98Å; K252-L825 HydrophobicContact CB-CD1 4.12Å; K252-L825 HydrophobicContact CB-CG 4.33Å
253	L	79.3	Confident	79	Confident	42 Å²	42	70.4 Å²	70.4	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-68.1	-41.4	172.6	-69.4	171.6	0	0	0	111	L249 Q250 F256 G257 L311 I315	L249-L253 HydrophobicContact CD1-CD1 4.44Å; L249-L253 HydrophobicContact CD1-CG 4.45Å; L249-L253 HydrophobicContact CD2-CD1 4.31Å; L249-L253 HydrophobicContact CG-CD1 3.95Å; L249-L253 HydrophobicContact CG-CG 4.33Å; L249-L253 WeakPolarHBondContact O-CG 2.93Å; L249-L253 PolarHBondContact O-N 2.88Å; Q250-L253 PolarHBondContact O-N 2.94Å; L253-F256 PolarHBondContact O-N 3.14Å; L253-G257 PolarHBondContact O-N 3.29Å; L253-L311 HydrophobicContact CD2-CD2 4.26Å; L253-I315 HydrophobicContact CD1-CD1 3.81Å; L253-I315 HydrophobicContact CD2-CD1 4.1Å
254	D	80.5	Confident	79.4	Confident	53 Å²	53	62 Å²	62	28%	0.283	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-46.9	174.4	-70	-6.1	0	0	0	110.9	K246 Q250 F256 G257 Q258	K246-D254 IonicContact NZ-OD2 3.82Å; K246-D254 PolarHBondContact NZ-OD2 3.32Å; Q250-D254 VanDerWaalsContact O-CG 3.31Å; Q250-D254 PolarHBondContact O-N 3.18Å; D254-F256 VanDerWaalsContact C-N 3.32Å; D254-F256 PolarHBondContact O-N 3.04Å; D254-G257 PolarHBondContact O-N 3.21Å; D254-Q258 WeakPolarHBondContact O-CG 3.38Å; D254-Q258 PolarHBondContact O-N 2.83Å
255	E	83.6	Confident	80.3	Confident	81 Å²	81	59.4 Å²	59.4	38%	0.379	29%	0.293	S	S	.	.	H	α-helix	trans	-59.8	-44.4	175.9	-173.2	-177.2	178.7	0	0	111	Q251 K252 Q258 Q259	Q251-E255 WeakPolarHBondContact O-CB 3.43Å; Q251-E255 PolarHBondContact O-N 3.29Å; K252-E255 IonicContact NZ-OE2 3.82Å; K252-E255 PolarHBondContact NZ-OE2 3.36Å; E255-Q258 PolarHBondContact O-N 3.03Å; E255-Q259 WeakPolarHBondContact O-CG 3.44Å; E255-Q259 PolarHBondContact O-N 3.3Å
256	F	80.4	Confident	81.1	Confident	38 Å²	38	58.4 Å²	58.4	17%	0.167	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-47.2	176	172.5	-102.8	0	0	0	111.7	K252 L253 D254 Q258 Q259 L260 P308 I762	K252-F256 WeakPolarHBondContact O-CB 3.33Å; K252-F256 PolarHBondContact O-N 2.98Å; L253-F256 PolarHBondContact O-N 3.14Å; D254-F256 VanDerWaalsContact C-N 3.32Å; D254-F256 PolarHBondContact O-N 3.04Å; F256-Q258 VanDerWaalsContact C-N 3.3Å; F256-Q258 PolarHBondContact O-N 3.03Å; F256-Q259 PolarHBondContact O-N 3.08Å; F256-Q259 VanDerWaalsContact O-N 3.13Å; F256-L260 HydrophobicContact CE1-CD2 3.96Å; F256-L260 HydrophobicContact CZ-CD2 4.04Å; F256-L260 WeakPolarHBondContact O-CB 3.39Å; F256-L260 PolarHBondContact O-N 3.41Å; F256-P308 HydrophobicContact CE1-CG 4.39Å; F256-I762 HydrophobicContact CD2-CD1 4.4Å; F256-I762 HydrophobicContact CE1-CD1 4.08Å; F256-I762 HydrophobicContact CE1-CG1 4.46Å; F256-I762 HydrophobicContact CE2-CD1 3.57Å; F256-I762 HydrophobicContact CE2-CG1 4.31Å; F256-I762 HydrophobicContact CZ-CD1 3.38Å; F256-I762 HydrophobicContact CZ-CG1 3.74Å
257	G	79.4	Confident	81.4	Confident	5 Å²	5	54.3 Å²	54.3	5%	0.052	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-39.1	178.2	0	0	0	0	0	112.6	L253 D254 S261	L253-G257 PolarHBondContact O-N 3.29Å; D254-G257 PolarHBondContact O-N 3.21Å; G257-S261 VanDerWaalsContact O-CB 3.29Å; G257-S261 WeakPolarHBondContact O-CB 3.35Å; G257-S261 PolarHBondContact O-N 2.96Å
258	Q	82.6	Confident	81.4	Confident	108 Å²	108	54.8 Å²	54.8	51%	0.505	28%	0.278	S	S	.	.	H	α-helix	trans	-66.1	-40.8	173.9	-69.9	177.4	19	0	0	113	D254 E255 F256 K262	D254-Q258 WeakPolarHBondContact O-CG 3.38Å; D254-Q258 PolarHBondContact O-N 2.83Å; E255-Q258 PolarHBondContact O-N 3.03Å; F256-Q258 VanDerWaalsContact C-N 3.3Å; F256-Q258 PolarHBondContact O-N 3.03Å; Q258-K262 WeakPolarHBondContact O-CG 3.29Å; Q258-K262 PolarHBondContact O-N 2.85Å
259	Q	82.4	Confident	81.6	Confident	105 Å²	105	58.7 Å²	58.7	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-65.7	-46.5	176.7	-72.8	-178.4	7.7	0	0	111.1	E255 F256 S261 K262 V263	E255-Q259 WeakPolarHBondContact O-CG 3.44Å; E255-Q259 PolarHBondContact O-N 3.3Å; F256-Q259 PolarHBondContact O-N 3.08Å; F256-Q259 VanDerWaalsContact O-N 3.13Å; Q259-S261 PolarHBondContact O-N 3.37Å; Q259-K262 WeakPolarHBondContact O-CB 3.37Å; Q259-K262 PolarHBondContact O-N 2.66Å; Q259-V263 WeakPolarHBondContact O-CG2 3.49Å; Q259-V263 PolarHBondContact O-N 2.94Å
260	L	79.8	Confident	81.9	Confident	28 Å²	28	60.1 Å²	60.1	15%	0.147	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-46.1	178.6	-176.3	62.9	0	0	0	111.3	L61 F256 K262 V263 I264 A306	L61-L260 HydrophobicContact CD2-CD2 4.41Å; F256-L260 HydrophobicContact CE1-CD2 3.96Å; F256-L260 HydrophobicContact CZ-CD2 4.04Å; F256-L260 WeakPolarHBondContact O-CB 3.39Å; F256-L260 PolarHBondContact O-N 3.41Å; L260-K262 VanDerWaalsContact C-N 3.28Å; L260-K262 PolarHBondContact O-N 2.84Å; L260-V263 PolarHBondContact O-N 3.02Å; L260-I264 HydrophobicContact CD1-CD1 4.43Å; L260-I264 HydrophobicContact CD1-CG1 4.49Å; L260-I264 HydrophobicContact CG-CD1 3.97Å; L260-I264 HydrophobicContact CG-CG1 4.46Å; L260-I264 WeakPolarHBondContact O-CG1 3.25Å; L260-I264 PolarHBondContact O-N 3.16Å; L260-A306 WeakPolarHBondContact CD2-O 3.37Å
261	S	79.8	Confident	81.8	Confident	8 Å²	8	56.9 Å²	56.9	6%	0.056	30%	0.3	C	S	.	.	H	α-helix	trans	-56.6	-39.8	175.9	175.7	0	0	0	0	113	L60 I64 G257 Q259 S265	L60-S261 WeakPolarHBondContact CD2-OG 3.23Å; I64-S261 VanDerWaalsContact CD1-OG 3.28Å; I64-S261 WeakPolarHBondContact CD1-OG 3.34Å; G257-S261 VanDerWaalsContact O-CB 3.29Å; G257-S261 WeakPolarHBondContact O-CB 3.35Å; G257-S261 PolarHBondContact O-N 2.96Å; Q259-S261 PolarHBondContact O-N 3.37Å; S261-S265 WeakPolarHBondContact O-CB 3.47Å; S261-S265 PolarHBondContact O-N 3.48Å; S261-S265 PolarHBondContact O-OG 3.19Å
262	K	84.8	Confident	81.5	Confident	141 Å²	141	58.1 Å²	58.1	61%	0.613	30%	0.3	S	S	*	.	H	α-helix	trans	-65.9	-42.2	175.2	-71.2	169.2	-174.7	170.1	0	111.8	Q258 Q259 L260 S265 L266	Q258-K262 WeakPolarHBondContact O-CG 3.29Å; Q258-K262 PolarHBondContact O-N 2.85Å; Q259-K262 WeakPolarHBondContact O-CB 3.37Å; Q259-K262 PolarHBondContact O-N 2.66Å; L260-K262 VanDerWaalsContact C-N 3.28Å; L260-K262 PolarHBondContact O-N 2.84Å; K262-S265 PolarHBondContact O-N 3.06Å; K262-L266 WeakPolarHBondContact O-CB 3.18Å; K262-L266 PolarHBondContact O-N 3.36Å
263	V	82.3	Confident	81.5	Confident	79 Å²	79	60.7 Å²	60.7	48%	0.479	32%	0.318	S	S	.	.	H	α-helix	trans	-63.5	-48.4	177.2	173.4	0	0	0	0	110.5	Q259 L260 S265 L266 I267	Q259-V263 WeakPolarHBondContact O-CG2 3.49Å; Q259-V263 PolarHBondContact O-N 2.94Å; L260-V263 PolarHBondContact O-N 3.02Å; V263-S265 VanDerWaalsContact C-N 3.34Å; V263-S265 PolarHBondContact O-N 2.8Å; V263-L266 PolarHBondContact O-N 2.76Å; V263-I267 HydrophobicContact CG1-CD1 3.75Å; V263-I267 HydrophobicContact CG1-CG1 4.34Å; V263-I267 WeakPolarHBondContact O-CG1 3.48Å; V263-I267 PolarHBondContact O-N 3.13Å
264	I	81.4	Confident	81.5	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-55.3	-51.6	176.1	-66.3	169.1	0	0	0	110.1	L260 L266 I267 C268 A303 A306 I307	L260-I264 HydrophobicContact CD1-CD1 4.43Å; L260-I264 HydrophobicContact CD1-CG1 4.49Å; L260-I264 HydrophobicContact CG-CD1 3.97Å; L260-I264 HydrophobicContact CG-CG1 4.46Å; L260-I264 WeakPolarHBondContact O-CG1 3.25Å; L260-I264 PolarHBondContact O-N 3.16Å; I264-L266 VanDerWaalsContact C-N 3.29Å; I264-L266 PolarHBondContact O-N 3.36Å; I264-I267 PolarHBondContact O-N 3.39Å; I264-C268 WeakPolarHBondContact O-CB 3.3Å; I264-C268 PolarHBondContact O-N 2.92Å; I264-C268 PolarHBondContact O-SG 2.68Å; I264-A303 HydrophobicContact CG2-CB 4.25Å; I264-A306 HydrophobicContact CD1-CB 3.48Å; I264-A306 VanDerWaalsContact CD1-CB 3.48Å; I264-A306 HydrophobicContact CG1-CB 3.39Å; I264-I307 HydrophobicContact CD1-CD1 4.48Å; I264-I307 HydrophobicContact CD1-CG1 3.91Å
265	S	83.1	Confident	81.2	Confident	60 Å²	60	60.5 Å²	60.5	42%	0.42	32%	0.317	S	S	.	.	H	α-helix	trans	-57.8	-42.2	179.9	-59.1	0	0	0	0	112	S261 K262 V263 V269	S261-S265 WeakPolarHBondContact O-CB 3.47Å; S261-S265 PolarHBondContact O-N 3.48Å; S261-S265 PolarHBondContact O-OG 3.19Å; K262-S265 PolarHBondContact O-N 3.06Å; V263-S265 VanDerWaalsContact C-N 3.34Å; V263-S265 PolarHBondContact O-N 2.8Å; S265-V269 VanDerWaalsContact O-CG2 3.3Å; S265-V269 WeakPolarHBondContact O-CG2 3.47Å; S265-V269 PolarHBondContact O-N 3.45Å
266	L	86.8	Confident	80.9	Confident	124 Å²	124	60.3 Å²	60.3	65%	0.649	32%	0.317	S	S	*	.	H	α-helix	trans	-66.8	-42.1	178.5	-177.2	138.8	0	0	0	112.2	K262 V263 I264 V269 A270	K262-L266 WeakPolarHBondContact O-CB 3.18Å; K262-L266 PolarHBondContact O-N 3.36Å; V263-L266 PolarHBondContact O-N 2.76Å; I264-L266 VanDerWaalsContact C-N 3.29Å; I264-L266 PolarHBondContact O-N 3.36Å; L266-V269 PolarHBondContact O-N 2.69Å; L266-A270 WeakPolarHBondContact O-CB 3.39Å; L266-A270 PolarHBondContact O-N 3.33Å
267	I	82.4	Confident	80.4	Confident	31 Å²	31	61.4 Å²	61.4	16%	0.159	34%	0.339	C	S	.	.	H	α-helix	trans	-68.6	-42.9	177.5	-59.2	170.4	0	0	0	110.3	V263 I264 V269 A270 V271 L302 V769 F773	V263-I267 HydrophobicContact CG1-CD1 3.75Å; V263-I267 HydrophobicContact CG1-CG1 4.34Å; V263-I267 WeakPolarHBondContact O-CG1 3.48Å; V263-I267 PolarHBondContact O-N 3.13Å; I264-I267 PolarHBondContact O-N 3.39Å; I267-V269 VanDerWaalsContact C-N 3.31Å; I267-V269 PolarHBondContact O-N 3.39Å; I267-A270 WeakPolarHBondContact O-CB 3.44Å; I267-A270 PolarHBondContact O-N 3.18Å; I267-A270 VanDerWaalsContact O-N 3.09Å; I267-V271 HydrophobicContact CG2-CG2 4.15Å; I267-V271 WeakPolarHBondContact O-CG2 3.27Å; I267-V271 PolarHBondContact O-N 3.49Å; I267-L302 HydrophobicContact CB-CD2 3.97Å; I267-L302 HydrophobicContact CG2-CD1 4.27Å; I267-L302 HydrophobicContact CG2-CD2 3.43Å; I267-L302 VanDerWaalsContact CG2-CD2 3.43Å; I267-L302 HydrophobicContact CG2-CG 4.41Å; I267-V769 HydrophobicContact CD1-CG1 3.85Å; I267-F773 HydrophobicContact CG2-CD2 3.93Å; I267-F773 HydrophobicContact CG2-CE2 4.29Å
268	C	79.9	Confident	79.9	Confident	28 Å²	28	65 Å²	65	19%	0.189	36%	0.355	C	S	.	.	H	α-helix	trans	-56.1	-45.5	174.7	-71.4	0	0	0	0	111.6	I264 W272	I264-C268 WeakPolarHBondContact O-CB 3.3Å; I264-C268 PolarHBondContact O-N 2.92Å; I264-C268 PolarHBondContact O-SG 2.68Å; C268-W272 WeakPolarHBondContact O-CB 3.43Å; C268-W272 PolarHBondContact O-N 2.8Å
269	V	83.8	Confident	79.4	Confident	92 Å²	92	59.9 Å²	59.9	56%	0.558	33%	0.331	S	S	*	.	H	α-helix	trans	-64.6	-42.1	175.1	172	0	0	0	0	111.3	S265 L266 I267 W272 V273	S265-V269 VanDerWaalsContact O-CG2 3.3Å; S265-V269 WeakPolarHBondContact O-CG2 3.47Å; S265-V269 PolarHBondContact O-N 3.45Å; L266-V269 PolarHBondContact O-N 2.69Å; I267-V269 VanDerWaalsContact C-N 3.31Å; I267-V269 PolarHBondContact O-N 3.39Å; V269-W272 PolarHBondContact O-N 3.1Å; V269-V273 HydrophobicContact CG1-CG2 4.2Å; V269-V273 WeakPolarHBondContact O-CB 3.16Å; V269-V273 VanDerWaalsContact O-CG2 3.29Å; V269-V273 WeakPolarHBondContact O-CG2 3.29Å; V269-V273 PolarHBondContact O-N 3.25Å
270	A	82.6	Confident	78.3	Confident	35 Å²	35	57.2 Å²	57.2	29%	0.289	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-46.8	178.6	0	0	0	0	0	112	L266 I267 W272 V273 I274	L266-A270 WeakPolarHBondContact O-CB 3.39Å; L266-A270 PolarHBondContact O-N 3.33Å; I267-A270 WeakPolarHBondContact O-CB 3.44Å; I267-A270 PolarHBondContact O-N 3.18Å; I267-A270 VanDerWaalsContact O-N 3.09Å; A270-W272 VanDerWaalsContact C-N 3.31Å; A270-W272 PolarHBondContact O-N 3.46Å; A270-V273 PolarHBondContact O-N 3.01Å; A270-I274 WeakPolarHBondContact O-CB 3.3Å; A270-I274 WeakPolarHBondContact O-CD1 3.49Å; A270-I274 WeakPolarHBondContact O-CG1 3.38Å; A270-I274 PolarHBondContact O-N 3.45Å
271	V	77.3	Confident	77.7	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.024	34%	0.336	C	S	.	.	H	α-helix	trans	-59.3	-44	175.1	171.8	0	0	0	0	110.2	I267 N275 I298 F773	I267-V271 HydrophobicContact CG2-CG2 4.15Å; I267-V271 WeakPolarHBondContact O-CG2 3.27Å; I267-V271 PolarHBondContact O-N 3.49Å; V271-N275 VanDerWaalsContact O-CB 3.26Å; V271-N275 WeakPolarHBondContact O-CB 3.47Å; V271-N275 PolarHBondContact O-N 3.47Å; V271-N275 VanDerWaalsContact O-N 3.11Å; V271-N275 PolarHBondContact O-ND2 2.81Å; V271-I298 HydrophobicContact CG1-CG2 4.12Å; V271-F773 HydrophobicContact CG2-CD2 3.95Å; V271-F773 HydrophobicContact CG2-CE2 4.26Å
272	W	77.7	Confident	76.6	Confident	120 Å²	120	63 Å²	63	46%	0.455	37%	0.368	S	S	.	.	H	α-helix	trans	-63.4	-45.1	178.2	-168.1	88.1	0	0	0	112.5	C268 V269 A270 N275 I276 F279	C268-W272 WeakPolarHBondContact O-CB 3.43Å; C268-W272 PolarHBondContact O-N 2.8Å; V269-W272 PolarHBondContact O-N 3.1Å; A270-W272 VanDerWaalsContact C-N 3.31Å; A270-W272 PolarHBondContact O-N 3.46Å; W272-N275 PolarHBondContact O-N 3.27Å; W272-I276 HydrophobicContact CE3-CD1 4.4Å; W272-I276 HydrophobicContact CH2-CD1 3.49Å; W272-I276 VanDerWaalsContact CH2-CD1 3.49Å; W272-I276 HydrophobicContact CH2-CG1 4.27Å; W272-I276 HydrophobicContact CZ2-CD1 4.18Å; W272-I276 HydrophobicContact CZ3-CD1 3.63Å; W272-I276 HydrophobicContact CZ3-CG1 4.46Å; W272-I276 PolarHBondContact O-N 3.26Å; W272-F279 AromaticContact CD1-CZ 3.65Å; W272-F279 AromaticContact CE2-CE2 3.93Å; W272-F279 HydrophobicContact CG-CZ 4.31Å; W272-F279 HydrophobicContact CZ2-CE2 4.21Å; W272-F279 AromaticContact NE1-CE2 3.52Å; W272-F279 AromaticContact NE1-CZ 3.42Å
273	V	82.2	Confident	75	Confident	86 Å²	86	58.6 Å²	58.6	52%	0.521	35%	0.353	S	S	.	.	H	α-helix	trans	-66.4	-41.8	179.2	170.4	0	0	0	0	112.1	V269 A270 N275 I276	V269-V273 HydrophobicContact CG1-CG2 4.2Å; V269-V273 WeakPolarHBondContact O-CB 3.16Å; V269-V273 VanDerWaalsContact O-CG2 3.29Å; V269-V273 WeakPolarHBondContact O-CG2 3.29Å; V269-V273 PolarHBondContact O-N 3.25Å; A270-V273 PolarHBondContact O-N 3.01Å; V273-N275 PolarHBondContact O-N 3.42Å; V273-I276 WeakPolarHBondContact O-CG2 3.1Å
274	I	79.3	Confident	73.8	Confident	85 Å²	85	55.7 Å²	55.7	44%	0.436	33%	0.334	S	S	.	.	H	α-helix	trans	-62.4	-37.5	177.6	-70	165.9	0	0	0	110.2	A270 I777	A270-I274 WeakPolarHBondContact O-CB 3.3Å; A270-I274 WeakPolarHBondContact O-CD1 3.49Å; A270-I274 WeakPolarHBondContact O-CG1 3.38Å; A270-I274 PolarHBondContact O-N 3.45Å; I274-I777 HydrophobicContact CD1-CD1 3.98Å; I274-I777 HydrophobicContact CD1-CG1 4.32Å
275	N	72.9	Confident	72.5	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.037	36%	0.361	C	S	.	.	H	α-helix	trans	-97.3	-6	-171.8	-72	-57.1	0	0	0	115.2	V271 W272 V273 G277 H278 F279 Y295	V271-N275 VanDerWaalsContact O-CB 3.26Å; V271-N275 WeakPolarHBondContact O-CB 3.47Å; V271-N275 PolarHBondContact O-N 3.47Å; V271-N275 VanDerWaalsContact O-N 3.11Å; V271-N275 PolarHBondContact O-ND2 2.81Å; W272-N275 PolarHBondContact O-N 3.27Å; V273-N275 PolarHBondContact O-N 3.42Å; N275-G277 PolarHBondContact O-N 2.91Å; N275-G277 VanDerWaalsContact O-N 3.1Å; N275-H278 WeakPolarHBondContact O-CA 3.36Å; N275-H278 WeakPolarHBondContact O-CB 3.33Å; N275-H278 PolarHBondContact O-N 2.77Å; N275-F279 HydrophobicContact CB-CE1 4.22Å; N275-F279 WeakPolarHBondContact O-CD1 3.43Å; N275-F279 WeakPolarHBondContact O-CE1 3.42Å; N275-Y295 HydrophobicContact CB-CD1 3.5Å; N275-Y295 VanDerWaalsContact CB-CD1 3.5Å; N275-Y295 HydrophobicContact CB-CD2 4.13Å; N275-Y295 HydrophobicContact CB-CE1 3.23Å; N275-Y295 HydrophobicContact CB-CE2 3.88Å; N275-Y295 HydrophobicContact CB-CG 3.94Å; N275-Y295 VanDerWaalsContact CB-CZ 3.41Å; N275-Y295 WeakPolarHBondContact ND2-CE1 3.35Å; N275-Y295 VanDerWaalsContact OD1-CE1 3.29Å; N275-Y295 WeakPolarHBondContact OD1-CE1 3.33Å; N275-Y295 PolarHBondContact OD1-OH 2.97Å
276	I	77.4	Confident	71.1	Confident	76 Å²	76	58 Å²	58	39%	0.39	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-56.7	-31.5	-179.7	-159.3	177.7	0	0	0	112.8	W272 V273 H278 F279	W272-I276 HydrophobicContact CE3-CD1 4.4Å; W272-I276 HydrophobicContact CH2-CD1 3.49Å; W272-I276 VanDerWaalsContact CH2-CD1 3.49Å; W272-I276 HydrophobicContact CH2-CG1 4.27Å; W272-I276 HydrophobicContact CZ2-CD1 4.18Å; W272-I276 HydrophobicContact CZ3-CD1 3.63Å; W272-I276 HydrophobicContact CZ3-CG1 4.46Å; W272-I276 PolarHBondContact O-N 3.26Å; V273-I276 WeakPolarHBondContact O-CG2 3.1Å; I276-H278 PolarHBondContact O-N 3.27Å; I276-F279 PolarHBondContact O-N 3.17Å
277	G	70.2	Confident	70.1	Confident	61 Å²	61	54.3 Å²	54.3	63%	0.629	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-67.1	-20.9	176.3	0	0	0	0	0	113.9	N275	N275-G277 PolarHBondContact O-N 2.91Å; N275-G277 VanDerWaalsContact O-N 3.1Å
278	H	69.9	Low	69.7	Low	82 Å²	82	60 Å²	60	38%	0.38	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-98.9	-2.5	-177.8	-69	-71.6	0	0	0	113.4	N275 I276 G280 D281 Y295	N275-H278 WeakPolarHBondContact O-CA 3.36Å; N275-H278 WeakPolarHBondContact O-CB 3.33Å; N275-H278 PolarHBondContact O-N 2.77Å; I276-H278 PolarHBondContact O-N 3.27Å; H278-G280 PolarHBondContact O-N 3.16Å; H278-D281 IonicContact CG-OD2 3.59Å; H278-D281 IonicContact ND1-OD2 2.73Å; H278-D281 PolarHBondContact ND1-OD2 2.86Å; H278-D281 WeakPolarHBondContact O-CB 3.43Å; H278-D281 PolarHBondContact O-N 2.85Å; H278-Y295 HydrophobicContact CB-CE2 4.33Å; H278-Y295 WeakPolarHBondContact CB-OH 3.36Å
279	F	71.4	Confident	69.1	Low	0 Å²	0	63 Å²	63	0%	0	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-27.1	-178.4	-76.5	20.6	0	0	0	113	W272 N275 I276 W288 A292 Y295	W272-F279 AromaticContact CD1-CZ 3.65Å; W272-F279 AromaticContact CE2-CE2 3.93Å; W272-F279 HydrophobicContact CG-CZ 4.31Å; W272-F279 HydrophobicContact CZ2-CE2 4.21Å; W272-F279 AromaticContact NE1-CE2 3.52Å; W272-F279 AromaticContact NE1-CZ 3.42Å; N275-F279 HydrophobicContact CB-CE1 4.22Å; N275-F279 WeakPolarHBondContact O-CD1 3.43Å; N275-F279 WeakPolarHBondContact O-CE1 3.42Å; I276-F279 PolarHBondContact O-N 3.17Å; F279-W288 HydrophobicContact CB-CG 4.35Å; F279-W288 HydrophobicContact CD2-CD2 4.46Å; F279-W288 AromaticContact CD2-CE2 3.75Å; F279-W288 AromaticContact CD2-CZ2 3.81Å; F279-W288 HydrophobicContact CD2-CZ2 3.81Å; F279-W288 AromaticContact CD2-NE1 3.78Å; F279-W288 HydrophobicContact CE2-CZ2 4.37Å; F279-A292 HydrophobicContact CD2-CB 4.26Å; F279-A292 HydrophobicContact CE2-CB 4.22Å; F279-Y295 AromaticContact CD1-CD2 3.42Å; F279-Y295 HydrophobicContact CD1-CD2 3.42Å; F279-Y295 VanDerWaalsContact CD1-CD2 3.42Å; F279-Y295 AromaticContact CD1-CE2 3.76Å; F279-Y295 HydrophobicContact CD1-CE2 3.76Å; F279-Y295 HydrophobicContact CD1-CG 4.34Å; F279-Y295 AromaticContact CE1-CD2 3.18Å; F279-Y295 HydrophobicContact CE1-CD2 3.18Å; F279-Y295 AromaticContact CE1-CE2 3.87Å; F279-Y295 HydrophobicContact CE1-CE2 3.87Å; F279-Y295 AromaticContact CE1-CG 3.65Å; F279-Y295 HydrophobicContact CE1-CG 3.65Å; F279-Y295 HydrophobicContact CZ-CD2 4.19Å; F279-Y295 HydrophobicContact CZ-CG 4.41Å
280	G	60.3	Low	68.3	Low	48 Å²	48	65.5 Å²	65.5	50%	0.495	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	5.1	178.7	0	0	0	0	0	114.4	H278	H278-G280 PolarHBondContact O-N 3.16Å
281	D	65.5	Low	67.8	Low	47 Å²	47	63.8 Å²	63.8	25%	0.251	38%	0.375	S	S	.	.			trans	-62.5	139.6	-175.4	-79.2	-16.2	0	0	0	111.1	H278 V283 H284	H278-D281 IonicContact CG-OD2 3.59Å; H278-D281 IonicContact ND1-OD2 2.73Å; H278-D281 PolarHBondContact ND1-OD2 2.86Å; H278-D281 WeakPolarHBondContact O-CB 3.43Å; H278-D281 PolarHBondContact O-N 2.85Å; D281-V283 HydrophobicContact CB-CB 4.14Å; D281-V283 HydrophobicContact CB-CG2 4.12Å; D281-V283 PolarHBondContact O-N 3.27Å; D281-H284 PolarHBondContact O-N 3.43Å
282	P	57.5	Low	67.6	Low	112 Å²	112	65 Å²	65	73%	0.727	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-53.2	-25.5	-178.2	-24.3	31.6	0	0	0	113.7	H284 G285 G286	P282-H284 PolarHBondContact O-N 3.06Å; P282-G285 PolarHBondContact O-N 3.49Å; P282-G286 PolarHBondContact O-N 3.32Å
283	V	52.3	Low	67.3	Low	47 Å²	47	62.7 Å²	62.7	29%	0.285	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-41.8	-42.4	170	170.7	0	0	0	0	114.1	D281 G285 M871 Q872	D281-V283 HydrophobicContact CB-CB 4.14Å; D281-V283 HydrophobicContact CB-CG2 4.12Å; D281-V283 PolarHBondContact O-N 3.27Å; V283-G285 PolarHBondContact O-N 2.82Å; V283-M871 HydrophobicContact CB-CB 4.44Å; V283-M871 HydrophobicContact CG1-CB 3.5Å; V283-M871 HydrophobicContact CG1-CG 3.9Å; V283-M871 HydrophobicContact CG1-SD 3.75Å; V283-M871 HydrophobicContact CG2-CB 4.09Å; V283-M871 WeakPolarHBondContact CG2-O 3.34Å; V283-Q872 HydrophobicContact CG2-CG 3.94Å
284	H	56.8	Low	66.8	Low	18 Å²	18	61 Å²	61	8%	0.083	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-88.5	20.6	-176.8	-57.1	93.1	0	0	0	112.3	D281 P282 G286 R290 G291	D281-H284 PolarHBondContact O-N 3.43Å; P282-H284 PolarHBondContact O-N 3.06Å; H284-G286 VanDerWaalsContact C-N 3.33Å; H284-R290 HydrophobicContact CB-CB 3.81Å; H284-R290 WeakPolarHBondContact O-CB 3.47Å; H284-R290 WeakPolarHBondContact O-CD 3.37Å; H284-G291 WeakPolarHBondContact CD2-CA 3.43Å; H284-G291 PolarHBondContact CD2-N 3.38Å; H284-G291 VanDerWaalsContact CG-CA 3.48Å
285	G	52.3	Low	66.6	Low	58 Å²	58	57.6 Å²	57.6	60%	0.598	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	20.4	-170.8	0	0	0	0	0	113.7	P282 V283 S287	P282-G285 PolarHBondContact O-N 3.49Å; V283-G285 PolarHBondContact O-N 2.82Å; G285-S287 PolarHBondContact O-N 3.21Å
286	G	55.8	Low	66.7	Low	56 Å²	56	62 Å²	62	58%	0.577	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	7.9	-175	0	0	0	0	0	114.8	P282 H284	P282-G286 PolarHBondContact O-N 3.32Å; H284-G286 VanDerWaalsContact C-N 3.33Å
287	S	64.4	Low	66.5	Low	48 Å²	48	61.9 Å²	61.9	34%	0.336	36%	0.363	S	S	.	.			trans	-100.7	117.1	179.3	-177.5	0	0	0	0	110.9	G285 V289 R290 G291	G285-S287 PolarHBondContact O-N 3.21Å; S287-V289 PolarHBondContact O-N 2.9Å; S287-V289 PolarHBondContact OG-N 2.88Å; S287-R290 PolarHBondContact O-N 3.26Å; S287-G291 PolarHBondContact O-N 3.26Å
288	W	73.3	Confident	66.8	Low	150 Å²	150	59.4 Å²	59.4	57%	0.568	34%	0.336	S	S	*	.	H	α-helix	trans	-53.6	-26.4	174	-163.1	78.7	0	0	0	112.7	F279 A292	F279-W288 HydrophobicContact CB-CG 4.35Å; F279-W288 HydrophobicContact CD2-CD2 4.46Å; F279-W288 AromaticContact CD2-CE2 3.75Å; F279-W288 AromaticContact CD2-CZ2 3.81Å; F279-W288 HydrophobicContact CD2-CZ2 3.81Å; F279-W288 AromaticContact CD2-NE1 3.78Å; F279-W288 HydrophobicContact CE2-CZ2 4.37Å; W288-A292 WeakPolarHBondContact O-CB 3.44Å; W288-A292 PolarHBondContact O-N 3.38Å
289	V	69.1	Low	67.1	Low	90 Å²	90	56.5 Å²	56.5	55%	0.545	33%	0.326	S	S	.	.	H	α-helix	trans	-68	-42.1	179	-178.3	0	0	0	0	111.9	S287 A292 I293	S287-V289 PolarHBondContact O-N 2.9Å; S287-V289 PolarHBondContact OG-N 2.88Å; V289-A292 PolarHBondContact O-N 2.85Å; V289-I293 HydrophobicContact CG1-CD1 4.03Å; V289-I293 WeakPolarHBondContact O-CD1 3.38Å; V289-I293 VanDerWaalsContact O-CG1 3.27Å; V289-I293 WeakPolarHBondContact O-CG1 3.35Å; V289-I293 PolarHBondContact O-N 2.99Å
290	R	65.7	Low	67.2	Low	145 Å²	145	56.9 Å²	56.9	55%	0.547	33%	0.328	S	S	.	.	H	α-helix	trans	-71.9	-36.8	-179.3	-79.2	-179.6	176.7	179.3	-0.6	111.9	H284 S287 I293 Y294	H284-R290 HydrophobicContact CB-CB 3.81Å; H284-R290 WeakPolarHBondContact O-CB 3.47Å; H284-R290 WeakPolarHBondContact O-CD 3.37Å; S287-R290 PolarHBondContact O-N 3.26Å; R290-I293 PolarHBondContact O-N 3.42Å; R290-Y294 PolarHBondContact O-N 3.05Å
291	G	71.6	Confident	67.9	Low	0 Å²	0	55 Å²	55	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-64.6	-43	171	0	0	0	0	0	112.7	H284 S287 I293 Y294 Y295	H284-G291 WeakPolarHBondContact CD2-CA 3.43Å; H284-G291 PolarHBondContact CD2-N 3.38Å; H284-G291 VanDerWaalsContact CG-CA 3.48Å; S287-G291 PolarHBondContact O-N 3.26Å; G291-I293 VanDerWaalsContact C-N 3.3Å; G291-I293 PolarHBondContact O-N 2.76Å; G291-Y294 PolarHBondContact O-N 3.3Å; G291-Y295 VanDerWaalsContact O-CD2 3.27Å; G291-Y295 WeakPolarHBondContact O-CD2 3.32Å; G291-Y295 PolarHBondContact O-N 2.97Å; G291-Y295 VanDerWaalsContact O-N 3.12Å
292	A	73.8	Confident	68.5	Low	29 Å²	29	53 Å²	53	24%	0.24	30%	0.298	C	S	.	.	H	α-helix	trans	-59.8	-41.3	173.4	0	0	0	0	0	111.9	F279 W288 V289 F296	F279-A292 HydrophobicContact CD2-CB 4.26Å; F279-A292 HydrophobicContact CE2-CB 4.22Å; W288-A292 WeakPolarHBondContact O-CB 3.44Å; W288-A292 PolarHBondContact O-N 3.38Å; V289-A292 PolarHBondContact O-N 2.85Å; A292-F296 WeakPolarHBondContact O-CB 3.39Å; A292-F296 PolarHBondContact O-N 2.79Å
293	I	71.7	Confident	69.5	Low	71 Å²	71	48.1 Å²	48.1	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-45.4	175.9	-74.2	164	0	0	0	111.7	L75 V289 R290 G291 F296 K297	L75-I293 HydrophobicContact CD2-CB 4.37Å; L75-I293 HydrophobicContact CD2-CG1 4.18Å; L75-I293 HydrophobicContact CD2-CG2 3.52Å; V289-I293 HydrophobicContact CG1-CD1 4.03Å; V289-I293 WeakPolarHBondContact O-CD1 3.38Å; V289-I293 VanDerWaalsContact O-CG1 3.27Å; V289-I293 WeakPolarHBondContact O-CG1 3.35Å; V289-I293 PolarHBondContact O-N 2.99Å; R290-I293 PolarHBondContact O-N 3.42Å; G291-I293 VanDerWaalsContact C-N 3.3Å; G291-I293 PolarHBondContact O-N 2.76Å; I293-F296 WeakPolarHBondContact O-CB 3.47Å; I293-F296 PolarHBondContact O-N 3.38Å; I293-K297 PolarHBondContact O-N 3.4Å
294	Y	72.5	Confident	70.6	Confident	50 Å²	50	45.9 Å²	45.9	20%	0.196	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-51.3	-179.9	179.1	-104.3	0	0	0	112.5	R290 G291 F296 K297 I298 M871	R290-Y294 PolarHBondContact O-N 3.05Å; G291-Y294 PolarHBondContact O-N 3.3Å; Y294-F296 PolarHBondContact O-N 3.33Å; Y294-K297 WeakPolarHBondContact O-CB 3.46Å; Y294-K297 PolarHBondContact O-N 3.11Å; Y294-K297 VanDerWaalsContact O-N 3.11Å; Y294-I298 HydrophobicContact CD1-CD1 4.11Å; Y294-I298 HydrophobicContact CE1-CD1 3.54Å; Y294-I298 HydrophobicContact CE1-CG1 4.46Å; Y294-I298 PolarHBondContact O-N 3.46Å; Y294-M871 HydrophobicContact CE1-SD 4.4Å
295	Y	75.2	Confident	71.8	Confident	14 Å²	14	45 Å²	45	6%	0.055	25%	0.249	C	C	.	.	H	α-helix	trans	-68.5	-22.8	177.8	-72.1	-68.8	0	0	0	113.1	N275 H278 F279 G291 I298 A299	N275-Y295 HydrophobicContact CB-CD1 3.5Å; N275-Y295 VanDerWaalsContact CB-CD1 3.5Å; N275-Y295 HydrophobicContact CB-CD2 4.13Å; N275-Y295 HydrophobicContact CB-CE1 3.23Å; N275-Y295 HydrophobicContact CB-CE2 3.88Å; N275-Y295 HydrophobicContact CB-CG 3.94Å; N275-Y295 VanDerWaalsContact CB-CZ 3.41Å; N275-Y295 WeakPolarHBondContact ND2-CE1 3.35Å; N275-Y295 VanDerWaalsContact OD1-CE1 3.29Å; N275-Y295 WeakPolarHBondContact OD1-CE1 3.33Å; N275-Y295 PolarHBondContact OD1-OH 2.97Å; H278-Y295 HydrophobicContact CB-CE2 4.33Å; H278-Y295 WeakPolarHBondContact CB-OH 3.36Å; F279-Y295 AromaticContact CD1-CD2 3.42Å; F279-Y295 HydrophobicContact CD1-CD2 3.42Å; F279-Y295 VanDerWaalsContact CD1-CD2 3.42Å; F279-Y295 AromaticContact CD1-CE2 3.76Å; F279-Y295 HydrophobicContact CD1-CE2 3.76Å; F279-Y295 HydrophobicContact CD1-CG 4.34Å; F279-Y295 AromaticContact CE1-CD2 3.18Å; F279-Y295 HydrophobicContact CE1-CD2 3.18Å; F279-Y295 AromaticContact CE1-CE2 3.87Å; F279-Y295 HydrophobicContact CE1-CE2 3.87Å; F279-Y295 AromaticContact CE1-CG 3.65Å; F279-Y295 HydrophobicContact CE1-CG 3.65Å; F279-Y295 HydrophobicContact CZ-CD2 4.19Å; F279-Y295 HydrophobicContact CZ-CG 4.41Å; G291-Y295 VanDerWaalsContact O-CD2 3.27Å; G291-Y295 WeakPolarHBondContact O-CD2 3.32Å; G291-Y295 PolarHBondContact O-N 2.97Å; G291-Y295 VanDerWaalsContact O-N 3.12Å; Y295-I298 HydrophobicContact CD1-CD1 3.97Å; Y295-I298 HydrophobicContact CE1-CD1 4.26Å; Y295-A299 PolarHBondContact O-N 3.4Å; Y295-A299 VanDerWaalsContact O-N 3.09Å
296	F	73.8	Confident	73.2	Confident	101 Å²	101	42.6 Å²	42.6	44%	0.443	22%	0.223	S	C	.	.	H	α-helix	trans	-74.1	-37.4	170.9	-162.6	-119.7	0	0	0	112.2	V71 A292 I293 Y294 I298 A299 V300	V71-F296 HydrophobicContact CB-CE1 3.9Å; V71-F296 HydrophobicContact CB-CZ 4.49Å; V71-F296 HydrophobicContact CG1-CD1 3.49Å; V71-F296 VanDerWaalsContact CG1-CD1 3.49Å; V71-F296 HydrophobicContact CG1-CE1 3.11Å; V71-F296 HydrophobicContact CG1-CZ 4.04Å; V71-F296 HydrophobicContact CG2-CE1 3.44Å; V71-F296 VanDerWaalsContact CG2-CE1 3.44Å; V71-F296 HydrophobicContact CG2-CZ 3.65Å; A292-F296 WeakPolarHBondContact O-CB 3.39Å; A292-F296 PolarHBondContact O-N 2.79Å; I293-F296 WeakPolarHBondContact O-CB 3.47Å; I293-F296 PolarHBondContact O-N 3.38Å; Y294-F296 PolarHBondContact O-N 3.33Å; F296-I298 VanDerWaalsContact C-N 3.33Å; F296-I298 PolarHBondContact O-N 3.48Å; F296-A299 WeakPolarHBondContact O-CB 3.42Å; F296-A299 PolarHBondContact O-N 3.05Å; F296-A299 VanDerWaalsContact O-N 3.14Å; F296-V300 PolarHBondContact O-N 2.91Å
297	K	73.3	Confident	74.4	Confident	72 Å²	72	40.2 Å²	40.2	31%	0.313	20%	0.197	S	C	.	.	H	α-helix	trans	-59.7	-42	169.7	-175	-179.4	177.1	179.7	0	111.3	L75 I293 Y294 A299 V300 A301	L75-K297 HydrophobicContact CD1-CB 4.39Å; I293-K297 PolarHBondContact O-N 3.4Å; Y294-K297 WeakPolarHBondContact O-CB 3.46Å; Y294-K297 PolarHBondContact O-N 3.11Å; Y294-K297 VanDerWaalsContact O-N 3.11Å; K297-A299 VanDerWaalsContact C-N 3.33Å; K297-A299 PolarHBondContact O-N 3.19Å; K297-V300 WeakPolarHBondContact O-CB 3.45Å; K297-V300 PolarHBondContact O-N 2.82Å; K297-A301 PolarHBondContact O-N 2.85Å
298	I	76.4	Confident	75.3	Confident	9 Å²	9	38.5 Å²	38.5	5%	0.046	19%	0.185	C	C	.	.	H	α-helix	trans	-61	-41.6	172.6	-66.6	175.8	0	0	0	111.3	V271 Y294 Y295 F296 V300 A301 L302 I772 A776	V271-I298 HydrophobicContact CG1-CG2 4.12Å; Y294-I298 HydrophobicContact CD1-CD1 4.11Å; Y294-I298 HydrophobicContact CE1-CD1 3.54Å; Y294-I298 HydrophobicContact CE1-CG1 4.46Å; Y294-I298 PolarHBondContact O-N 3.46Å; Y295-I298 HydrophobicContact CD1-CD1 3.97Å; Y295-I298 HydrophobicContact CE1-CD1 4.26Å; F296-I298 VanDerWaalsContact C-N 3.33Å; F296-I298 PolarHBondContact O-N 3.48Å; I298-V300 VanDerWaalsContact C-N 3.31Å; I298-V300 PolarHBondContact O-N 2.88Å; I298-A301 PolarHBondContact O-N 3.03Å; I298-L302 VanDerWaalsContact O-CB 3.22Å; I298-L302 WeakPolarHBondContact O-CB 3.26Å; I298-L302 PolarHBondContact O-N 3.14Å; I298-I772 HydrophobicContact CG2-CG2 4.08Å; I298-A776 HydrophobicContact CD1-CB 4.35Å; I298-A776 HydrophobicContact CG2-CB 4.2Å
299	A	75.7	Confident	75.6	Confident	21 Å²	21	31.7 Å²	31.7	17%	0.174	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-36.1	177.2	0	0	0	0	0	112.4	Y295 F296 K297 A303	Y295-A299 PolarHBondContact O-N 3.4Å; Y295-A299 VanDerWaalsContact O-N 3.09Å; F296-A299 WeakPolarHBondContact O-CB 3.42Å; F296-A299 PolarHBondContact O-N 3.05Å; F296-A299 VanDerWaalsContact O-N 3.14Å; K297-A299 VanDerWaalsContact C-N 3.33Å; K297-A299 PolarHBondContact O-N 3.19Å; A299-A303 WeakPolarHBondContact O-CB 3.43Å; A299-A303 PolarHBondContact O-N 3.1Å
300	V	73.4	Confident	76.1	Confident	9 Å²	9	27.5 Å²	27.5	6%	0.055	13%	0.134	C	C	.	.	H	α-helix	trans	-66.4	-48.8	172.7	169.9	0	0	0	0	111.2	A68 V71 F296 K297 I298 L302 A303 V304	A68-V300 HydrophobicContact CB-CG1 4.02Å; V71-V300 HydrophobicContact CB-CG2 4.18Å; V71-V300 HydrophobicContact CG1-CG2 3.57Å; F296-V300 PolarHBondContact O-N 2.91Å; K297-V300 WeakPolarHBondContact O-CB 3.45Å; K297-V300 PolarHBondContact O-N 2.82Å; I298-V300 VanDerWaalsContact C-N 3.31Å; I298-V300 PolarHBondContact O-N 2.88Å; V300-L302 VanDerWaalsContact C-N 3.27Å; V300-L302 PolarHBondContact O-N 2.83Å; V300-A303 WeakPolarHBondContact O-CB 3.33Å; V300-A303 PolarHBondContact O-N 2.89Å; V300-A303 VanDerWaalsContact O-N 3.11Å; V300-V304 WeakPolarHBondContact O-CG2 2.94Å; V300-V304 PolarHBondContact O-N 3.11Å
301	A	75.1	Confident	77	Confident	9 Å²	9	21.1 Å²	21.1	7%	0.074	11%	0.111	C	C	.	.	H	α-helix	trans	-58.7	-40.9	177.5	0	0	0	0	0	111.9	K297 I298 V304 A305 I772 P786	K297-A301 PolarHBondContact O-N 2.85Å; I298-A301 PolarHBondContact O-N 3.03Å; A301-V304 PolarHBondContact O-N 2.89Å; A301-A305 VanDerWaalsContact O-CB 3.3Å; A301-A305 WeakPolarHBondContact O-CB 3.11Å; A301-A305 PolarHBondContact O-N 2.85Å; A301-I772 HydrophobicContact CB-CD1 4.16Å; A301-I772 WeakPolarHBondContact O-CD1 3.19Å; A301-P786 HydrophobicContact CB-CG 3.78Å
302	L	79.3	Confident	77.4	Confident	4 Å²	4	24.5 Å²	24.5	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-65	-40.3	175.4	-174.7	73.1	0	0	0	112.5	I267 I298 V300 A306 V769 I772	I267-L302 HydrophobicContact CB-CD2 3.97Å; I267-L302 HydrophobicContact CG2-CD1 4.27Å; I267-L302 HydrophobicContact CG2-CD2 3.43Å; I267-L302 VanDerWaalsContact CG2-CD2 3.43Å; I267-L302 HydrophobicContact CG2-CG 4.41Å; I298-L302 VanDerWaalsContact O-CB 3.22Å; I298-L302 WeakPolarHBondContact O-CB 3.26Å; I298-L302 PolarHBondContact O-N 3.14Å; V300-L302 VanDerWaalsContact C-N 3.27Å; V300-L302 PolarHBondContact O-N 2.83Å; L302-A306 WeakPolarHBondContact O-CB 3.29Å; L302-A306 PolarHBondContact O-N 3.14Å; L302-A306 VanDerWaalsContact O-N 3.1Å; L302-V769 HydrophobicContact CD1-CB 4.44Å; L302-V769 HydrophobicContact CD1-CG1 4Å; L302-V769 HydrophobicContact CD1-CG2 4.37Å; L302-I772 HydrophobicContact CB-CG2 4.33Å; L302-I772 HydrophobicContact CD1-CB 4.29Å; L302-I772 HydrophobicContact CD1-CG2 4.14Å
303	A	77.8	Confident	77.8	Confident	9 Å²	9	24.6 Å²	24.6	7%	0.074	13%	0.134	C	C	.	.	H	α-helix	trans	-64.7	-41.3	177.2	0	0	0	0	0	111.6	I64 I264 A299 V300 I307	I64-A303 HydrophobicContact CG2-CB 4.12Å; I264-A303 HydrophobicContact CG2-CB 4.25Å; A299-A303 WeakPolarHBondContact O-CB 3.43Å; A299-A303 PolarHBondContact O-N 3.1Å; V300-A303 WeakPolarHBondContact O-CB 3.33Å; V300-A303 PolarHBondContact O-N 2.89Å; V300-A303 VanDerWaalsContact O-N 3.11Å; A303-I307 WeakPolarHBondContact O-CD1 3.19Å; A303-I307 VanDerWaalsContact O-CG1 3.29Å; A303-I307 WeakPolarHBondContact O-CG1 3.18Å
304	V	76.1	Confident	78.6	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-51.4	174.1	173	0	0	0	0	110.6	L65 I94 V300 A301 A306 I307 L790	L65-V304 HydrophobicContact CD2-CG2 4.39Å; I94-V304 HydrophobicContact CD1-CG2 4.41Å; V300-V304 WeakPolarHBondContact O-CG2 2.94Å; V300-V304 PolarHBondContact O-N 3.11Å; A301-V304 PolarHBondContact O-N 2.89Å; V304-A306 PolarHBondContact O-N 2.93Å; V304-A306 VanDerWaalsContact O-N 3.08Å; V304-I307 PolarHBondContact O-N 3.4Å; V304-I307 VanDerWaalsContact O-N 3.12Å; V304-L790 HydrophobicContact CG1-CD1 4.44Å; V304-L790 HydrophobicContact CG1-CD2 3.61Å; V304-L790 HydrophobicContact CG1-CG 3.74Å
305	A	80.9	Confident	79.2	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-55.7	-31.1	179.3	0	0	0	0	0	114.3	A301 N765 E768 V769 I772 L789	A301-A305 VanDerWaalsContact O-CB 3.3Å; A301-A305 WeakPolarHBondContact O-CB 3.11Å; A301-A305 PolarHBondContact O-N 2.85Å; A305-N765 WeakPolarHBondContact O-CB 3.32Å; A305-N765 PolarHBondContact O-ND2 2.85Å; A305-E768 HydrophobicContact CB-CB 3.95Å; A305-V769 HydrophobicContact CB-CG2 4.36Å; A305-I772 HydrophobicContact CB-CD1 3.51Å; A305-L789 HydrophobicContact CB-CD1 3.76Å
306	A	81.8	Confident	79.6	Confident	7 Å²	7	20.5 Å²	20.5	6%	0.058	12%	0.118	C	C	.	.	H	α-helix	trans	-83.8	-21.2	-176.5	0	0	0	0	0	113.7	L260 I264 L302 V304 V769	L260-A306 WeakPolarHBondContact CD2-O 3.37Å; I264-A306 HydrophobicContact CD1-CB 3.48Å; I264-A306 VanDerWaalsContact CD1-CB 3.48Å; I264-A306 HydrophobicContact CG1-CB 3.39Å; L302-A306 WeakPolarHBondContact O-CB 3.29Å; L302-A306 PolarHBondContact O-N 3.14Å; L302-A306 VanDerWaalsContact O-N 3.1Å; V304-A306 PolarHBondContact O-N 2.93Å; V304-A306 VanDerWaalsContact O-N 3.08Å; A306-V769 HydrophobicContact CB-CG2 3.67Å
307	I	82.2	Confident	80.1	Confident	7 Å²	7	18.6 Å²	18.6	4%	0.036	12%	0.115	C	C	.	.	S	Bend	trans	-93.9	125.2	-174	-64.2	169.8	0	0	0	109	L61 I64 L65 I264 A303 V304 E309 N765	L61-I307 HydrophobicContact CD2-CG1 4.47Å; I64-I307 HydrophobicContact CB-CD1 4.49Å; I64-I307 HydrophobicContact CG2-CD1 4.11Å; L65-I307 HydrophobicContact CD1-CD1 4.15Å; L65-I307 HydrophobicContact CD1-CG2 3.95Å; L65-I307 HydrophobicContact CD2-CD1 4.19Å; L65-I307 HydrophobicContact CG-CD1 3.68Å; I264-I307 HydrophobicContact CD1-CD1 4.48Å; I264-I307 HydrophobicContact CD1-CG1 3.91Å; A303-I307 WeakPolarHBondContact O-CD1 3.19Å; A303-I307 VanDerWaalsContact O-CG1 3.29Å; A303-I307 WeakPolarHBondContact O-CG1 3.18Å; V304-I307 PolarHBondContact O-N 3.4Å; V304-I307 VanDerWaalsContact O-N 3.12Å; I307-E309 HydrophobicContact CG2-CG 4.21Å; I307-E309 PolarHBondContact O-N 2.73Å; I307-N765 PolarHBondContact O-ND2 3.38Å
308	P	81.9	Confident	80.7	Confident	12 Å²	12	15.3 Å²	15.3	8%	0.078	10%	0.101	C	C	.	.			trans	-82.4	81.6	177.8	32.5	-35	0	0	0	110.5	F256 G310 L311	F256-P308 HydrophobicContact CE1-CG 4.39Å; P308-G310 VanDerWaalsContact C-N 3.26Å; P308-G310 PolarHBondContact O-N 2.87Å; P308-L311 HydrophobicContact CB-CB 4.03Å; P308-L311 HydrophobicContact CG-CB 4.21Å; P308-L311 HydrophobicContact CG-CD2 4.1Å; P308-L311 VanDerWaalsContact O-CB 3.24Å; P308-L311 WeakPolarHBondContact O-CB 3.47Å; P308-L311 PolarHBondContact O-N 3.43Å
309	E	80.6	Confident	81.2	Confident	6 Å²	6	15.2 Å²	15.2	3%	0.028	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-28.3	-171.9	-55.6	89.7	167.3	0	0	113.6	L65 I97 I307 L311 P312 L790 N793	L65-E309 HydrophobicContact CD1-CG 4.2Å; I97-E309 HydrophobicContact CG2-CB 4.44Å; I307-E309 HydrophobicContact CG2-CG 4.21Å; I307-E309 PolarHBondContact O-N 2.73Å; E309-L311 PolarHBondContact O-N 2.78Å; E309-P312 WeakPolarHBondContact O-CD 3.41Å; E309-L790 HydrophobicContact CG-CD2 4.3Å; E309-L790 WeakPolarHBondContact OE1-CD2 3.3Å; E309-N793 WeakPolarHBondContact OE2-CB 3.42Å
310	G	80.4	Confident	81.6	Confident	2 Å²	2	16.3 Å²	16.3	2%	0.021	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.2	175.6	0	0	0	0	0	113.7	P308 A313 V314	P308-G310 VanDerWaalsContact C-N 3.26Å; P308-G310 PolarHBondContact O-N 2.87Å; G310-A313 PolarHBondContact O-N 3.22Å; G310-V314 WeakPolarHBondContact O-CG2 3.5Å; G310-V314 PolarHBondContact O-N 3.12Å
311	L	84.2	Confident	82	Confident	12 Å²	12	18.2 Å²	18.2	6%	0.063	12%	0.119	C	C	.	.	H	α-helix	trans	-62.2	-47.6	-169.1	179.5	64.3	0	0	0	114	L253 P308 E309 A313 V314 I315 F757 I758 L761	L253-L311 HydrophobicContact CD2-CD2 4.26Å; P308-L311 HydrophobicContact CB-CB 4.03Å; P308-L311 HydrophobicContact CG-CB 4.21Å; P308-L311 HydrophobicContact CG-CD2 4.1Å; P308-L311 VanDerWaalsContact O-CB 3.24Å; P308-L311 WeakPolarHBondContact O-CB 3.47Å; P308-L311 PolarHBondContact O-N 3.43Å; E309-L311 PolarHBondContact O-N 2.78Å; L311-A313 VanDerWaalsContact C-N 3.28Å; L311-A313 PolarHBondContact O-N 3.33Å; L311-V314 PolarHBondContact O-N 3.26Å; L311-I315 HydrophobicContact CD1-CD1 3.79Å; L311-I315 HydrophobicContact CD1-CG1 3.9Å; L311-I315 HydrophobicContact CD2-CD1 4.4Å; L311-I315 HydrophobicContact CG-CD1 3.78Å; L311-I315 HydrophobicContact CG-CG1 4.31Å; L311-I315 WeakPolarHBondContact O-CG1 3.23Å; L311-I315 PolarHBondContact O-N 3.17Å; L311-F757 HydrophobicContact CD1-CD2 4.32Å; L311-F757 HydrophobicContact CD1-CE2 3.98Å; L311-I758 HydrophobicContact CD1-CB 4.48Å; L311-I758 HydrophobicContact CD1-CG1 3.66Å; L311-L761 HydrophobicContact CB-CD1 4.2Å; L311-L761 HydrophobicContact CD1-CD1 3.85Å
312	P	79.9	Confident	82.4	Confident	70 Å²	70	17.8 Å²	17.8	46%	0.455	12%	0.115	S	C	.	.	H	α-helix	trans	-59.8	-37.9	178.2	-24.6	35.6	0	0	0	113.1	E309 T316	E309-P312 WeakPolarHBondContact O-CD 3.41Å; P312-T316 WeakPolarHBondContact O-CB 3.36Å; P312-T316 PolarHBondContact O-N 3.07Å; P312-T316 PolarHBondContact O-OG1 3.48Å
313	A	82.1	Confident	82.6	Confident	32 Å²	32	18.7 Å²	18.7	26%	0.264	12%	0.121	S	C	.	.	H	α-helix	trans	-68.3	-42.9	178.5	0	0	0	0	0	111.8	G310 L311 T316 T317	G310-A313 PolarHBondContact O-N 3.22Å; L311-A313 VanDerWaalsContact C-N 3.28Å; L311-A313 PolarHBondContact O-N 3.33Å; A313-T316 PolarHBondContact O-N 3.44Å; A313-T317 WeakPolarHBondContact O-CB 3.23Å; A313-T317 PolarHBondContact O-N 2.88Å; A313-T317 PolarHBondContact O-OG1 2.75Å
314	V	87.6	Confident	82.8	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.024	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-46	177.9	175.2	0	0	0	0	111	G310 L311 T316 T317 C318 F757 L761 A801	G310-V314 WeakPolarHBondContact O-CG2 3.5Å; G310-V314 PolarHBondContact O-N 3.12Å; L311-V314 PolarHBondContact O-N 3.26Å; V314-T316 PolarHBondContact O-N 2.66Å; V314-T317 PolarHBondContact O-N 2.73Å; V314-C318 WeakPolarHBondContact O-CB 3.47Å; V314-C318 PolarHBondContact O-N 3.3Å; V314-F757 HydrophobicContact CB-CE2 4.4Å; V314-F757 HydrophobicContact CG1-CD1 4.27Å; V314-F757 HydrophobicContact CG1-CD2 3.63Å; V314-F757 HydrophobicContact CG1-CE1 4.2Å; V314-F757 HydrophobicContact CG1-CE2 3.64Å; V314-F757 HydrophobicContact CG1-CG 4.01Å; V314-F757 HydrophobicContact CG1-CZ 3.94Å; V314-L761 HydrophobicContact CG2-CD1 4.46Å; V314-A801 HydrophobicContact CG1-CB 3.9Å; V314-A801 HydrophobicContact CG2-CB 4.05Å
315	I	85.8	Confident	83.2	Confident	15 Å²	15	29.8 Å²	29.8	8%	0.077	16%	0.161	C	C	.	.	H	α-helix	trans	-57.5	-51.1	176	-69	173.5	0	0	0	110.1	L253 L311 T317 C318 L319 F757	L253-I315 HydrophobicContact CD1-CD1 3.81Å; L253-I315 HydrophobicContact CD2-CD1 4.1Å; L311-I315 HydrophobicContact CD1-CD1 3.79Å; L311-I315 HydrophobicContact CD1-CG1 3.9Å; L311-I315 HydrophobicContact CD2-CD1 4.4Å; L311-I315 HydrophobicContact CG-CD1 3.78Å; L311-I315 HydrophobicContact CG-CG1 4.31Å; L311-I315 WeakPolarHBondContact O-CG1 3.23Å; L311-I315 PolarHBondContact O-N 3.17Å; I315-T317 VanDerWaalsContact C-N 3.32Å; I315-T317 PolarHBondContact O-N 2.81Å; I315-C318 PolarHBondContact O-N 3.44Å; I315-L319 HydrophobicContact CG2-CD1 3.65Å; I315-L319 HydrophobicContact CG2-CG 4.16Å; I315-L319 VanDerWaalsContact O-CG 3.29Å; I315-L319 WeakPolarHBondContact O-CG 3.46Å; I315-L319 PolarHBondContact O-N 3.26Å; I315-F757 HydrophobicContact CG1-CE2 3.72Å; I315-F757 HydrophobicContact CG1-CZ 3.86Å
316	T	82.9	Confident	83.5	Confident	30 Å²	30	29.9 Å²	29.9	18%	0.184	16%	0.162	C	C	.	.	H	α-helix	trans	-56	-48.5	179.5	-62.9	0	0	0	0	111.3	Q108 P312 A313 V314 C318 L319 A320 L336	Q108-T316 PolarHBondContact NE2-OG1 3.26Å; P312-T316 WeakPolarHBondContact O-CB 3.36Å; P312-T316 PolarHBondContact O-N 3.07Å; P312-T316 PolarHBondContact O-OG1 3.48Å; A313-T316 PolarHBondContact O-N 3.44Å; V314-T316 PolarHBondContact O-N 2.66Å; T316-C318 PolarHBondContact O-N 3.05Å; T316-L319 PolarHBondContact O-N 2.97Å; T316-A320 VanDerWaalsContact O-CB 3.3Å; T316-A320 WeakPolarHBondContact O-CB 3.24Å; T316-A320 PolarHBondContact O-N 2.83Å; T316-L336 HydrophobicContact CG2-CD1 4.35Å
317	T	84.6	Confident	83.7	Confident	60 Å²	60	31.7 Å²	31.7	37%	0.368	18%	0.177	S	C	.	.	H	α-helix	trans	-62.9	-44.6	-179	-54.2	0	0	0	0	110.7	A313 V314 I315 A320 L321 T802	A313-T317 WeakPolarHBondContact O-CB 3.23Å; A313-T317 PolarHBondContact O-N 2.88Å; A313-T317 PolarHBondContact O-OG1 2.75Å; V314-T317 PolarHBondContact O-N 2.73Å; I315-T317 VanDerWaalsContact C-N 3.32Å; I315-T317 PolarHBondContact O-N 2.81Å; T317-A320 PolarHBondContact O-N 3.05Å; T317-L321 HydrophobicContact CG2-CD1 3.9Å; T317-L321 WeakPolarHBondContact O-CB 3.29Å; T317-L321 WeakPolarHBondContact O-CD1 3.48Å; T317-L321 WeakPolarHBondContact O-CG 3.48Å; T317-L321 PolarHBondContact O-N 3.47Å; T317-T802 HydrophobicContact CG2-CG2 3.84Å
318	C	86.2	Confident	83.8	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.02	21%	0.209	C	C	.	.	H	α-helix	trans	-60.5	-47.3	177.2	-172.3	0	0	0	0	112	V314 I315 T316 L321 G322 F757	V314-C318 WeakPolarHBondContact O-CB 3.47Å; V314-C318 PolarHBondContact O-N 3.3Å; I315-C318 PolarHBondContact O-N 3.44Å; T316-C318 PolarHBondContact O-N 3.05Å; C318-L321 PolarHBondContact O-N 3.43Å; C318-G322 PolarHBondContact O-N 2.91Å; C318-F757 HydrophobicContact CB-CE1 3.86Å; C318-F757 HydrophobicContact CB-CZ 4.25Å
319	L	86.1	Confident	84.1	Confident	8 Å²	8	42.7 Å²	42.7	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-39.7	178.2	-66.1	174.3	0	0	0	112	I315 T316 G322 T323 L336 V339 I750 M754	I315-L319 HydrophobicContact CG2-CD1 3.65Å; I315-L319 HydrophobicContact CG2-CG 4.16Å; I315-L319 VanDerWaalsContact O-CG 3.29Å; I315-L319 WeakPolarHBondContact O-CG 3.46Å; I315-L319 PolarHBondContact O-N 3.26Å; T316-L319 PolarHBondContact O-N 2.97Å; L319-G322 PolarHBondContact O-N 3.32Å; L319-T323 WeakPolarHBondContact O-CB 3.29Å; L319-T323 PolarHBondContact O-N 3.48Å; L319-T323 PolarHBondContact O-OG1 2.55Å; L319-L336 HydrophobicContact CB-CB 4.06Å; L319-L336 HydrophobicContact CD1-CB 4.27Å; L319-V339 HydrophobicContact CD2-CB 4.06Å; L319-V339 HydrophobicContact CD2-CG1 4.27Å; L319-I750 HydrophobicContact CD2-CG2 4.15Å; L319-M754 HydrophobicContact CD2-SD 3.75Å; L319-M754 HydrophobicContact CG-SD 4.41Å
320	A	83.9	Confident	84.5	Confident	43 Å²	43	45.6 Å²	45.6	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-64.5	-41.8	176.8	0	0	0	0	0	111.8	T316 T317 T323 R324 L336	T316-A320 VanDerWaalsContact O-CB 3.3Å; T316-A320 WeakPolarHBondContact O-CB 3.24Å; T316-A320 PolarHBondContact O-N 2.83Å; T317-A320 PolarHBondContact O-N 3.05Å; A320-T323 WeakPolarHBondContact O-CB 3.25Å; A320-T323 PolarHBondContact O-N 3.04Å; A320-R324 PolarHBondContact O-N 3.45Å; A320-L336 HydrophobicContact CB-CD2 4.41Å
321	L	81.9	Confident	85	Confident	49 Å²	49	45.6 Å²	45.6	26%	0.257	24%	0.238	S	C	.	.	H	α-helix	trans	-68	-39.4	174.8	-70.3	162.7	0	0	0	112	T317 C318 R324 R325 F806	T317-L321 HydrophobicContact CG2-CD1 3.9Å; T317-L321 WeakPolarHBondContact O-CB 3.29Å; T317-L321 WeakPolarHBondContact O-CD1 3.48Å; T317-L321 WeakPolarHBondContact O-CG 3.48Å; T317-L321 PolarHBondContact O-N 3.47Å; C318-L321 PolarHBondContact O-N 3.43Å; L321-R324 WeakPolarHBondContact O-CB 3.24Å; L321-R324 PolarHBondContact O-N 2.98Å; L321-R325 PolarHBondContact O-N 2.87Å; L321-F806 HydrophobicContact CD1-CE1 3.91Å; L321-F806 HydrophobicContact CD1-CE2 3.79Å; L321-F806 HydrophobicContact CD1-CZ 3.23Å; L321-F806 HydrophobicContact CD2-CE1 4.36Å; L321-F806 HydrophobicContact CD2-CZ 4.12Å; L321-F806 HydrophobicContact CG-CZ 4.19Å
322	G	84.3	Confident	85.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.2	-48.2	171.2	0	0	0	0	0	112.2	C318 L319 R324 R325 M326 I750	C318-G322 PolarHBondContact O-N 2.91Å; L319-G322 PolarHBondContact O-N 3.32Å; G322-R324 VanDerWaalsContact C-N 3.28Å; G322-R324 PolarHBondContact O-N 3.14Å; G322-R325 WeakPolarHBondContact O-CA 3.41Å; G322-R325 WeakPolarHBondContact O-CB 3.49Å; G322-R325 PolarHBondContact O-N 3.25Å; G322-M326 WeakPolarHBondContact O-CG 3.24Å; G322-M326 PolarHBondContact O-N 2.79Å; G322-I750 VanDerWaalsContact CA-CD1 3.47Å
323	T	83.9	Confident	85.5	Confident	23 Å²	23	46.1 Å²	46.1	14%	0.141	24%	0.237	C	C	.	.	H	α-helix	trans	-57	-42	174.5	-60.1	0	0	0	0	111.4	L319 A320 R325 M326 A327 V333 L336 V339	L319-T323 WeakPolarHBondContact O-CB 3.29Å; L319-T323 PolarHBondContact O-N 3.48Å; L319-T323 PolarHBondContact O-OG1 2.55Å; A320-T323 WeakPolarHBondContact O-CB 3.25Å; A320-T323 PolarHBondContact O-N 3.04Å; T323-R325 PolarHBondContact O-N 3.33Å; T323-M326 PolarHBondContact O-N 3.18Å; T323-A327 WeakPolarHBondContact O-CB 3.45Å; T323-A327 PolarHBondContact O-N 3.46Å; T323-V333 HydrophobicContact CG2-CB 3.93Å; T323-L336 WeakPolarHBondContact OG1-CD2 3.3Å; T323-V339 WeakPolarHBondContact OG1-CG2 3.25Å
324	R	81.4	Confident	85.6	Confident	173 Å²	173	49.2 Å²	49.2	65%	0.653	24%	0.242	S	C	*	.	H	α-helix	trans	-65.7	-35.1	175.9	-170.2	178.9	178.1	-170.8	0.2	112.8	A320 L321 G322 K328	A320-R324 PolarHBondContact O-N 3.45Å; L321-R324 WeakPolarHBondContact O-CB 3.24Å; L321-R324 PolarHBondContact O-N 2.98Å; G322-R324 VanDerWaalsContact C-N 3.28Å; G322-R324 PolarHBondContact O-N 3.14Å; R324-K328 PolarHBondContact O-N 3.35Å
325	R	83.8	Confident	85.2	Confident	70 Å²	70	50.9 Å²	50.9	26%	0.264	25%	0.253	S	S	.	.	H	α-helix	trans	-68.1	-44.4	173.8	-74.9	-172.1	-77.7	169.3	-11.7	111.5	L321 G322 T323 A327 K328 K329 E746	L321-R325 PolarHBondContact O-N 2.87Å; G322-R325 WeakPolarHBondContact O-CA 3.41Å; G322-R325 WeakPolarHBondContact O-CB 3.49Å; G322-R325 PolarHBondContact O-N 3.25Å; T323-R325 PolarHBondContact O-N 3.33Å; R325-A327 VanDerWaalsContact C-N 3.35Å; R325-A327 PolarHBondContact O-N 3.29Å; R325-K328 WeakPolarHBondContact O-CB 3.46Å; R325-K328 PolarHBondContact O-N 3.24Å; R325-K329 PolarHBondContact O-N 2.98Å; R325-E746 WeakPolarHBondContact CD-OE1 3.47Å; R325-E746 IonicContact CZ-OE1 3.71Å; R325-E746 IonicContact NE-OE1 3.82Å; R325-E746 PolarHBondContact NE-OE1 3.17Å; R325-E746 IonicContact NH1-OE1 2.69Å; R325-E746 PolarHBondContact NH1-OE1 3.4Å; R325-E746 IonicContact NH2-OE1 2.72Å
326	M	87.8	Confident	84.9	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-41.9	174.9	-72	-178.8	173.6	0	0	111.8	G322 T323 K328 K329 N330 A331 V333 V339 A743 E746 I750	G322-M326 WeakPolarHBondContact O-CG 3.24Å; G322-M326 PolarHBondContact O-N 2.79Å; T323-M326 PolarHBondContact O-N 3.18Å; M326-K328 VanDerWaalsContact C-N 3.28Å; M326-K328 PolarHBondContact O-N 3.21Å; M326-K329 CarbonylContact O-C 3.48Å; M326-K329 VanDerWaalsContact O-C 3.26Å; M326-K329 VanDerWaalsContact O-CA 3.29Å; M326-K329 WeakPolarHBondContact O-CA 3.24Å; M326-K329 WeakPolarHBondContact O-CB 3.32Å; M326-K329 PolarHBondContact O-N 2.87Å; M326-N330 PolarHBondContact O-N 3.06Å; M326-A331 CarbonylContact C-O 3.38Å; M326-A331 HydrophobicContact CB-CB 4.01Å; M326-A331 WeakPolarHBondContact CB-O 3.44Å; M326-A331 PolarHBondContact O-N 3.26Å; M326-V333 HydrophobicContact CB-CG2 4.37Å; M326-V333 HydrophobicContact SD-CG2 3.58Å; M326-V333 VanDerWaalsContact SD-CG2 3.58Å; M326-V339 HydrophobicContact CE-CB 4.39Å; M326-V339 HydrophobicContact CE-CG1 3.61Å; M326-V339 HydrophobicContact SD-CB 4.5Å; M326-V339 HydrophobicContact SD-CG1 4.05Å; M326-V339 HydrophobicContact SD-CG2 4.17Å; M326-A743 VanDerWaalsContact CE-O 3.31Å; M326-A743 WeakPolarHBondContact CE-O 3.33Å; M326-E746 HydrophobicContact CE-CB 3.75Å; M326-E746 HydrophobicContact CE-CG 3.92Å; M326-E746 HydrophobicContact CG-CB 4.27Å; M326-E746 HydrophobicContact CG-CG 3.95Å; M326-I750 HydrophobicContact CE-CD1 4.22Å
327	A	85.4	Confident	84.9	Confident	45 Å²	45	52.3 Å²	52.3	37%	0.372	26%	0.261	S	S	.	.	H	α-helix	trans	-61.4	-35.4	177.8	0	0	0	0	0	112.6	T323 R325 K329 N330 A331	T323-A327 WeakPolarHBondContact O-CB 3.45Å; T323-A327 PolarHBondContact O-N 3.46Å; R325-A327 VanDerWaalsContact C-N 3.35Å; R325-A327 PolarHBondContact O-N 3.29Å; A327-K329 PolarHBondContact O-N 2.9Å; A327-N330 PolarHBondContact O-N 3.48Å; A327-N330 VanDerWaalsContact O-N 3.09Å; A327-A331 VanDerWaalsContact CA-O 3.26Å; A327-A331 WeakPolarHBondContact CA-O 3.27Å; A327-A331 PolarHBondContact N-O 3.19Å
328	K	85.5	Confident	85	Confident	166 Å²	166	49.6 Å²	49.6	72%	0.722	25%	0.245	S	C	*	.	H	α-helix	trans	-66.1	-22.2	172.4	-71.6	-178.7	178.4	-177.2	0	113.3	R324 R325 M326	R324-K328 PolarHBondContact O-N 3.35Å; R325-K328 WeakPolarHBondContact O-CB 3.46Å; R325-K328 PolarHBondContact O-N 3.24Å; M326-K328 VanDerWaalsContact C-N 3.28Å; M326-K328 PolarHBondContact O-N 3.21Å
329	K	86.8	Confident	85	Confident	85 Å²	85	49.4 Å²	49.4	37%	0.37	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	21.7	173.4	-63.9	177.8	172.9	174.2	0	111.7	R325 M326 A327 A331 T739 A742 E746	R325-K329 PolarHBondContact O-N 2.98Å; M326-K329 CarbonylContact O-C 3.48Å; M326-K329 VanDerWaalsContact O-C 3.26Å; M326-K329 VanDerWaalsContact O-CA 3.29Å; M326-K329 WeakPolarHBondContact O-CA 3.24Å; M326-K329 WeakPolarHBondContact O-CB 3.32Å; M326-K329 PolarHBondContact O-N 2.87Å; A327-K329 PolarHBondContact O-N 2.9Å; K329-A331 VanDerWaalsContact C-N 3.26Å; K329-A331 PolarHBondContact O-N 2.98Å; K329-T739 WeakPolarHBondContact O-CG2 3.33Å; K329-A742 HydrophobicContact CD-CB 4.39Å; K329-E746 IonicContact NZ-OE2 3.61Å; K329-E746 PolarHBondContact NZ-OE2 3.23Å
330	N	88.9	Confident	85.1	Confident	67 Å²	67	49 Å²	49	36%	0.358	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	10.9	179.5	-53.6	-37.8	0	0	0	116.2	M326 A327 S733 D734 T739	M326-N330 PolarHBondContact O-N 3.06Å; A327-N330 PolarHBondContact O-N 3.48Å; A327-N330 VanDerWaalsContact O-N 3.09Å; N330-S733 VanDerWaalsContact CA-OG 3.28Å; N330-S733 WeakPolarHBondContact CA-OG 3.37Å; N330-S733 VanDerWaalsContact CB-OG 3.24Å; N330-S733 WeakPolarHBondContact CB-OG 3.2Å; N330-S733 PolarHBondContact O-N 3.05Å; N330-S733 PolarHBondContact O-OG 3.2Å; N330-D734 HydrophobicContact CB-CB 3.98Å; N330-D734 VanDerWaalsContact CB-CG 3.48Å; N330-D734 WeakPolarHBondContact CB-OD2 3.4Å; N330-D734 PolarHBondContact ND2-OD2 2.99Å; N330-T739 HydrophobicContact CB-CG2 4.28Å
331	A	90.9	Very high	85.3	Confident	1 Å²	1	47 Å²	47	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	103.6	175	0	0	0	0	0	110.5	M326 A327 K329 V333 M730 T739 A743	M326-A331 CarbonylContact C-O 3.38Å; M326-A331 HydrophobicContact CB-CB 4.01Å; M326-A331 WeakPolarHBondContact CB-O 3.44Å; M326-A331 PolarHBondContact O-N 3.26Å; A327-A331 VanDerWaalsContact CA-O 3.26Å; A327-A331 WeakPolarHBondContact CA-O 3.27Å; A327-A331 PolarHBondContact N-O 3.19Å; K329-A331 VanDerWaalsContact C-N 3.26Å; K329-A331 PolarHBondContact O-N 2.98Å; A331-V333 PolarHBondContact O-N 2.87Å; A331-M730 HydrophobicContact CB-CG 4.49Å; A331-M730 HydrophobicContact CB-SD 3.83Å; A331-T739 HydrophobicContact CB-CG2 3.82Å; A331-A743 HydrophobicContact CB-CB 4.21Å
332	I	89.3	Confident	85.7	Confident	82 Å²	82	44.7 Å²	44.7	42%	0.421	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	104.3	178.8	-58	171.6	0	0	0	108.5	M730 V731	I332-M730 CarbonylContact O-C 3.48Å; I332-M730 WeakPolarHBondContact O-CA 3.39Å; I332-V731 HydrophobicContact CB-CB 4.3Å; I332-V731 PolarHBondContact N-O 3.04Å; I332-V731 PolarHBondContact O-N 2.99Å
333	V	86.8	Confident	86	Confident	12 Å²	12	44.9 Å²	44.9	7%	0.073	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.9	176.4	-173.4	0	0	0	0	110.1	T323 M326 A331 S335 V339 M730	T323-V333 HydrophobicContact CG2-CB 3.93Å; M326-V333 HydrophobicContact CB-CG2 4.37Å; M326-V333 HydrophobicContact SD-CG2 3.58Å; M326-V333 VanDerWaalsContact SD-CG2 3.58Å; A331-V333 PolarHBondContact O-N 2.87Å; V333-S335 WeakPolarHBondContact CG1-O 3.5Å; V333-V339 HydrophobicContact CB-CG2 4.2Å; V333-V339 HydrophobicContact CG1-CG2 3.8Å; V333-V339 HydrophobicContact CG2-CG2 4.14Å; V333-M730 HydrophobicContact CG2-CG 4.31Å; V333-M730 HydrophobicContact CG2-SD 4.44Å
334	R	83.5	Confident	86.3	Confident	97 Å²	97	43.9 Å²	43.9	37%	0.366	21%	0.209	S	C	.	.	S	Bend	trans	-91.4	-31.8	179.5	-68	-176.7	54.8	137.9	6.3	112.7	K725 S726 S728 E729 V731	R334-K725 WeakPolarHBondContact CD-O 3.43Å; R334-K725 PolarHBondContact NE-O 3.1Å; R334-K725 PolarHBondContact NH1-O 3.46Å; R334-S726 VanDerWaalsContact NH1-CA 3.29Å; R334-S728 WeakPolarHBondContact CD-O 3.3Å; R334-E729 PolarHBondContact N-O 3.48Å; R334-V731 HydrophobicContact CG-CG2 4.44Å
335	S	78.5	Confident	87	Confident	38 Å²	38	35.7 Å²	35.7	27%	0.266	18%	0.178	S	C	.	.	S	Bend	trans	-116.3	118.5	179.9	-180	0	0	0	0	110.3	V333 P337 S338	V333-S335 WeakPolarHBondContact CG1-O 3.5Å; S335-P337 WeakPolarHBondContact OG-CD 3.44Å; S335-S338 WeakPolarHBondContact CB-OG 3.18Å; S335-S338 VanDerWaalsContact O-CB 3.29Å; S335-S338 WeakPolarHBondContact O-CB 3.09Å; S335-S338 PolarHBondContact O-N 3.36Å; S335-S338 VanDerWaalsContact O-N 3.12Å; S335-S338 PolarHBondContact O-OG 3.25Å; S335-S338 PolarHBondContact OG-OG 2.91Å
336	L	81.3	Confident	87.5	Confident	47 Å²	47	33 Å²	33	25%	0.246	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-43.8	-175.7	-64.9	178.9	0	0	0	113.4	T316 L319 A320 T323 S338 V339	T316-L336 HydrophobicContact CG2-CD1 4.35Å; L319-L336 HydrophobicContact CB-CB 4.06Å; L319-L336 HydrophobicContact CD1-CB 4.27Å; A320-L336 HydrophobicContact CB-CD2 4.41Å; T323-L336 WeakPolarHBondContact OG1-CD2 3.3Å; L336-S338 PolarHBondContact O-N 2.88Å; L336-V339 WeakPolarHBondContact O-CB 3.42Å; L336-V339 WeakPolarHBondContact O-CG2 3.39Å; L336-V339 PolarHBondContact O-N 2.78Å
337	P	82.5	Confident	87.9	Confident	28 Å²	28	33 Å²	33	18%	0.182	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.2	177.3	-27.3	37.4	0	0	0	114.3	T247 S335 V339 E340 T341	T247-P337 HydrophobicContact CG2-CB 3.66Å; S335-P337 WeakPolarHBondContact OG-CD 3.44Å; P337-V339 PolarHBondContact O-N 3.29Å; P337-E340 PolarHBondContact O-N 2.73Å; P337-E340 VanDerWaalsContact O-N 3.08Å; P337-T341 PolarHBondContact O-N 2.95Å
338	S	85.9	Confident	88.5	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-64.7	-21.8	-178.2	-53.8	0	0	0	0	113.6	S335 L336 E340 T341 L342 E729	S335-S338 WeakPolarHBondContact CB-OG 3.18Å; S335-S338 VanDerWaalsContact O-CB 3.29Å; S335-S338 WeakPolarHBondContact O-CB 3.09Å; S335-S338 PolarHBondContact O-N 3.36Å; S335-S338 VanDerWaalsContact O-N 3.12Å; S335-S338 PolarHBondContact O-OG 3.25Å; S335-S338 PolarHBondContact OG-OG 2.91Å; L336-S338 PolarHBondContact O-N 2.88Å; S338-E340 VanDerWaalsContact C-N 3.26Å; S338-E340 PolarHBondContact O-N 3.31Å; S338-T341 PolarHBondContact O-N 3.26Å; S338-L342 WeakPolarHBondContact O-CB 3.15Å; S338-L342 WeakPolarHBondContact O-CG 3.46Å; S338-L342 PolarHBondContact O-N 3.13Å; S338-E729 VanDerWaalsContact OG-CB 3.31Å; S338-E729 WeakPolarHBondContact OG-CB 3.22Å; S338-E729 WeakPolarHBondContact OG-CG 3.36Å
339	V	86.2	Confident	89	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-56.7	-41	172.1	176	0	0	0	0	111.4	L319 T323 M326 V333 L336 P337 G747 I750	L319-V339 HydrophobicContact CD2-CB 4.06Å; L319-V339 HydrophobicContact CD2-CG1 4.27Å; T323-V339 WeakPolarHBondContact OG1-CG2 3.25Å; M326-V339 HydrophobicContact CE-CB 4.39Å; M326-V339 HydrophobicContact CE-CG1 3.61Å; M326-V339 HydrophobicContact SD-CB 4.5Å; M326-V339 HydrophobicContact SD-CG1 4.05Å; M326-V339 HydrophobicContact SD-CG2 4.17Å; V333-V339 HydrophobicContact CB-CG2 4.2Å; V333-V339 HydrophobicContact CG1-CG2 3.8Å; V333-V339 HydrophobicContact CG2-CG2 4.14Å; L336-V339 WeakPolarHBondContact O-CB 3.42Å; L336-V339 WeakPolarHBondContact O-CG2 3.39Å; L336-V339 PolarHBondContact O-N 2.78Å; P337-V339 PolarHBondContact O-N 3.29Å; V339-G747 WeakPolarHBondContact O-CA 3.34Å; V339-I750 HydrophobicContact CG1-CB 4.38Å; V339-I750 HydrophobicContact CG1-CD1 3.27Å; V339-I750 HydrophobicContact CG1-CG1 4.4Å; V339-I750 HydrophobicContact CG1-CG2 4.12Å
340	E	87.8	Confident	89.2	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-73.9	-45.6	177.7	178	-86.5	168	0	0	111.4	L249 P337 S338 L342 G343 Y751 M754 R819	L249-E340 HydrophobicContact CB-CG 4.11Å; L249-E340 HydrophobicContact CD2-CG 4.44Å; P337-E340 PolarHBondContact O-N 2.73Å; P337-E340 VanDerWaalsContact O-N 3.08Å; S338-E340 VanDerWaalsContact C-N 3.26Å; S338-E340 PolarHBondContact O-N 3.31Å; E340-L342 PolarHBondContact O-N 3.07Å; E340-G343 WeakPolarHBondContact O-CA 3.08Å; E340-G343 PolarHBondContact O-N 2.85Å; E340-Y751 HydrophobicContact CG-CD2 3.64Å; E340-Y751 HydrophobicContact CG-CE2 4.46Å; E340-Y751 HydrophobicContact CG-CG 4.46Å; E340-Y751 WeakPolarHBondContact OE1-CD2 3.16Å; E340-M754 HydrophobicContact CB-CE 4.37Å; E340-M754 HydrophobicContact CG-CE 4.06Å; E340-R819 IonicContact OE1-NH2 2.94Å; E340-R819 PolarHBondContact OE1-NH2 2.69Å
341	T	89.3	Confident	89.2	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-64.8	-31.7	-174.3	-56.4	0	0	0	0	111.4	T247 P337 S338 G343 C344 T345 I694 E712 I713	T247-T341 WeakPolarHBondContact CB-OG1 3.5Å; T247-T341 WeakPolarHBondContact CG2-OG1 3.38Å; P337-T341 PolarHBondContact O-N 2.95Å; S338-T341 PolarHBondContact O-N 3.26Å; T341-G343 PolarHBondContact O-N 3.02Å; T341-C344 PolarHBondContact O-N 3.1Å; T341-T345 PolarHBondContact O-N 3.17Å; T341-I694 HydrophobicContact CG2-CG2 3.93Å; T341-E712 HydrophobicContact CG2-CB 3.94Å; T341-I713 HydrophobicContact CG2-CD1 3.67Å; T341-I713 HydrophobicContact CG2-CG1 3.92Å
342	L	90.2	Very high	88.9	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-52.2	-39.3	168	-89.8	162.2	0	0	0	112.8	S338 E340 C344 T345 I713 M730 A743 V744	S338-L342 WeakPolarHBondContact O-CB 3.15Å; S338-L342 WeakPolarHBondContact O-CG 3.46Å; S338-L342 PolarHBondContact O-N 3.13Å; E340-L342 PolarHBondContact O-N 3.07Å; L342-C344 PolarHBondContact O-N 3.12Å; L342-T345 WeakPolarHBondContact CA-OG1 3.21Å; L342-T345 VanDerWaalsContact O-CB 3.32Å; L342-T345 WeakPolarHBondContact O-CB 3.41Å; L342-T345 PolarHBondContact O-N 3.3Å; L342-T345 PolarHBondContact O-OG1 3.31Å; L342-I713 HydrophobicContact CD2-CG2 3.81Å; L342-I713 HydrophobicContact CG-CD1 4.32Å; L342-I713 HydrophobicContact CG-CG1 4.27Å; L342-I713 HydrophobicContact CG-CG2 3.97Å; L342-M730 HydrophobicContact CD1-CE 4.22Å; L342-M730 HydrophobicContact CD1-SD 3.76Å; L342-M730 HydrophobicContact CD2-CE 3.9Å; L342-A743 HydrophobicContact CD1-CB 4.35Å; L342-V744 HydrophobicContact CD2-CG2 4.27Å
343	G	89.6	Confident	88.3	Confident	4 Å²	4	12.7 Å²	12.7	4%	0.041	7%	0.067	C	C	.	.	H	α-helix	trans	-66.7	-24.7	178.3	0	0	0	0	0	114	E340 T341 R748	E340-G343 WeakPolarHBondContact O-CA 3.08Å; E340-G343 PolarHBondContact O-N 2.85Å; T341-G343 PolarHBondContact O-N 3.02Å; G343-R748 VanDerWaalsContact O-CG 3.24Å; G343-R748 WeakPolarHBondContact O-CG 3.45Å
344	C	91.2	Very high	87.8	Confident	2 Å²	2	12.4 Å²	12.4	1%	0.014	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-1.9	178.2	-60.6	0	0	0	0	113.3	T341 L342 S346 I694 R819	T341-C344 PolarHBondContact O-N 3.1Å; L342-C344 PolarHBondContact O-N 3.12Å; C344-S346 PolarHBondContact O-N 3.4Å; C344-I694 HydrophobicContact CB-CG1 4.15Å; C344-I694 HydrophobicContact CB-CG2 4.45Å; C344-I694 WeakPolarHBondContact O-CB 3.36Å; C344-R819 PolarHBondContact SG-NE 3.18Å; C344-R819 VanDerWaalsContact SG-NE 3.39Å; C344-R819 PolarHBondContact SG-NH2 2.86Å
345	T	95	Very high	87.5	Confident	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.05	C	C	.	.			trans	-54.6	121.8	-176.8	-54.2	0	0	0	0	111.2	T341 L342 V347 I348 A696	T341-T345 PolarHBondContact O-N 3.17Å; L342-T345 WeakPolarHBondContact CA-OG1 3.21Å; L342-T345 VanDerWaalsContact O-CB 3.32Å; L342-T345 WeakPolarHBondContact O-CB 3.41Å; L342-T345 PolarHBondContact O-N 3.3Å; L342-T345 PolarHBondContact O-OG1 3.31Å; T345-V347 WeakPolarHBondContact CG2-O 3.44Å; T345-I348 HydrophobicContact CG2-CG1 3.76Å; T345-A696 HydrophobicContact CG2-CB 3.69Å
346	S	95.4	Very high	87.9	Confident	15 Å²	15	6 Å²	6	11%	0.105	4%	0.037	C	C	.	.			trans	-107.4	-26	177.4	63.7	0	0	0	0	113	C344 I616 R617 E693 I694	C344-S346 PolarHBondContact O-N 3.4Å; S346-I616 WeakPolarHBondContact O-CA 3.46Å; S346-R617 PolarHBondContact O-N 2.96Å; S346-E693 WeakPolarHBondContact CB-OE2 3.45Å; S346-E693 PolarHBondContact OG-OE2 3.4Å; S346-I694 PolarHBondContact N-O 2.98Å; S346-I694 PolarHBondContact OG-N 3.21Å; S346-I694 VanDerWaalsContact OG-N 3.15Å; S346-I694 PolarHBondContact OG-O 3.35Å
347	V	96.9	Very high	88	Confident	1 Å²	1	3.8 Å²	3.8	1%	0.006	3%	0.026	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.4	177.6	-174.9	0	0	0	0	110.2	T345 R617 I619 L688 E693 I694 T695 A696	T345-V347 WeakPolarHBondContact CG2-O 3.44Å; V347-R617 CarbonylContact C-O 3.56Å; V347-R617 VanDerWaalsContact CA-O 3.32Å; V347-R617 WeakPolarHBondContact CA-O 3.4Å; V347-R617 HydrophobicContact CG2-CB 4.37Å; V347-I619 HydrophobicContact CG1-CD1 3.63Å; V347-I619 HydrophobicContact CG1-CG1 3.94Å; V347-L688 HydrophobicContact CB-CD1 4.48Å; V347-L688 HydrophobicContact CG1-CD1 3.92Å; V347-L688 HydrophobicContact CG1-CD2 4.34Å; V347-L688 HydrophobicContact CG2-CD2 4.29Å; V347-E693 HydrophobicContact CG2-CB 4.19Å; V347-E693 HydrophobicContact CG2-CG 4.43Å; V347-I694 PolarHBondContact N-O 3.49Å; V347-T695 WeakPolarHBondContact O-CA 3.47Å; V347-A696 PolarHBondContact O-N 3.41Å
348	I	96.9	Very high	87.9	Confident	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.024	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	106.8	171.1	-58.5	172.7	0	0	0	108.2	T345 I616 R617 V618 I619 A696 T698 F737 I740	T345-I348 HydrophobicContact CG2-CG1 3.76Å; I348-I616 HydrophobicContact CD1-CG2 3.83Å; I348-I616 HydrophobicContact CG1-CG2 3.8Å; I348-R617 PolarHBondContact N-O 3.24Å; I348-V618 CarbonylContact O-C 3.58Å; I348-V618 WeakPolarHBondContact O-CA 3.38Å; I348-I619 PolarHBondContact O-N 2.97Å; I348-A696 CarbonylContact C-O 3.54Å; I348-A696 WeakPolarHBondContact CA-O 3.1Å; I348-A696 HydrophobicContact CG1-CB 4.26Å; I348-T698 HydrophobicContact CG2-CG2 4.43Å; I348-F737 HydrophobicContact CD1-CZ 4.41Å; I348-F737 HydrophobicContact CG2-CE2 3.82Å; I348-F737 HydrophobicContact CG2-CZ 4.24Å; I348-I740 HydrophobicContact CD1-CG2 4.04Å
349	C	95.9	Very high	87.5	Confident	0 Å²	0	6 Å²	6	0%	0	4%	0.036	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	112.5	167.2	-69	0	0	0	0	108.3	I619 I621 L688 A696 M697 T698	C349-I619 CarbonylContact C-O 3.58Å; C349-I619 WeakPolarHBondContact CA-O 3.49Å; C349-I621 HydrophobicContact CB-CD1 3.94Å; C349-L688 VanDerWaalsContact SG-CD1 3.59Å; C349-A696 PolarHBondContact N-O 3.25Å; C349-M697 HydrophobicContact CB-SD 3.47Å; C349-M697 WeakPolarHBondContact CB-SD 3.39Å; C349-M697 CarbonylContact O-C 3.6Å; C349-M697 WeakPolarHBondContact O-CA 3.14Å; C349-T698 PolarHBondContact O-N 3.37Å
350	S	91.9	Very high	87.3	Confident	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.6	-176.7	-168.1	0	0	0	0	112.1	T355 I619 M620 I621 T698	S350-T355 WeakPolarHBondContact OG-CG2 3.15Å; S350-I619 PolarHBondContact N-O 3.45Å; S350-M620 WeakPolarHBondContact O-CA 3.43Å; S350-I621 PolarHBondContact O-N 2.91Å; S350-T698 VanDerWaalsContact CA-OG1 3.23Å; S350-T698 WeakPolarHBondContact CA-OG1 3.45Å; S350-T698 PolarHBondContact OG-OG1 3.04Å
351	D	87.8	Confident	87.3	Confident	9 Å²	9	9.7 Å²	9.7	5%	0.048	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	146.8	168.6	-160.6	76.5	0	0	0	110.8	T353 T355 I621 K681 T698	D351-T353 PolarHBondContact OD2-N 2.77Å; D351-T355 WeakPolarHBondContact O-CB 3.43Å; D351-I621 WeakPolarHBondContact CA-O 3.42Å; D351-K681 IonicContact OD1-NZ 2.68Å; D351-K681 PolarHBondContact OD1-NZ 3.11Å; D351-T698 PolarHBondContact N-OG1 3.33Å
352	K	85.3	Confident	87.4	Confident	7 Å²	7	9.8 Å²	9.8	3%	0.03	6%	0.055	C	C	.	.	I	π-helix	trans	-74.7	-54	179.5	-176.4	-133.6	61.5	170	0	111.4	G354 L356 T357 D598 M620 I621 D624 I632	K352-G354 PolarHBondContact O-N 3.03Å; K352-L356 PolarHBondContact O-N 3.23Å; K352-L356 VanDerWaalsContact O-N 3.14Å; K352-T357 HydrophobicContact CD-CG2 4.21Å; K352-T357 HydrophobicContact CG-CG2 3.99Å; K352-T357 PolarHBondContact O-N 3.17Å; K352-T357 PolarHBondContact O-OG1 2.78Å; K352-T357 VanDerWaalsContact O-OG1 3.04Å; K352-D598 IonicContact NZ-OD2 3.71Å; K352-M620 HydrophobicContact CB-CG 4.17Å; K352-M620 HydrophobicContact CB-SD 4.12Å; K352-M620 HydrophobicContact CG-CE 4.39Å; K352-M620 HydrophobicContact CG-SD 4.08Å; K352-I621 PolarHBondContact N-O 2.91Å; K352-I621 VanDerWaalsContact N-O 3.11Å; K352-D624 WeakPolarHBondContact CD-OD2 3.41Å; K352-D624 WeakPolarHBondContact CE-OD2 3.42Å; K352-D624 IonicContact NZ-OD1 2.82Å; K352-D624 IonicContact NZ-OD2 2.91Å; K352-D624 PolarHBondContact NZ-OD2 2.98Å; K352-I632 HydrophobicContact CD-CD1 3.59Å; K352-I632 HydrophobicContact CG-CD1 4.27Å
353	T	77.3	Confident	87.7	Confident	2 Å²	2	9.9 Å²	9.9	1%	0.012	6%	0.055	C	C	.	.	I	π-helix	trans	-75.1	127.5	-166	-57.7	0	0	0	0	109.4	D351 T355 T357 N359	D351-T353 PolarHBondContact OD2-N 2.77Å; T353-T355 PolarHBondContact O-N 3.3Å; T353-T357 WeakPolarHBondContact CA-OG1 3.45Å; T353-N359 HydrophobicContact CG2-CB 3.99Å; T353-N359 WeakPolarHBondContact CG2-OD1 3.49Å
354	G	74.8	Confident	87.8	Confident	7 Å²	7	11 Å²	11	7%	0.072	6%	0.062	C	C	.	.	I	π-helix	trans	77	-21.8	177.3	0	0	0	0	0	115.3	K352 T357 R601 M717	K352-G354 PolarHBondContact O-N 3.03Å; G354-T357 CarbonylContact C-O 3.56Å; G354-T357 WeakPolarHBondContact CA-O 3.12Å; G354-T357 PolarHBondContact N-OG1 3.17Å; G354-R601 PolarHBondContact O-NH2 2.75Å; G354-M717 WeakPolarHBondContact O-CE 3.37Å
355	T	78.7	Confident	87.9	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.076	C	C	.	.	I	π-helix	trans	-96.6	-68.4	174.6	-46.2	0	0	0	0	111.8	S350 D351 T353 R601 T698 M717 F737	S350-T355 WeakPolarHBondContact OG-CG2 3.15Å; D351-T355 WeakPolarHBondContact O-CB 3.43Å; T353-T355 PolarHBondContact O-N 3.3Å; T355-R601 WeakPolarHBondContact O-CD 3.32Å; T355-R601 PolarHBondContact O-NE 3.3Å; T355-T698 HydrophobicContact CG2-CG2 4.49Å; T355-M717 HydrophobicContact CG2-CE 3.97Å; T355-M717 HydrophobicContact CG2-SD 3.87Å; T355-M717 PolarHBondContact OG1-SD 3.31Å; T355-F737 HydrophobicContact CG2-CD2 4.46Å
356	L	85.5	Confident	88	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.076	C	C	.	.	I	π-helix	trans	-76.8	-28.1	177.9	-61.6	174.8	0	0	0	111.8	K352 P600 R601 V604 M620 I636 F737	K352-L356 PolarHBondContact O-N 3.23Å; K352-L356 VanDerWaalsContact O-N 3.14Å; L356-P600 WeakPolarHBondContact O-CA 3.45Å; L356-R601 PolarHBondContact O-N 3.1Å; L356-V604 HydrophobicContact CD2-CG1 3.8Å; L356-V604 HydrophobicContact CD2-CG2 4.43Å; L356-M620 HydrophobicContact CD1-CB 4.34Å; L356-M620 HydrophobicContact CD1-CE 3.57Å; L356-M620 HydrophobicContact CD1-CG 3.98Å; L356-I636 HydrophobicContact CD1-CD1 3.94Å; L356-I636 HydrophobicContact CD2-CD1 4.42Å; L356-F737 HydrophobicContact CD2-CB 4.35Å; L356-F737 HydrophobicContact CD2-CD2 3.67Å; L356-F737 HydrophobicContact CD2-CE2 4.1Å; L356-F737 HydrophobicContact CD2-CG 3.94Å
357	T	84.8	Confident	88	Confident	0 Å²	0	14 Å²	14	0%	0	7%	0.071	C	C	.	.	B	Isolated β-bridge	trans	-109.4	167.6	175.4	64.3	0	0	0	0	111.8	K352 T353 G354 N359 D598 P599 R601	K352-T357 HydrophobicContact CD-CG2 4.21Å; K352-T357 HydrophobicContact CG-CG2 3.99Å; K352-T357 PolarHBondContact O-N 3.17Å; K352-T357 PolarHBondContact O-OG1 2.78Å; K352-T357 VanDerWaalsContact O-OG1 3.04Å; T353-T357 WeakPolarHBondContact CA-OG1 3.45Å; G354-T357 CarbonylContact C-O 3.56Å; G354-T357 WeakPolarHBondContact CA-O 3.12Å; G354-T357 PolarHBondContact N-OG1 3.17Å; T357-N359 VanDerWaalsContact C-N 3.26Å; T357-N359 PolarHBondContact O-N 2.89Å; T357-D598 VanDerWaalsContact CB-CG 3.44Å; T357-D598 WeakPolarHBondContact CB-OD1 3.37Å; T357-D598 WeakPolarHBondContact CB-OD2 3.46Å; T357-D598 VanDerWaalsContact OG1-CG 3.25Å; T357-D598 PolarHBondContact OG1-OD1 2.86Å; T357-D598 PolarHBondContact OG1-OD2 3.36Å; T357-P599 VanDerWaalsContact CA-O 3.29Å; T357-P599 WeakPolarHBondContact CA-O 3.47Å; T357-P599 WeakPolarHBondContact CB-O 3.26Å; T357-R601 PolarHBondContact O-NE 3.41Å
358	T	79.1	Confident	88	Confident	23 Å²	23	14.2 Å²	14.2	14%	0.141	7%	0.072	C	C	.	.			trans	-77	-12	179.2	57	0	0	0	0	113.3	Q360 S387 P599 R601	T358-Q360 WeakPolarHBondContact O-CG 3.12Å; T358-Q360 PolarHBondContact O-N 2.92Å; T358-Q360 PolarHBondContact OG1-N 2.92Å; T358-S387 PolarHBondContact OG1-O 3.48Å; T358-P599 PolarHBondContact N-O 2.89Å; T358-R601 HydrophobicContact CG2-CG 3.99Å
359	N	77.7	Confident	87.8	Confident	54 Å²	54	14.6 Å²	14.6	29%	0.289	8%	0.075	S	C	.	.	S	Bend	trans	53.2	30.1	-165.5	-164.6	14.7	0	0	0	112.1	S184 T353 T357 D598	S184-N359 PolarHBondContact OG-ND2 2.82Å; T353-N359 HydrophobicContact CG2-CB 3.99Å; T353-N359 WeakPolarHBondContact CG2-OD1 3.49Å; T357-N359 VanDerWaalsContact C-N 3.26Å; T357-N359 PolarHBondContact O-N 2.89Å; N359-D598 WeakPolarHBondContact CA-OD1 3.29Å; N359-D598 PolarHBondContact N-OD1 2.97Å
360	Q	82.9	Confident	87.6	Confident	51 Å²	51	17.2 Å²	17.2	24%	0.238	9%	0.089	C	C	.	.			trans	-121.2	97.9	179	-61.4	-168.8	14.5	0	0	108.8	T358 S362 Y389 D598 P599	T358-Q360 WeakPolarHBondContact O-CG 3.12Å; T358-Q360 PolarHBondContact O-N 2.92Å; T358-Q360 PolarHBondContact OG1-N 2.92Å; Q360-S362 PolarHBondContact O-N 3.33Å; Q360-Y389 HydrophobicContact CB-CD2 4.06Å; Q360-Y389 HydrophobicContact CB-CE2 3.89Å; Q360-Y389 HydrophobicContact CB-CG 4.47Å; Q360-Y389 HydrophobicContact CG-CD2 3.84Å; Q360-Y389 HydrophobicContact CG-CE2 3.77Å; Q360-D598 PolarHBondContact N-OD1 3.31Å; Q360-P599 WeakPolarHBondContact O-CD 3.49Å
361	M	88.3	Confident	87.5	Confident	28 Å²	28	23 Å²	23	14%	0.138	11%	0.114	C	C	.	.			trans	-57.8	123.5	178.8	-168	64.4	59.2	0	0	109.2	Y389 A440 A444 M596 L597	M361-Y389 PolarHBondContact N-OH 3.17Å; M361-Y389 VanDerWaalsContact O-CE1 3.28Å; M361-Y389 WeakPolarHBondContact O-CE1 3.42Å; M361-A440 HydrophobicContact CB-CB 4Å; M361-A444 HydrophobicContact CB-CB 4.15Å; M361-A444 HydrophobicContact CG-CB 3.94Å; M361-A444 WeakPolarHBondContact O-CB 3.34Å; M361-M596 HydrophobicContact CG-CB 4.2Å; M361-M596 HydrophobicContact CG-CG 3.94Å; M361-M596 HydrophobicContact CG-SD 3.59Å; M361-M596 VanDerWaalsContact CG-SD 3.59Å; M361-M596 HydrophobicContact SD-CB 4.08Å; M361-M596 HydrophobicContact SD-CG 3.69Å; M361-M596 HydrophobicContact SD-SD 4.05Å; M361-L597 VanDerWaalsContact SD-C 3.59Å
362	S	91.4	Very high	87.6	Confident	2 Å²	2	24.6 Å²	24.6	1%	0.014	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.7	-177	-149.5	0	0	0	0	110.6	Q360 C364 G386 M596 L597	Q360-S362 PolarHBondContact O-N 3.33Å; S362-C364 PolarHBondContact O-N 3.38Å; S362-C364 PolarHBondContact O-SG 3.46Å; S362-G386 PolarHBondContact OG-O 3.36Å; S362-G386 VanDerWaalsContact OG-O 3.1Å; S362-M596 CarbonylContact O-C 3.59Å; S362-M596 WeakPolarHBondContact O-CA 3.5Å; S362-M596 VanDerWaalsContact O-CB 3.28Å; S362-M596 WeakPolarHBondContact O-CB 3.26Å; S362-L597 PolarHBondContact N-O 3.5Å; S362-L597 PolarHBondContact O-N 3.34Å
363	V	94.5	Very high	87.5	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.012	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	125.1	173.1	-175.2	0	0	0	0	108.2	R365 I384 A444 L445 L448 V594 M596	V363-R365 WeakPolarHBondContact CG1-O 3.45Å; V363-I384 HydrophobicContact CG1-CD1 4.12Å; V363-I384 WeakPolarHBondContact O-CB 3.26Å; V363-I384 WeakPolarHBondContact O-CG2 3.36Å; V363-A444 HydrophobicContact CG2-CB 4.24Å; V363-L445 HydrophobicContact CG2-CD2 4.26Å; V363-L448 HydrophobicContact CB-CB 4.27Å; V363-L448 HydrophobicContact CB-CD1 4.25Å; V363-L448 HydrophobicContact CB-CD2 4.25Å; V363-L448 HydrophobicContact CB-CG 4.46Å; V363-L448 HydrophobicContact CG1-CD1 4.2Å; V363-L448 HydrophobicContact CG1-CD2 3.96Å; V363-L448 HydrophobicContact CG2-CB 4.04Å; V363-L448 HydrophobicContact CG2-CD2 4.09Å; V363-V594 HydrophobicContact CG1-CB 3.99Å; V363-V594 HydrophobicContact CG1-CG1 4.41Å; V363-M596 HydrophobicContact CG2-CB 4.18Å; V363-M596 HydrophobicContact CG2-CE 4.25Å
364	C	92.1	Very high	87.5	Confident	27 Å²	27	38.5 Å²	38.5	18%	0.182	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-24.8	-176.6	-62.5	0	0	0	0	113	S362 S383 I384 G595 L597	S362-C364 PolarHBondContact O-N 3.38Å; S362-C364 PolarHBondContact O-SG 3.46Å; C364-S383 CarbonylContact O-C 3.53Å; C364-S383 VanDerWaalsContact O-CA 3.32Å; C364-S383 WeakPolarHBondContact O-CA 3.47Å; C364-I384 PolarHBondContact O-N 2.97Å; C364-G595 PolarHBondContact N-O 3.33Å; C364-L597 HydrophobicContact CB-CD2 3.71Å; C364-L597 WeakPolarHBondContact SG-CD2 3.43Å
365	R	94.4	Very high	87.7	Confident	82 Å²	82	41.6 Å²	41.6	31%	0.309	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	148.5	174.8	-59.3	-76.7	-165.2	159.7	2.4	110.2	V363 F382 W549 D554 L556 G595	V363-R365 WeakPolarHBondContact CG1-O 3.45Å; R365-F382 WeakPolarHBondContact CA-O 3.35Å; R365-W549 HydrophobicContact CB-CD2 4.22Å; R365-W549 HydrophobicContact CB-CE3 4.05Å; R365-W549 HydrophobicContact CB-CH2 3.47Å; R365-W549 VanDerWaalsContact CB-CH2 3.47Å; R365-W549 HydrophobicContact CB-CZ2 3.67Å; R365-W549 HydrophobicContact CB-CZ3 3.69Å; R365-W549 HydrophobicContact CG-CZ2 4.31Å; R365-D554 IonicContact CZ-OD2 3.77Å; R365-D554 IonicContact NE-OD2 3.59Å; R365-D554 PolarHBondContact NE-OD2 2.95Å; R365-D554 IonicContact NH2-OD1 2.58Å; R365-D554 IonicContact NH2-OD2 2.63Å; R365-D554 PolarHBondContact NH2-OD2 3.07Å; R365-L556 HydrophobicContact CB-CD1 3.74Å; R365-L556 HydrophobicContact CG-CD1 3.46Å; R365-L556 VanDerWaalsContact CG-CD1 3.46Å; R365-G595 PolarHBondContact N-O 3.29Å; R365-G595 VanDerWaalsContact N-O 3.11Å; R365-G595 PolarHBondContact O-N 3.43Å
366	M	96.4	Very high	87.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	153.6	165.1	68.6	-176.3	174.4	0	0	110.8	F382 I384 I395 L410 L413 L448 M452 C593 V594	M366-F382 HydrophobicContact CE-CB 3.91Å; M366-F382 HydrophobicContact CE-CD2 4.25Å; M366-F382 HydrophobicContact CE-CG 4.09Å; M366-F382 HydrophobicContact CG-CB 3.91Å; M366-F382 HydrophobicContact CG-CD2 4.24Å; M366-F382 HydrophobicContact CG-CG 4.49Å; M366-F382 PolarHBondContact N-O 2.85Å; M366-F382 PolarHBondContact O-N 3.22Å; M366-I384 HydrophobicContact CB-CD1 4.31Å; M366-I384 HydrophobicContact CG-CD1 3.95Å; M366-I384 HydrophobicContact SD-CD1 4.37Å; M366-I395 HydrophobicContact CE-CD1 4.39Å; M366-I395 HydrophobicContact CE-CG2 3.57Å; M366-L410 HydrophobicContact CE-CD1 4.02Å; M366-L410 HydrophobicContact CE-CD2 3.66Å; M366-L410 HydrophobicContact CE-CG 4.49Å; M366-L410 HydrophobicContact SD-CD2 3.95Å; M366-L413 HydrophobicContact SD-CD2 4.19Å; M366-L448 HydrophobicContact SD-CD1 4.25Å; M366-L448 HydrophobicContact SD-CD2 4.42Å; M366-M452 HydrophobicContact CE-CE 4.13Å; M366-M452 HydrophobicContact CE-CG 4.37Å; M366-M452 HydrophobicContact CE-SD 4.38Å; M366-M452 HydrophobicContact SD-CE 4.21Å; M366-M452 HydrophobicContact SD-SD 4.16Å; M366-C593 CarbonylContact C-O 3.58Å; M366-C593 WeakPolarHBondContact CA-O 3.25Å; M366-C593 WeakPolarHBondContact CB-O 3.47Å; M366-V594 HydrophobicContact CB-CG1 3.92Å
367	F	96.2	Very high	88	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	151.9	173.4	74.2	-108.2	0	0	0	112.2	L379 H380 E381 L542 K545 I546 W549 F590 G592 C593	F367-L379 HydrophobicContact CD2-CD1 4.08Å; F367-L379 HydrophobicContact CD2-CD2 4.11Å; F367-L379 HydrophobicContact CE2-CD1 4.34Å; F367-L379 HydrophobicContact CE2-CD2 4.42Å; F367-L379 HydrophobicContact CG-CD1 4.35Å; F367-H380 WeakPolarHBondContact CA-O 3.42Å; F367-H380 WeakPolarHBondContact CB-O 3.45Å; F367-E381 HydrophobicContact CB-CG 4.19Å; F367-L542 HydrophobicContact CE2-CD2 3.84Å; F367-L542 HydrophobicContact CZ-CD2 4.36Å; F367-K545 HydrophobicContact CD1-CG 4.31Å; F367-K545 HydrophobicContact CE1-CG 4.14Å; F367-I546 HydrophobicContact CE1-CG1 3.83Å; F367-I546 HydrophobicContact CZ-CD1 4.05Å; F367-I546 HydrophobicContact CZ-CG1 3.84Å; F367-W549 HydrophobicContact CB-CH2 4.09Å; F367-W549 HydrophobicContact CD1-CE3 4.42Å; F367-W549 AromaticContact CD1-CH2 3.42Å; F367-W549 HydrophobicContact CD1-CH2 3.42Å; F367-W549 VanDerWaalsContact CD1-CH2 3.42Å; F367-W549 AromaticContact CD1-CZ2 3.89Å; F367-W549 HydrophobicContact CD1-CZ2 3.89Å; F367-W549 AromaticContact CD1-CZ3 3.72Å; F367-W549 HydrophobicContact CD1-CZ3 3.72Å; F367-W549 HydrophobicContact CE1-CH2 4.32Å; F367-W549 HydrophobicContact CE1-CZ3 4.23Å; F367-W549 HydrophobicContact CG-CH2 4.21Å; F367-F590 HydrophobicContact CE2-CE1 4.01Å; F367-F590 HydrophobicContact CE2-CZ 4.13Å; F367-F590 HydrophobicContact CZ-CZ 4.31Å; F367-G592 VanDerWaalsContact O-CA 3.22Å; F367-G592 WeakPolarHBondContact O-CA 3.23Å; F367-C593 HydrophobicContact CD1-CB 3.99Å; F367-C593 HydrophobicContact CE1-CB 3.4Å; F367-C593 HydrophobicContact CE2-CB 4.06Å; F367-C593 HydrophobicContact CZ-CB 3.42Å; F367-C593 VanDerWaalsContact CZ-CB 3.42Å; F367-C593 PolarHBondContact N-O 2.9Å; F367-C593 PolarHBondContact O-N 3.16Å; F367-C593 VanDerWaalsContact O-N 3.08Å
368	V	96.1	Very high	88.3	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.024	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	159.1	169.6	-64	0	0	0	0	109.3	H380 F382 L410 L413	V368-H380 HydrophobicContact CG2-CB 4.07Å; V368-H380 PolarHBondContact N-O 3.13Å; V368-H380 VanDerWaalsContact N-O 3.14Å; V368-H380 PolarHBondContact O-N 2.78Å; V368-F382 HydrophobicContact CG2-CE2 4.17Å; V368-L410 HydrophobicContact CG1-CD2 3.94Å; V368-L410 HydrophobicContact CG2-CD2 4.2Å; V368-L410 HydrophobicContact CG2-CG 4.46Å; V368-L413 HydrophobicContact CG1-CB 4.41Å; V368-L413 HydrophobicContact CG1-CD1 3.6Å
369	A	93.8	Very high	89	Confident	8 Å²	8	49.2 Å²	49.2	7%	0.066	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	136.8	176.2	0	0	0	0	0	111.4	L525 R526 V527	A369-L525 HydrophobicContact CB-CD1 4.07Å; A369-L525 HydrophobicContact CB-CD2 4.18Å; A369-L525 HydrophobicContact CB-CG 4.22Å; A369-R526 WeakPolarHBondContact CB-O 3.37Å; A369-V527 HydrophobicContact CB-CG2 4.24Å
370	D	91.7	Very high	89.7	Confident	55 Å²	55	48 Å²	48	29%	0.294	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-62.2	177.2	172.9	26	0	0	0	110.7	T378 H380 V527	D370-T378 WeakPolarHBondContact CB-O 3.31Å; D370-T378 PolarHBondContact N-O 2.89Å; D370-T378 PolarHBondContact OD2-OG1 2.75Å; D370-H380 VanDerWaalsContact CB-CE1 3.45Å; D370-H380 WeakPolarHBondContact CB-CE1 3.01Å; D370-H380 IonicContact OD1-CE1 3.29Å; D370-H380 PolarHBondContact OD1-CE1 2.95Å; D370-H380 VanDerWaalsContact OD1-CE1 3.29Å; D370-H380 IonicContact OD1-NE2 3.29Å; D370-H380 PolarHBondContact OD1-NE2 3.37Å; D370-H380 IonicContact OD2-CE1 3.16Å; D370-H380 PolarHBondContact OD2-CE1 3.43Å; D370-H380 IonicContact OD2-ND1 3.71Å; D370-H380 IonicContact OD2-NE2 3.96Å; D370-V527 WeakPolarHBondContact O-CG1 3.34Å
371	K	89.8	Confident	90.3	Very high	121 Å²	121	48.9 Å²	48.9	53%	0.526	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	156.4	177.3	-70.1	179.2	-179.8	176.7	0	110.9	C377 T378	K371-C377 WeakPolarHBondContact O-CA 3.35Å; K371-C377 PolarHBondContact O-SG 3.21Å; K371-C377 VanDerWaalsContact O-SG 3.39Å; K371-T378 PolarHBondContact N-OG1 2.58Å; K371-T378 PolarHBondContact O-N 3.1Å; K371-T378 PolarHBondContact O-OG1 3.46Å
372	V	88.3	Confident	90.7	Very high	44 Å²	44	47.6 Å²	47.6	27%	0.267	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	118.3	173.4	176.2	0	0	0	0	107.4	S376 C377 L525 V527 V532 L538	V372-S376 WeakPolarHBondContact CA-O 3.33Å; V372-C377 HydrophobicContact CG2-CB 4.03Å; V372-L525 HydrophobicContact CG2-CD2 3.89Å; V372-V527 HydrophobicContact CG2-CG2 3.74Å; V372-V532 HydrophobicContact CB-CG2 4.5Å; V372-V532 HydrophobicContact CG2-CG2 4.11Å; V372-L538 HydrophobicContact CG1-CD1 3.89Å; V372-L538 HydrophobicContact CG1-CD2 4.24Å
373	E	83.7	Confident	90.8	Very high	134 Å²	134	48.9 Å²	48.9	63%	0.626	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	123.4	175.9	-71.3	179.6	-174.4	0	0	108.2	S375 S376	E373-S375 PolarHBondContact O-N 3.33Å; E373-S376 PolarHBondContact N-O 2.52Å; E373-S376 PolarHBondContact O-N 2.71Å; E373-S376 VanDerWaalsContact O-O 3.13Å; E373-S376 PolarHBondContact O-OG 2.88Å
374	D	78.3	Confident	90.8	Very high	167 Å²	167	49.4 Å²	49.4	89%	0.893	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	-96.3	-172.5	-58.7	-39.6	0	0	0	114.1
375	S	78.1	Confident	90.8	Very high	72 Å²	72	50.8 Å²	50.8	50%	0.503	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	13.3	-178.5	-62.7	0	0	0	0	113.1	E373	E373-S375 PolarHBondContact O-N 3.33Å
376	S	82.7	Confident	90.5	Very high	66 Å²	66	48.4 Å²	48.4	46%	0.462	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	146.2	179.4	71.9	0	0	0	0	111.3	V372 E373	V372-S376 WeakPolarHBondContact CA-O 3.33Å; E373-S376 PolarHBondContact N-O 2.52Å; E373-S376 PolarHBondContact O-N 2.71Å; E373-S376 VanDerWaalsContact O-O 3.13Å; E373-S376 PolarHBondContact O-OG 2.88Å
377	C	87.4	Confident	89.9	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.034	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133	178.1	179	0	0	0	0	111	K371 V372 L538 Q541	K371-C377 WeakPolarHBondContact O-CA 3.35Å; K371-C377 PolarHBondContact O-SG 3.21Å; K371-C377 VanDerWaalsContact O-SG 3.39Å; V372-C377 HydrophobicContact CG2-CB 4.03Å; C377-L538 HydrophobicContact CB-CD2 3.57Å; C377-Q541 PolarHBondContact O-NE2 3.31Å
378	T	91.7	Very high	89.5	Confident	73 Å²	73	52.4 Å²	52.4	45%	0.448	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	136.3	164.9	57	0	0	0	0	109.3	D370 K371	D370-T378 WeakPolarHBondContact CB-O 3.31Å; D370-T378 PolarHBondContact N-O 2.89Å; D370-T378 PolarHBondContact OD2-OG1 2.75Å; K371-T378 PolarHBondContact N-OG1 2.58Å; K371-T378 PolarHBondContact O-N 3.1Å; K371-T378 PolarHBondContact O-OG1 3.46Å
379	L	92.7	Very high	89.3	Confident	38 Å²	38	52.6 Å²	52.6	20%	0.199	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	141.3	-179.1	-58.5	179.1	0	0	0	110.6	F367 E381 L542 K545	F367-L379 HydrophobicContact CD2-CD1 4.08Å; F367-L379 HydrophobicContact CD2-CD2 4.11Å; F367-L379 HydrophobicContact CE2-CD1 4.34Å; F367-L379 HydrophobicContact CE2-CD2 4.42Å; F367-L379 HydrophobicContact CG-CD1 4.35Å; L379-E381 HydrophobicContact CB-CG 4.42Å; L379-L542 HydrophobicContact CD1-CD2 4.28Å; L379-L542 HydrophobicContact CD2-CD2 3.69Å; L379-K545 HydrophobicContact CD1-CB 4.46Å; L379-K545 HydrophobicContact CD1-CG 4.16Å
380	H	94.2	Very high	89.2	Confident	28 Å²	28	52.8 Å²	52.8	13%	0.13	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	107.4	159.9	-74.6	-20.4	0	0	0	109.2	F367 V368 D370 F382 K397 Y407	F367-H380 WeakPolarHBondContact CA-O 3.42Å; F367-H380 WeakPolarHBondContact CB-O 3.45Å; V368-H380 HydrophobicContact CG2-CB 4.07Å; V368-H380 PolarHBondContact N-O 3.13Å; V368-H380 VanDerWaalsContact N-O 3.14Å; V368-H380 PolarHBondContact O-N 2.78Å; D370-H380 VanDerWaalsContact CB-CE1 3.45Å; D370-H380 WeakPolarHBondContact CB-CE1 3.01Å; D370-H380 IonicContact OD1-CE1 3.29Å; D370-H380 PolarHBondContact OD1-CE1 2.95Å; D370-H380 VanDerWaalsContact OD1-CE1 3.29Å; D370-H380 IonicContact OD1-NE2 3.29Å; D370-H380 PolarHBondContact OD1-NE2 3.37Å; D370-H380 IonicContact OD2-CE1 3.16Å; D370-H380 PolarHBondContact OD2-CE1 3.43Å; D370-H380 IonicContact OD2-ND1 3.71Å; D370-H380 IonicContact OD2-NE2 3.96Å; H380-F382 HydrophobicContact CB-CD2 4.48Å; H380-F382 HydrophobicContact CB-CE2 3.51Å; H380-F382 HydrophobicContact CB-CZ 3.76Å; H380-F382 WeakPolarHBondContact O-CD2 3.48Å; H380-F382 WeakPolarHBondContact O-CE2 3.5Å; H380-K397 PolarHBondContact CE1-NZ 2.82Å; H380-K397 PolarHBondContact ND1-NZ 2.82Å; H380-K397 PolarHBondContact NE2-NZ 2.83Å; H380-Y407 AromaticContact CD2-CD1 3.54Å; H380-Y407 AromaticContact CD2-CE1 3.6Å; H380-Y407 AromaticContact NE2-CD1 3.83Å; H380-Y407 AromaticContact NE2-CE1 3.58Å
381	E	94.7	Very high	89.3	Confident	70 Å²	70	50.7 Å²	50.7	33%	0.327	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136.2	174.3	-64.3	-175.1	-142.5	0	0	111	F367 L379 K545	F367-E381 HydrophobicContact CB-CG 4.19Å; L379-E381 HydrophobicContact CB-CG 4.42Å; E381-K545 WeakPolarHBondContact OE1-CE 3.31Å; E381-K545 IonicContact OE1-NZ 2.94Å; E381-K545 PolarHBondContact OE1-NZ 2.77Å; E381-K545 WeakPolarHBondContact OE2-CE 3.36Å; E381-K545 IonicContact OE2-NZ 3.18Å; E381-K545 PolarHBondContact OE2-NZ 2.66Å
382	F	95.7	Very high	89.3	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.009	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.8	179.2	-55.2	-90.3	0	0	0	110.5	R365 M366 V368 H380 I395 L396 K397 V402 Y407 L410	R365-F382 WeakPolarHBondContact CA-O 3.35Å; M366-F382 HydrophobicContact CE-CB 3.91Å; M366-F382 HydrophobicContact CE-CD2 4.25Å; M366-F382 HydrophobicContact CE-CG 4.09Å; M366-F382 HydrophobicContact CG-CB 3.91Å; M366-F382 HydrophobicContact CG-CD2 4.24Å; M366-F382 HydrophobicContact CG-CG 4.49Å; M366-F382 PolarHBondContact N-O 2.85Å; M366-F382 PolarHBondContact O-N 3.22Å; V368-F382 HydrophobicContact CG2-CE2 4.17Å; H380-F382 HydrophobicContact CB-CD2 4.48Å; H380-F382 HydrophobicContact CB-CE2 3.51Å; H380-F382 HydrophobicContact CB-CZ 3.76Å; H380-F382 WeakPolarHBondContact O-CD2 3.48Å; H380-F382 WeakPolarHBondContact O-CE2 3.5Å; F382-I395 HydrophobicContact CB-CG2 4.04Å; F382-I395 HydrophobicContact CD1-CG2 4.12Å; F382-I395 HydrophobicContact CG-CG2 4.35Å; F382-L396 CarbonylContact C-O 3.55Å; F382-L396 VanDerWaalsContact CA-O 3.24Å; F382-L396 WeakPolarHBondContact CA-O 3.25Å; F382-K397 HydrophobicContact CD1-CB 3.98Å; F382-K397 HydrophobicContact CD1-CG 4.34Å; F382-K397 HydrophobicContact CE1-CB 4.1Å; F382-K397 HydrophobicContact CE1-CD 3.89Å; F382-K397 HydrophobicContact CE1-CG 4.21Å; F382-K397 HydrophobicContact CZ-CD 4.42Å; F382-V402 HydrophobicContact CD1-CG2 3.95Å; F382-V402 HydrophobicContact CE1-CG2 3.95Å; F382-Y407 HydrophobicContact CE1-CD2 4.39Å; F382-Y407 HydrophobicContact CE1-CE2 4.11Å; F382-Y407 HydrophobicContact CZ-CD1 4.2Å; F382-Y407 HydrophobicContact CZ-CD2 4.24Å; F382-Y407 HydrophobicContact CZ-CE1 4.22Å; F382-Y407 HydrophobicContact CZ-CE2 4.28Å; F382-Y407 HydrophobicContact CZ-CG 4.2Å; F382-L410 HydrophobicContact CD1-CD1 4.48Å; F382-L410 HydrophobicContact CD2-CD1 4.32Å; F382-L410 HydrophobicContact CD2-CD2 4.09Å; F382-L410 HydrophobicContact CE1-CD1 4.02Å; F382-L410 HydrophobicContact CE2-CD1 3.85Å; F382-L410 HydrophobicContact CE2-CD2 3.86Å; F382-L410 HydrophobicContact CE2-CG 4.08Å; F382-L410 HydrophobicContact CZ-CD1 3.68Å; F382-L410 HydrophobicContact CZ-CG 4.27Å
383	S	94.6	Very high	89.4	Confident	29 Å²	29	50.5 Å²	50.5	20%	0.203	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	144.9	169.1	55.5	0	0	0	0	110.5	C364 L396	C364-S383 CarbonylContact O-C 3.53Å; C364-S383 VanDerWaalsContact O-CA 3.32Å; C364-S383 WeakPolarHBondContact O-CA 3.47Å; S383-L396 PolarHBondContact N-O 2.81Å; S383-L396 PolarHBondContact O-N 2.92Å
384	I	94.7	Very high	89.8	Confident	13 Å²	13	49.3 Å²	49.3	7%	0.067	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.5	-175	-59	90.9	0	0	0	108.7	V363 C364 M366 I395 L448 K451	V363-I384 HydrophobicContact CG1-CD1 4.12Å; V363-I384 WeakPolarHBondContact O-CB 3.26Å; V363-I384 WeakPolarHBondContact O-CG2 3.36Å; C364-I384 PolarHBondContact O-N 2.97Å; M366-I384 HydrophobicContact CB-CD1 4.31Å; M366-I384 HydrophobicContact CG-CD1 3.95Å; M366-I384 HydrophobicContact SD-CD1 4.37Å; I384-I395 HydrophobicContact CB-CD1 4.06Å; I384-I395 HydrophobicContact CG1-CD1 3.4Å; I384-I395 HydrophobicContact CG2-CD1 3.79Å; I384-L448 HydrophobicContact CD1-CD1 4.42Å; I384-L448 HydrophobicContact CG1-CD1 3.92Å; I384-L448 HydrophobicContact CG2-CD1 4.44Å; I384-K451 HydrophobicContact CG2-CD 3.86Å
385	T	92.3	Very high	90.7	Very high	55 Å²	55	41.7 Å²	41.7	34%	0.337	25%	0.251	S	S	.	.			trans	-94.2	166.3	175.6	70.7	0	0	0	0	112.2	G393 Q394 L396 K451	T385-G393 WeakPolarHBondContact OG1-CA 3.36Å; T385-Q394 PolarHBondContact N-O 2.68Å; T385-Q394 PolarHBondContact OG1-N 3.35Å; T385-Q394 PolarHBondContact OG1-O 2.8Å; T385-L396 HydrophobicContact CG2-CD1 3.72Å; T385-L396 HydrophobicContact CG2-CG 4.22Å; T385-K451 PolarHBondContact O-NZ 3.22Å
386	G	88.4	Confident	91.5	Very high	32 Å²	32	39.5 Å²	39.5	33%	0.33	23%	0.234	S	C	.	.			trans	88.8	123.1	-175.7	0	0	0	0	0	111.5	S362 K451	S362-G386 PolarHBondContact OG-O 3.36Å; S362-G386 VanDerWaalsContact OG-O 3.1Å; G386-K451 PolarHBondContact O-NZ 3.06Å; G386-K451 VanDerWaalsContact O-NZ 3.08Å
387	S	83.4	Confident	92	Very high	37 Å²	37	39.5 Å²	39.5	26%	0.259	23%	0.225	S	C	.	.	S	Bend	trans	-103.8	13.6	-173	53.4	0	0	0	0	113.4	T358 P599	T358-S387 PolarHBondContact OG1-O 3.48Å; S387-P599 WeakPolarHBondContact O-CG 3.41Å
388	T	88	Confident	92	Very high	47 Å²	47	41.8 Å²	41.8	29%	0.288	25%	0.25	S	S	.	.	S	Bend	trans	-127.8	173.7	-175	62.1	0	0	0	0	111.1	A390	T388-A390 PolarHBondContact O-N 2.81Å; T388-A390 WeakPolarHBondContact OG1-CB 3.38Å; T388-A390 PolarHBondContact OG1-N 2.77Å
389	Y	91.1	Very high	91.8	Very high	9 Å²	9	46 Å²	46	4%	0.035	27%	0.27	C	S	.	.	S	Bend	trans	-71.7	-14.9	170.6	-69.9	-48.6	0	0	0	113.2	Q360 M361 L425 K436 A440 T443 T447	Q360-Y389 HydrophobicContact CB-CD2 4.06Å; Q360-Y389 HydrophobicContact CB-CE2 3.89Å; Q360-Y389 HydrophobicContact CB-CG 4.47Å; Q360-Y389 HydrophobicContact CG-CD2 3.84Å; Q360-Y389 HydrophobicContact CG-CE2 3.77Å; M361-Y389 PolarHBondContact N-OH 3.17Å; M361-Y389 VanDerWaalsContact O-CE1 3.28Å; M361-Y389 WeakPolarHBondContact O-CE1 3.42Å; Y389-L425 WeakPolarHBondContact O-CD1 3.08Å; Y389-K436 HydrophobicContact CD2-CB 4.28Å; Y389-K436 HydrophobicContact CE2-CB 3.99Å; Y389-K436 HydrophobicContact CE2-CD 4.28Å; Y389-K436 HydrophobicContact CE2-CG 4.15Å; Y389-A440 VanDerWaalsContact OH-CB 3.23Å; Y389-A440 WeakPolarHBondContact OH-CB 3.26Å; Y389-T443 HydrophobicContact CD1-CG2 3.64Å; Y389-T443 HydrophobicContact CE1-CG2 3.92Å; Y389-T443 HydrophobicContact CG-CG2 4.18Å; Y389-T447 VanDerWaalsContact O-CG2 3.29Å; Y389-T447 WeakPolarHBondContact O-CG2 3.47Å; Y389-T447 PolarHBondContact O-OG1 2.95Å
390	A	92.2	Very high	91.8	Very high	12 Å²	12	53.6 Å²	53.6	10%	0.099	30%	0.296	C	S	.	.	S	Bend	trans	-56.5	137.9	176.9	0	0	0	0	0	110.7	T388 E392 Y434	T388-A390 PolarHBondContact O-N 2.81Å; T388-A390 WeakPolarHBondContact OG1-CB 3.38Å; T388-A390 PolarHBondContact OG1-N 2.77Å; A390-E392 HydrophobicContact CB-CB 4.42Å; A390-E392 HydrophobicContact CB-CG 4.34Å; A390-E392 PolarHBondContact O-N 3.02Å; A390-Y434 HydrophobicContact CB-CD2 3.64Å; A390-Y434 HydrophobicContact CB-CE2 4.25Å; A390-Y434 HydrophobicContact CB-CG 4.38Å
391	P	93	Very high	91.8	Very high	10 Å²	10	56.3 Å²	56.3	7%	0.065	32%	0.316	C	S	.	.	S	Bend	trans	-76.6	39.7	178.7	34.5	-35.5	0	0	0	111.9	L425 Y434 E450 R467	P391-L425 HydrophobicContact CG-CD2 4.39Å; P391-Y434 HydrophobicContact CG-CE1 4.13Å; P391-Y434 HydrophobicContact CG-CE2 4.35Å; P391-E450 HydrophobicContact CB-CB 3.58Å; P391-E450 HydrophobicContact CB-CG 4.23Å; P391-R467 HydrophobicContact CG-CG 3.81Å; P391-R467 PolarHBondContact O-NH2 3.15Å
392	E	90.3	Very high	91.8	Very high	130 Å²	130	54.7 Å²	54.7	61%	0.607	31%	0.311	S	S	*	.			trans	-113.4	120.5	-178.6	-64.4	178.6	-169.9	0	0	108.8	A390 K451	A390-E392 HydrophobicContact CB-CB 4.42Å; A390-E392 HydrophobicContact CB-CG 4.34Å; A390-E392 PolarHBondContact O-N 3.02Å; E392-K451 VanDerWaalsContact O-CE 3.3Å; E392-K451 WeakPolarHBondContact O-CE 3.36Å
393	G	90.7	Very high	91.6	Very high	32 Å²	32	58.2 Å²	58.2	33%	0.33	33%	0.327	S	S	.	.			trans	159.2	170.1	-176.4	0	0	0	0	0	111.7	T385	T385-G393 WeakPolarHBondContact OG1-CA 3.36Å
394	Q	92.5	Very high	91.4	Very high	108 Å²	108	56.9 Å²	56.9	51%	0.505	32%	0.318	S	S	.	.			trans	-128.3	150	-179.6	-65	-179.2	-3.5	0	0	109.8	T385 L396	T385-Q394 PolarHBondContact N-O 2.68Å; T385-Q394 PolarHBondContact OG1-N 3.35Å; T385-Q394 PolarHBondContact OG1-O 2.8Å; Q394-L396 HydrophobicContact CB-CD2 4.15Å
395	I	95.7	Very high	91	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.036	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.6	171.6	-49.7	-61.2	0	0	0	107.8	M366 F382 I384 P401 V402 C404 L448 K451 M452	M366-I395 HydrophobicContact CE-CD1 4.39Å; M366-I395 HydrophobicContact CE-CG2 3.57Å; F382-I395 HydrophobicContact CB-CG2 4.04Å; F382-I395 HydrophobicContact CD1-CG2 4.12Å; F382-I395 HydrophobicContact CG-CG2 4.35Å; I384-I395 HydrophobicContact CB-CD1 4.06Å; I384-I395 HydrophobicContact CG1-CD1 3.4Å; I384-I395 HydrophobicContact CG2-CD1 3.79Å; I395-P401 WeakPolarHBondContact O-CA 3.37Å; I395-V402 HydrophobicContact CG2-CG2 4.23Å; I395-V402 PolarHBondContact O-N 3.49Å; I395-C404 VanDerWaalsContact CG1-SG 3.5Å; I395-L448 HydrophobicContact CD1-CD1 4.29Å; I395-K451 HydrophobicContact CD1-CB 4.35Å; I395-M452 HydrophobicContact CD1-CG 4.16Å; I395-M452 HydrophobicContact CG1-CG 4.28Å
396	L	95.1	Very high	90.9	Very high	26 Å²	26	59.6 Å²	59.6	14%	0.136	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	140.8	-175.7	-48.3	176.4	0	0	0	110	F382 S383 T385 Q394 R400 P401	F382-L396 CarbonylContact C-O 3.55Å; F382-L396 VanDerWaalsContact CA-O 3.24Å; F382-L396 WeakPolarHBondContact CA-O 3.25Å; S383-L396 PolarHBondContact N-O 2.81Å; S383-L396 PolarHBondContact O-N 2.92Å; T385-L396 HydrophobicContact CG2-CD1 3.72Å; T385-L396 HydrophobicContact CG2-CG 4.22Å; Q394-L396 HydrophobicContact CB-CD2 4.15Å; L396-R400 CarbonylContact C-O 3.53Å; L396-R400 VanDerWaalsContact CA-O 3.27Å; L396-R400 WeakPolarHBondContact CA-O 3.31Å; L396-P401 HydrophobicContact CD2-CB 4.14Å; L396-P401 HydrophobicContact CD2-CG 3.87Å
397	K	93.3	Very high	91.2	Very high	66 Å²	66	60.6 Å²	60.6	29%	0.287	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	109.9	166.5	-170.1	172.5	-179.6	172.9	0	107.6	H380 F382 N399 R400 V402 Y407	H380-K397 PolarHBondContact CE1-NZ 2.82Å; H380-K397 PolarHBondContact ND1-NZ 2.82Å; H380-K397 PolarHBondContact NE2-NZ 2.83Å; F382-K397 HydrophobicContact CD1-CB 3.98Å; F382-K397 HydrophobicContact CD1-CG 4.34Å; F382-K397 HydrophobicContact CE1-CB 4.1Å; F382-K397 HydrophobicContact CE1-CD 3.89Å; F382-K397 HydrophobicContact CE1-CG 4.21Å; F382-K397 HydrophobicContact CZ-CD 4.42Å; K397-N399 PolarHBondContact O-N 2.87Å; K397-R400 PolarHBondContact N-O 3.01Å; K397-R400 PolarHBondContact O-N 3.45Å; K397-V402 HydrophobicContact CB-CG1 3.7Å; K397-V402 HydrophobicContact CB-CG2 4.18Å; K397-Y407 WeakPolarHBondContact CD-OH 3.44Å; K397-Y407 PolarHBondContact NZ-OH 3.13Å
398	G	88.9	Confident	91.6	Very high	54 Å²	54	63 Å²	63	56%	0.557	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	-122.5	-159	0	0	0	0	0	109.9
399	N	86.4	Confident	91.8	Very high	161 Å²	161	61.1 Å²	61.1	86%	0.861	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	14.9	177.8	-75.2	-8.2	0	0	0	113.9	K397	K397-N399 PolarHBondContact O-N 2.87Å
400	R	93.3	Very high	92	Very high	197 Å²	197	60.7 Å²	60.7	74%	0.743	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.5	-177.7	-66.5	-174.9	-177.5	177.8	1.5	111.4	L396 K397	L396-R400 CarbonylContact C-O 3.53Å; L396-R400 VanDerWaalsContact CA-O 3.27Å; L396-R400 WeakPolarHBondContact CA-O 3.31Å; K397-R400 PolarHBondContact N-O 3.01Å; K397-R400 PolarHBondContact O-N 3.45Å
401	P	93.6	Very high	92.1	Very high	85 Å²	85	62.7 Å²	62.7	55%	0.552	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.4	138.2	170.1	-20.4	32.2	0	0	0	111	I395 L396	I395-P401 WeakPolarHBondContact O-CA 3.37Å; L396-P401 HydrophobicContact CD2-CB 4.14Å; L396-P401 HydrophobicContact CD2-CG 3.87Å
402	V	94.3	Very high	92.2	Very high	36 Å²	36	63.3 Å²	63.3	22%	0.218	34%	0.338	C	S	.	.			trans	-131.4	151.2	179.5	-66.8	0	0	0	0	110.8	F382 I395 K397 Y407	F382-V402 HydrophobicContact CD1-CG2 3.95Å; F382-V402 HydrophobicContact CE1-CG2 3.95Å; I395-V402 HydrophobicContact CG2-CG2 4.23Å; I395-V402 PolarHBondContact O-N 3.49Å; K397-V402 HydrophobicContact CB-CG1 3.7Å; K397-V402 HydrophobicContact CB-CG2 4.18Å; V402-Y407 HydrophobicContact CB-CE2 4.43Å
403	Q	91.8	Very high	92.5	Very high	76 Å²	76	57.1 Å²	57.1	36%	0.355	31%	0.309	S	S	.	.			trans	-87.9	116.1	173.8	-170.1	62	25.8	0	0	109.8	G405 D406 K456	Q403-G405 VanDerWaalsContact C-N 3.26Å; Q403-G405 PolarHBondContact O-N 3.45Å; Q403-D406 PolarHBondContact O-N 3Å; Q403-K456 HydrophobicContact CG-CD 4.38Å; Q403-K456 HydrophobicContact CG-CG 4.45Å
404	C	89.6	Confident	92.8	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.007	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-65.2	-28.5	-175.2	-64.4	0	0	0	0	113.9	I395 D406 Y407 L410 M452 V454	I395-C404 VanDerWaalsContact CG1-SG 3.5Å; C404-D406 PolarHBondContact O-N 2.75Å; C404-D406 VanDerWaalsContact O-N 3.13Å; C404-Y407 PolarHBondContact O-N 3.29Å; C404-Y407 VanDerWaalsContact O-N 3.12Å; C404-L410 HydrophobicContact CB-CB 4.44Å; C404-L410 HydrophobicContact CB-CD1 3.91Å; C404-M452 HydrophobicContact CB-CB 4.21Å; C404-M452 HydrophobicContact CB-CE 4.47Å; C404-M452 WeakPolarHBondContact CB-O 3.23Å; C404-V454 HydrophobicContact CB-CG1 3.94Å
405	G	88.2	Confident	93	Very high	21 Å²	21	51.1 Å²	51.1	22%	0.216	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-64	-11.9	178.1	0	0	0	0	0	114.6	Q403 Y407 V454	Q403-G405 VanDerWaalsContact C-N 3.26Å; Q403-G405 PolarHBondContact O-N 3.45Å; G405-Y407 VanDerWaalsContact C-N 3.29Å; G405-V454 WeakPolarHBondContact CA-O 3.49Å
406	D	90	Very high	93	Very high	104 Å²	104	50.8 Å²	50.8	56%	0.556	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-86.1	-2.7	177.2	-56.2	-18.8	0	0	0	112.4	Q403 C404 K456	Q403-D406 PolarHBondContact O-N 3Å; C404-D406 PolarHBondContact O-N 2.75Å; C404-D406 VanDerWaalsContact O-N 3.13Å; D406-K456 IonicContact OD1-NZ 3.1Å; D406-K456 PolarHBondContact OD1-NZ 2.88Å
407	Y	93.4	Very high	93.1	Very high	53 Å²	53	49.5 Å²	49.5	21%	0.208	27%	0.265	C	S	.	.			trans	-120.4	107.6	179	-60.7	-89.4	0	0	0	110.4	H380 F382 K397 V402 C404 G405 G409 L410 L411	H380-Y407 AromaticContact CD2-CD1 3.54Å; H380-Y407 AromaticContact CD2-CE1 3.6Å; H380-Y407 AromaticContact NE2-CD1 3.83Å; H380-Y407 AromaticContact NE2-CE1 3.58Å; F382-Y407 HydrophobicContact CE1-CD2 4.39Å; F382-Y407 HydrophobicContact CE1-CE2 4.11Å; F382-Y407 HydrophobicContact CZ-CD1 4.2Å; F382-Y407 HydrophobicContact CZ-CD2 4.24Å; F382-Y407 HydrophobicContact CZ-CE1 4.22Å; F382-Y407 HydrophobicContact CZ-CE2 4.28Å; F382-Y407 HydrophobicContact CZ-CG 4.2Å; K397-Y407 WeakPolarHBondContact CD-OH 3.44Å; K397-Y407 PolarHBondContact NZ-OH 3.13Å; V402-Y407 HydrophobicContact CB-CE2 4.43Å; C404-Y407 PolarHBondContact O-N 3.29Å; C404-Y407 VanDerWaalsContact O-N 3.12Å; G405-Y407 VanDerWaalsContact C-N 3.29Å; Y407-G409 PolarHBondContact O-N 3.39Å; Y407-L410 HydrophobicContact CD2-CD1 4.1Å; Y407-L410 HydrophobicContact CG-CD1 4.25Å; Y407-L410 WeakPolarHBondContact O-CB 3.4Å; Y407-L410 PolarHBondContact O-N 3.22Å; Y407-L411 PolarHBondContact O-N 3.22Å
408	D	91.6	Very high	93.3	Very high	89 Å²	89	46.4 Å²	46.4	48%	0.476	25%	0.252	S	S	.	.	H	α-helix	trans	-56.3	-38.2	-177.6	-65.2	-48	0	0	0	113.1	L410 L411 E412 T529	D408-L410 VanDerWaalsContact C-N 3.27Å; D408-L410 PolarHBondContact O-N 2.97Å; D408-L411 WeakPolarHBondContact O-CB 3.35Å; D408-L411 PolarHBondContact O-N 2.84Å; D408-L411 VanDerWaalsContact O-N 3.1Å; D408-E412 PolarHBondContact O-N 3.41Å; D408-E412 VanDerWaalsContact O-N 3.14Å; D408-T529 HydrophobicContact CB-CG2 3.92Å
409	G	92.5	Very high	93.6	Very high	6 Å²	6	44.1 Å²	44.1	6%	0.062	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-34.8	176.3	0	0	0	0	0	112.9	Y407 L413	Y407-G409 PolarHBondContact O-N 3.39Å; G409-L413 VanDerWaalsContact O-CB 3.25Å; G409-L413 WeakPolarHBondContact O-CB 3.42Å; G409-L413 PolarHBondContact O-N 3.06Å
410	L	95.4	Very high	94.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-73	-30	176	-68.8	-173.1	0	0	0	112.3	M366 V368 F382 C404 Y407 D408 L413 A414 M452	M366-L410 HydrophobicContact CE-CD1 4.02Å; M366-L410 HydrophobicContact CE-CD2 3.66Å; M366-L410 HydrophobicContact CE-CG 4.49Å; M366-L410 HydrophobicContact SD-CD2 3.95Å; V368-L410 HydrophobicContact CG1-CD2 3.94Å; V368-L410 HydrophobicContact CG2-CD2 4.2Å; V368-L410 HydrophobicContact CG2-CG 4.46Å; F382-L410 HydrophobicContact CD1-CD1 4.48Å; F382-L410 HydrophobicContact CD2-CD1 4.32Å; F382-L410 HydrophobicContact CD2-CD2 4.09Å; F382-L410 HydrophobicContact CE1-CD1 4.02Å; F382-L410 HydrophobicContact CE2-CD1 3.85Å; F382-L410 HydrophobicContact CE2-CD2 3.86Å; F382-L410 HydrophobicContact CE2-CG 4.08Å; F382-L410 HydrophobicContact CZ-CD1 3.68Å; F382-L410 HydrophobicContact CZ-CG 4.27Å; C404-L410 HydrophobicContact CB-CB 4.44Å; C404-L410 HydrophobicContact CB-CD1 3.91Å; Y407-L410 HydrophobicContact CD2-CD1 4.1Å; Y407-L410 HydrophobicContact CG-CD1 4.25Å; Y407-L410 WeakPolarHBondContact O-CB 3.4Å; Y407-L410 PolarHBondContact O-N 3.22Å; D408-L410 VanDerWaalsContact C-N 3.27Å; D408-L410 PolarHBondContact O-N 2.97Å; L410-L413 PolarHBondContact O-N 2.99Å; L410-A414 WeakPolarHBondContact O-CB 3.38Å; L410-A414 PolarHBondContact O-N 3.38Å; L410-M452 HydrophobicContact CB-CE 3.76Å; L410-M452 HydrophobicContact CD2-CE 4.13Å; L410-M452 HydrophobicContact CG-CE 4.38Å; L410-M452 WeakPolarHBondContact O-CE 3.28Å
411	L	94.8	Very high	94.1	Very high	54 Å²	54	27.3 Å²	27.3	28%	0.283	15%	0.152	S	C	.	.	H	α-helix	trans	-67.3	-43.9	175.5	-171.1	140.4	0	0	0	111.3	Y407 D408 T415 V454 F455	Y407-L411 PolarHBondContact O-N 3.22Å; D408-L411 WeakPolarHBondContact O-CB 3.35Å; D408-L411 PolarHBondContact O-N 2.84Å; D408-L411 VanDerWaalsContact O-N 3.1Å; L411-T415 PolarHBondContact O-N 3.31Å; L411-T415 VanDerWaalsContact O-N 3.09Å; L411-T415 PolarHBondContact O-OG1 3.42Å; L411-V454 HydrophobicContact CG-CG2 4.31Å; L411-F455 HydrophobicContact CD1-CD1 4.41Å; L411-F455 HydrophobicContact CD1-CE1 3.79Å; L411-F455 HydrophobicContact CD1-CZ 3.89Å; L411-F455 HydrophobicContact CD2-CZ 4.14Å; L411-F455 HydrophobicContact CG-CE1 4.45Å; L411-F455 HydrophobicContact CG-CZ 4.04Å
412	E	94.7	Very high	94	Very high	23 Å²	23	27.5 Å²	27.5	11%	0.107	15%	0.148	C	C	.	.	H	α-helix	trans	-68.3	-40.2	173.4	-166	166.7	-135.9	0	0	111.1	D408 A414 T415 V416 K508 R526 T563 V591	D408-E412 PolarHBondContact O-N 3.41Å; D408-E412 VanDerWaalsContact O-N 3.14Å; E412-A414 PolarHBondContact O-N 3.17Å; E412-T415 WeakPolarHBondContact O-CA 3.23Å; E412-T415 WeakPolarHBondContact O-CB 3.21Å; E412-T415 PolarHBondContact O-N 3.13Å; E412-T415 VanDerWaalsContact O-N 3.07Å; E412-V416 WeakPolarHBondContact O-CG2 3.46Å; E412-V416 PolarHBondContact O-N 3.08Å; E412-K508 IonicContact OE1-NZ 3.53Å; E412-K508 PolarHBondContact OE1-NZ 2.55Å; E412-R526 IonicContact OE1-NE 2.71Å; E412-R526 IonicContact OE1-NH2 3.64Å; E412-R526 PolarHBondContact OE1-NH2 3.09Å; E412-R526 WeakPolarHBondContact OE2-CD 3.46Å; E412-R526 WeakPolarHBondContact OE2-CG 3.38Å; E412-R526 IonicContact OE2-CZ 3.89Å; E412-R526 IonicContact OE2-NE 2.8Å; E412-R526 PolarHBondContact OE2-NE 2.86Å; E412-R526 IonicContact OE2-NH2 3.02Å; E412-T563 HydrophobicContact CG-CG2 3.96Å; E412-T563 WeakPolarHBondContact OE1-CG2 3.19Å; E412-V591 HydrophobicContact CB-CG1 4.16Å; E412-V591 HydrophobicContact CG-CG1 4.29Å; E412-V591 HydrophobicContact CG-CG2 4.17Å
413	L	96.9	Very high	93.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-57	-48.3	175.3	-171.4	151.4	0	0	0	112	M366 V368 G409 L410 T415 V416 C417 L448 M452 L561 V591 V594	M366-L413 HydrophobicContact SD-CD2 4.19Å; V368-L413 HydrophobicContact CG1-CB 4.41Å; V368-L413 HydrophobicContact CG1-CD1 3.6Å; G409-L413 VanDerWaalsContact O-CB 3.25Å; G409-L413 WeakPolarHBondContact O-CB 3.42Å; G409-L413 PolarHBondContact O-N 3.06Å; L410-L413 PolarHBondContact O-N 2.99Å; L413-T415 VanDerWaalsContact C-N 3.26Å; L413-T415 PolarHBondContact O-N 3.24Å; L413-V416 PolarHBondContact O-N 3.4Å; L413-C417 PolarHBondContact O-N 3.1Å; L413-C417 PolarHBondContact O-SG 3.18Å; L413-C417 VanDerWaalsContact O-SG 3.35Å; L413-L448 HydrophobicContact CD2-CD2 4.3Å; L413-M452 HydrophobicContact CD2-CE 4.15Å; L413-M452 HydrophobicContact CD2-SD 4.22Å; L413-L561 HydrophobicContact CD1-CD1 4.23Å; L413-L561 HydrophobicContact CD2-CD1 4.02Å; L413-L561 HydrophobicContact CG-CD1 3.67Å; L413-V591 HydrophobicContact CB-CG1 4.21Å; L413-V594 HydrophobicContact CD1-CG1 4.41Å; L413-V594 HydrophobicContact CD2-CG1 3.99Å
414	A	96.8	Very high	93.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62	-35.9	175.9	0	0	0	0	0	111.9	L410 E412 C417 S418 V449 M452 V454 I475	L410-A414 WeakPolarHBondContact O-CB 3.38Å; L410-A414 PolarHBondContact O-N 3.38Å; E412-A414 PolarHBondContact O-N 3.17Å; A414-C417 PolarHBondContact O-N 3.19Å; A414-S418 WeakPolarHBondContact O-CB 3.24Å; A414-S418 PolarHBondContact O-N 3.26Å; A414-V449 HydrophobicContact CB-CG2 4.41Å; A414-V449 WeakPolarHBondContact O-CG2 3.1Å; A414-M452 HydrophobicContact CB-CE 3.87Å; A414-M452 HydrophobicContact CB-SD 4.06Å; A414-V454 HydrophobicContact CB-CG1 3.69Å; A414-V454 HydrophobicContact CB-CG2 3.97Å; A414-I475 HydrophobicContact CB-CD1 4.2Å
415	T	96.1	Very high	94.1	Very high	14 Å²	14	25.1 Å²	25.1	9%	0.086	14%	0.14	C	C	.	.	H	α-helix	trans	-64.5	-44.6	176.5	-55.4	0	0	0	0	111.2	L411 E412 L413 S418 M419 I475 F510	L411-T415 PolarHBondContact O-N 3.31Å; L411-T415 VanDerWaalsContact O-N 3.09Å; L411-T415 PolarHBondContact O-OG1 3.42Å; E412-T415 WeakPolarHBondContact O-CA 3.23Å; E412-T415 WeakPolarHBondContact O-CB 3.21Å; E412-T415 PolarHBondContact O-N 3.13Å; E412-T415 VanDerWaalsContact O-N 3.07Å; L413-T415 VanDerWaalsContact C-N 3.26Å; L413-T415 PolarHBondContact O-N 3.24Å; T415-S418 PolarHBondContact O-N 3.4Å; T415-M419 HydrophobicContact CG2-CG 4.1Å; T415-M419 WeakPolarHBondContact O-CB 3.39Å; T415-M419 WeakPolarHBondContact O-CG 3.44Å; T415-M419 PolarHBondContact O-N 3.06Å; T415-I475 HydrophobicContact CG2-CG2 4.03Å; T415-F510 HydrophobicContact CG2-CE1 3.98Å; T415-F510 HydrophobicContact CG2-CE2 3.94Å; T415-F510 HydrophobicContact CG2-CZ 3.55Å
416	V	97.1	Very high	94.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.5	-47.2	174.7	-178	0	0	0	0	110.6	E412 L413 S418 C420 F510 I511 L561 T563	E412-V416 WeakPolarHBondContact O-CG2 3.46Å; E412-V416 PolarHBondContact O-N 3.08Å; L413-V416 PolarHBondContact O-N 3.4Å; V416-S418 VanDerWaalsContact C-N 3.27Å; V416-S418 PolarHBondContact O-N 3.28Å; V416-C420 HydrophobicContact CG1-CB 4.3Å; V416-C420 VanDerWaalsContact O-CB 3.25Å; V416-C420 WeakPolarHBondContact O-CB 3.3Å; V416-C420 PolarHBondContact O-N 3.18Å; V416-F510 HydrophobicContact CB-CB 4.49Å; V416-F510 HydrophobicContact CG1-CB 4.24Å; V416-F510 HydrophobicContact CG2-CB 4.28Å; V416-F510 HydrophobicContact CG2-CD1 3.83Å; V416-F510 HydrophobicContact CG2-CG 4.4Å; V416-I511 WeakPolarHBondContact CG1-O 3.43Å; V416-L561 HydrophobicContact CB-CB 4.43Å; V416-L561 HydrophobicContact CG1-CB 4.05Å; V416-L561 HydrophobicContact CG1-CD2 3.8Å; V416-L561 HydrophobicContact CG1-CG 4.41Å; V416-T563 HydrophobicContact CG2-CG2 3.97Å
417	C	97.2	Very high	94.4	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.5	-35	179.5	-73.4	0	0	0	0	113.5	L413 A414 N421 L445 V449 L561	L413-C417 PolarHBondContact O-N 3.1Å; L413-C417 PolarHBondContact O-SG 3.18Å; L413-C417 VanDerWaalsContact O-SG 3.35Å; A414-C417 PolarHBondContact O-N 3.19Å; C417-N421 WeakPolarHBondContact O-CB 3.39Å; C417-N421 PolarHBondContact O-ND2 3.02Å; C417-L445 HydrophobicContact CB-CB 4.1Å; C417-V449 HydrophobicContact CB-CG2 3.58Å; C417-L561 VanDerWaalsContact SG-CD1 3.55Å
418	S	96.6	Very high	94	Very high	1 Å²	1	23 Å²	23	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-84.5	-44	-178.9	-168.6	0	0	0	0	113.3	A414 T415 V416 N421 N472	A414-S418 WeakPolarHBondContact O-CB 3.24Å; A414-S418 PolarHBondContact O-N 3.26Å; T415-S418 PolarHBondContact O-N 3.4Å; V416-S418 VanDerWaalsContact C-N 3.27Å; V416-S418 PolarHBondContact O-N 3.28Å; S418-N421 WeakPolarHBondContact O-CB 3.46Å; S418-N472 VanDerWaalsContact CB-OD1 3.3Å; S418-N472 WeakPolarHBondContact CB-OD1 3.47Å; S418-N472 PolarHBondContact OG-OD1 3.21Å
419	M	95.6	Very high	93.9	Very high	6 Å²	6	26.2 Å²	26.2	3%	0.03	14%	0.138	C	C	.	.	H	α-helix	trans	-81.2	-44.6	-174.6	-65.5	-56.9	-63.9	0	0	112.2	T415 N421 I475 R476 M479 K481 V496 C498 F510	T415-M419 HydrophobicContact CG2-CG 4.1Å; T415-M419 WeakPolarHBondContact O-CB 3.39Å; T415-M419 WeakPolarHBondContact O-CG 3.44Å; T415-M419 PolarHBondContact O-N 3.06Å; M419-N421 PolarHBondContact O-N 3.21Å; M419-I475 HydrophobicContact CG-CG2 4.06Å; M419-I475 HydrophobicContact SD-CG2 4.17Å; M419-R476 HydrophobicContact SD-CG 4.05Å; M419-M479 HydrophobicContact CE-CB 3.85Å; M419-M479 WeakPolarHBondContact CE-O 3.27Å; M419-M479 HydrophobicContact SD-CB 4.29Å; M419-K481 HydrophobicContact CE-CB 3.88Å; M419-V496 HydrophobicContact CB-CG2 4.13Å; M419-V496 WeakPolarHBondContact O-CG2 3.49Å; M419-C498 HydrophobicContact CE-CB 4.47Å; M419-C498 VanDerWaalsContact CE-SG 3.51Å; M419-F510 HydrophobicContact CB-CD2 3.67Å; M419-F510 HydrophobicContact CB-CE2 4.14Å; M419-F510 HydrophobicContact CB-CG 4.49Å; M419-F510 HydrophobicContact CG-CD2 4.11Å; M419-F510 HydrophobicContact CG-CE2 4.06Å
420	C	96.5	Very high	93.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-81.6	56.1	178.3	-167	0	0	0	0	110.2	V416 M494 V496 F510 K512	V416-C420 HydrophobicContact CG1-CB 4.3Å; V416-C420 VanDerWaalsContact O-CB 3.25Å; V416-C420 WeakPolarHBondContact O-CB 3.3Å; V416-C420 PolarHBondContact O-N 3.18Å; C420-M494 PolarHBondContact SG-O 3.04Å; C420-M494 VanDerWaalsContact SG-O 3.4Å; C420-V496 HydrophobicContact CB-CG1 4.47Å; C420-V496 HydrophobicContact CB-CG2 3.88Å; C420-F510 HydrophobicContact CB-CB 4.16Å; C420-K512 VanDerWaalsContact O-CD 3.23Å; C420-K512 WeakPolarHBondContact O-CD 3.4Å; C420-K512 WeakPolarHBondContact O-CE 3.24Å; C420-K512 PolarHBondContact O-NZ 3.07Å
421	N	94.5	Very high	92.5	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.021	20%	0.199	C	C	.	.			trans	-150.6	137.3	-171.3	-160.1	-34.1	0	0	0	110	C417 S418 M419 S423 E442 T446 K481	C417-N421 WeakPolarHBondContact O-CB 3.39Å; C417-N421 PolarHBondContact O-ND2 3.02Å; S418-N421 WeakPolarHBondContact O-CB 3.46Å; M419-N421 PolarHBondContact O-N 3.21Å; N421-S423 WeakPolarHBondContact OD1-CA 3.47Å; N421-S423 WeakPolarHBondContact OD1-CB 3.4Å; N421-S423 PolarHBondContact OD1-N 2.94Å; N421-S423 PolarHBondContact OD1-O 3.46Å; N421-E442 PolarHBondContact ND2-O 3.28Å; N421-E442 WeakPolarHBondContact OD1-CB 3.44Å; N421-E442 PolarHBondContact OD1-OE2 3.24Å; N421-T446 PolarHBondContact ND2-OG1 2.8Å; N421-T446 VanDerWaalsContact ND2-OG1 3.14Å; N421-K481 PolarHBondContact O-NZ 3.3Å; N421-K481 VanDerWaalsContact O-NZ 3.08Å
422	D	90.7	Very high	92.1	Very high	90 Å²	90	36.6 Å²	36.6	48%	0.481	20%	0.202	S	C	.	.			trans	-112.8	-0.6	176.8	-63.6	-34.2	0	0	0	111.9	E442 K481 M494	D422-E442 PolarHBondContact N-OE2 3.17Å; D422-K481 IonicContact OD1-NZ 2.93Å; D422-K481 PolarHBondContact OD1-NZ 3.25Å; D422-M494 WeakPolarHBondContact OD2-CE 3.27Å
423	S	91.5	Very high	91.7	Very high	4 Å²	4	38.8 Å²	38.8	3%	0.028	22%	0.217	C	C	.	.			trans	-103.6	159.1	-179.4	-55.4	0	0	0	0	112.2	N421 V437 E439 E442 T446	N421-S423 WeakPolarHBondContact OD1-CA 3.47Å; N421-S423 WeakPolarHBondContact OD1-CB 3.4Å; N421-S423 PolarHBondContact OD1-N 2.94Å; N421-S423 PolarHBondContact OD1-O 3.46Å; S423-V437 CarbonylContact C-O 3.47Å; S423-V437 VanDerWaalsContact CA-O 3.24Å; S423-V437 WeakPolarHBondContact CA-O 3.47Å; S423-V437 VanDerWaalsContact CB-O 3.24Å; S423-V437 WeakPolarHBondContact CB-O 3.37Å; S423-E439 PolarHBondContact OG-N 2.63Å; S423-E442 VanDerWaalsContact CB-CB 3.49Å; S423-E442 PolarHBondContact N-OE2 2.99Å; S423-E442 WeakPolarHBondContact OG-CB 3.41Å; S423-E442 PolarHBondContact OG-OE2 3.31Å; S423-T446 PolarHBondContact O-OG1 2.77Å
424	S	92.3	Very high	91.4	Very high	45 Å²	45	39.8 Å²	39.8	32%	0.315	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	173.6	177.8	61.1	0	0	0	0	112	V437	S424-V437 PolarHBondContact N-O 3.07Å; S424-V437 PolarHBondContact O-N 3.43Å; S424-V437 WeakPolarHBondContact OG-CB 3.38Å
425	L	93.2	Very high	90.9	Very high	14 Å²	14	42.4 Å²	42.4	7%	0.073	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	140.3	171.9	-151.5	83.3	0	0	0	108.6	Y389 P391 Y434 T443 T446 T447 A468	Y389-L425 WeakPolarHBondContact O-CD1 3.08Å; P391-L425 HydrophobicContact CG-CD2 4.39Å; L425-Y434 HydrophobicContact CD2-CD1 3.41Å; L425-Y434 VanDerWaalsContact CD2-CD1 3.41Å; L425-Y434 HydrophobicContact CD2-CE1 4.07Å; L425-Y434 HydrophobicContact CD2-CG 4.02Å; L425-Y434 HydrophobicContact CG-CD1 4.15Å; L425-T443 HydrophobicContact CD1-CG2 3.61Å; L425-T446 HydrophobicContact CB-CG2 4.39Å; L425-T447 WeakPolarHBondContact CD1-OG1 3.22Å; L425-A468 HydrophobicContact CB-CB 4.2Å; L425-A468 WeakPolarHBondContact CB-O 3.47Å; L425-A468 HydrophobicContact CD2-CB 4.09Å; L425-A468 HydrophobicContact CG-CB 4.49Å
426	D	92.8	Very high	90.6	Very high	72 Å²	72	45.4 Å²	45.4	39%	0.385	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	149.1	171.1	-177.6	46	0	0	0	109.9	Y434 E435 V437	D426-Y434 CarbonylContact O-C 3.07Å; D426-Y434 VanDerWaalsContact O-CA 3.31Å; D426-Y434 WeakPolarHBondContact O-CA 3.4Å; D426-E435 PolarHBondContact N-O 3.44Å; D426-E435 PolarHBondContact O-N 3.02Å; D426-V437 HydrophobicContact CB-CG2 3.73Å
427	Y	91.8	Very high	90.1	Very high	29 Å²	29	48.8 Å²	48.8	11%	0.114	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	108.4	172.8	-178.7	-100.1	0	0	0	109	E429 G432 Y434 K464 V465	Y427-E429 HydrophobicContact CD1-CG 4.08Å; Y427-E429 HydrophobicContact CE1-CG 4.23Å; Y427-E429 PolarHBondContact O-N 3.43Å; Y427-E429 VanDerWaalsContact O-N 3.16Å; Y427-G432 WeakPolarHBondContact OH-CA 3.33Å; Y427-G432 PolarHBondContact OH-O 3.09Å; Y427-Y434 AromaticContact CD2-CD1 3.91Å; Y427-Y434 HydrophobicContact CD2-CD1 3.91Å; Y427-Y434 AromaticContact CD2-CD2 3.91Å; Y427-Y434 HydrophobicContact CD2-CD2 3.91Å; Y427-Y434 AromaticContact CD2-CE1 3.79Å; Y427-Y434 HydrophobicContact CD2-CE1 3.79Å; Y427-Y434 AromaticContact CD2-CE2 3.79Å; Y427-Y434 HydrophobicContact CD2-CE2 3.79Å; Y427-Y434 AromaticContact CD2-CG 3.98Å; Y427-Y434 HydrophobicContact CD2-CG 3.98Å; Y427-Y434 AromaticContact CD2-CZ 3.71Å; Y427-Y434 HydrophobicContact CE2-CD2 4.37Å; Y427-Y434 HydrophobicContact CE2-CE2 4.16Å; Y427-Y434 HydrophobicContact CG-CD1 4.43Å; Y427-Y434 HydrophobicContact CG-CE1 4.19Å; Y427-K464 HydrophobicContact CD1-CB 3.82Å; Y427-K464 HydrophobicContact CD2-CB 3.98Å; Y427-K464 HydrophobicContact CD2-CD 4.33Å; Y427-K464 HydrophobicContact CE1-CB 3.84Å; Y427-K464 HydrophobicContact CE1-CD 3.95Å; Y427-K464 HydrophobicContact CE2-CB 4.01Å; Y427-K464 HydrophobicContact CE2-CD 3.54Å; Y427-K464 HydrophobicContact CE2-CG 4.41Å; Y427-K464 HydrophobicContact CG-CB 3.88Å; Y427-K464 VanDerWaalsContact OH-CD 3.23Å; Y427-K464 WeakPolarHBondContact OH-CD 3.3Å; Y427-K464 PolarHBondContact OH-NZ 3.13Å; Y427-V465 HydrophobicContact CD1-CG2 3.9Å
428	N	86.8	Confident	89.5	Confident	31 Å²	31	51.1 Å²	51.1	17%	0.166	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	103.7	179.5	-171.9	-35.5	0	0	0	109.6	S430 K431 G432 V433 E435	N428-S430 VanDerWaalsContact C-N 3.25Å; N428-S430 PolarHBondContact O-N 3.16Å; N428-S430 WeakPolarHBondContact OD1-CB 3.4Å; N428-S430 PolarHBondContact OD1-N 3.29Å; N428-S430 PolarHBondContact OD1-OG 3.27Å; N428-K431 HydrophobicContact CB-CB 4.41Å; N428-K431 PolarHBondContact O-N 3.23Å; N428-K431 PolarHBondContact OD1-N 3.41Å; N428-G432 WeakPolarHBondContact O-CA 3.39Å; N428-G432 PolarHBondContact O-N 3.29Å; N428-V433 PolarHBondContact N-O 3.24Å; N428-V433 PolarHBondContact O-N 3.29Å; N428-E435 HydrophobicContact CB-CG 4.04Å; N428-E435 WeakPolarHBondContact CB-OE2 3.43Å; N428-E435 PolarHBondContact ND2-OE2 3.17Å
429	E	88.4	Confident	88.8	Confident	157 Å²	157	53 Å²	53	73%	0.734	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-32.4	-178.2	-64.4	-172.9	115.7	0	0	113	Y427 V465	Y427-E429 HydrophobicContact CD1-CG 4.08Å; Y427-E429 HydrophobicContact CE1-CG 4.23Å; Y427-E429 PolarHBondContact O-N 3.43Å; Y427-E429 VanDerWaalsContact O-N 3.16Å; E429-V465 HydrophobicContact CG-CG2 4.17Å
430	S	82	Confident	88.3	Confident	110 Å²	110	53 Å²	53	77%	0.769	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-37.9	-179.3	71.6	0	0	0	0	112.8	N428	N428-S430 VanDerWaalsContact C-N 3.25Å; N428-S430 PolarHBondContact O-N 3.16Å; N428-S430 WeakPolarHBondContact OD1-CB 3.4Å; N428-S430 PolarHBondContact OD1-N 3.29Å; N428-S430 PolarHBondContact OD1-OG 3.27Å
431	K	75.9	Confident	87.9	Confident	134 Å²	134	53.4 Å²	53.4	58%	0.583	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-15.4	178.3	-64.6	-177.7	-174.9	173.2	0	113.2	N428 V433 E435	N428-K431 HydrophobicContact CB-CB 4.41Å; N428-K431 PolarHBondContact O-N 3.23Å; N428-K431 PolarHBondContact OD1-N 3.41Å; K431-V433 VanDerWaalsContact C-N 3.3Å; K431-V433 HydrophobicContact CB-CG2 3.79Å; K431-V433 HydrophobicContact CD-CG2 4.5Å; K431-V433 PolarHBondContact O-N 2.87Å; K431-E435 VanDerWaalsContact CD-OE1 3.27Å; K431-E435 WeakPolarHBondContact CD-OE1 3.48Å; K431-E435 WeakPolarHBondContact CE-OE1 3.49Å; K431-E435 IonicContact NZ-OE1 2.7Å; K431-E435 PolarHBondContact NZ-OE1 3.15Å
432	G	86.5	Confident	87.9	Confident	34 Å²	34	53.8 Å²	53.8	35%	0.351	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	22.8	-177.5	0	0	0	0	0	114.6	Y427 N428	Y427-G432 WeakPolarHBondContact OH-CA 3.33Å; Y427-G432 PolarHBondContact OH-O 3.09Å; N428-G432 WeakPolarHBondContact O-CA 3.39Å; N428-G432 PolarHBondContact O-N 3.29Å
433	V	86.9	Confident	88	Confident	70 Å²	70	49.5 Å²	49.5	42%	0.424	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	154.4	-175.4	-62.2	0	0	0	0	112.3	N428 K431 E435	N428-V433 PolarHBondContact N-O 3.24Å; N428-V433 PolarHBondContact O-N 3.29Å; K431-V433 VanDerWaalsContact C-N 3.3Å; K431-V433 HydrophobicContact CB-CG2 3.79Å; K431-V433 HydrophobicContact CD-CG2 4.5Å; K431-V433 PolarHBondContact O-N 2.87Å; V433-E435 HydrophobicContact CG2-CG 4.17Å
434	Y	90.4	Very high	88.2	Confident	20 Å²	20	49.4 Å²	49.4	8%	0.078	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	123.1	171.1	-70	-84.6	0	0	0	110.3	A390 P391 L425 D426 Y427 K464 A468	A390-Y434 HydrophobicContact CB-CD2 3.64Å; A390-Y434 HydrophobicContact CB-CE2 4.25Å; A390-Y434 HydrophobicContact CB-CG 4.38Å; P391-Y434 HydrophobicContact CG-CE1 4.13Å; P391-Y434 HydrophobicContact CG-CE2 4.35Å; L425-Y434 HydrophobicContact CD2-CD1 3.41Å; L425-Y434 VanDerWaalsContact CD2-CD1 3.41Å; L425-Y434 HydrophobicContact CD2-CE1 4.07Å; L425-Y434 HydrophobicContact CD2-CG 4.02Å; L425-Y434 HydrophobicContact CG-CD1 4.15Å; D426-Y434 CarbonylContact O-C 3.07Å; D426-Y434 VanDerWaalsContact O-CA 3.31Å; D426-Y434 WeakPolarHBondContact O-CA 3.4Å; Y427-Y434 AromaticContact CD2-CD1 3.91Å; Y427-Y434 HydrophobicContact CD2-CD1 3.91Å; Y427-Y434 AromaticContact CD2-CD2 3.91Å; Y427-Y434 HydrophobicContact CD2-CD2 3.91Å; Y427-Y434 AromaticContact CD2-CE1 3.79Å; Y427-Y434 HydrophobicContact CD2-CE1 3.79Å; Y427-Y434 AromaticContact CD2-CE2 3.79Å; Y427-Y434 HydrophobicContact CD2-CE2 3.79Å; Y427-Y434 AromaticContact CD2-CG 3.98Å; Y427-Y434 HydrophobicContact CD2-CG 3.98Å; Y427-Y434 AromaticContact CD2-CZ 3.71Å; Y427-Y434 HydrophobicContact CE2-CD2 4.37Å; Y427-Y434 HydrophobicContact CE2-CE2 4.16Å; Y427-Y434 HydrophobicContact CG-CD1 4.43Å; Y427-Y434 HydrophobicContact CG-CE1 4.19Å; Y434-K464 VanDerWaalsContact CE1-O 3.29Å; Y434-K464 WeakPolarHBondContact CE1-O 3.45Å; Y434-K464 WeakPolarHBondContact OH-CA 3.49Å; Y434-K464 PolarHBondContact OH-O 3.13Å; Y434-A468 HydrophobicContact CD1-CB 4.21Å; Y434-A468 HydrophobicContact CE1-CB 3.93Å
435	E	86.4	Confident	88.4	Confident	56 Å²	56	47.2 Å²	47.2	26%	0.262	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	154.4	179.5	-65.2	-169.3	138.2	0	0	111.1	D426 N428 K431 V433	D426-E435 PolarHBondContact N-O 3.44Å; D426-E435 PolarHBondContact O-N 3.02Å; N428-E435 HydrophobicContact CB-CG 4.04Å; N428-E435 WeakPolarHBondContact CB-OE2 3.43Å; N428-E435 PolarHBondContact ND2-OE2 3.17Å; K431-E435 VanDerWaalsContact CD-OE1 3.27Å; K431-E435 WeakPolarHBondContact CD-OE1 3.48Å; K431-E435 WeakPolarHBondContact CE-OE1 3.49Å; K431-E435 IonicContact NZ-OE1 2.7Å; K431-E435 PolarHBondContact NZ-OE1 3.15Å; V433-E435 HydrophobicContact CG2-CG 4.17Å
436	K	89.3	Confident	88.6	Confident	77 Å²	77	46.7 Å²	46.7	34%	0.335	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	141.9	173.4	61.7	165.4	-173.5	145.7	0	110.4	Y389 A440 T443	Y389-K436 HydrophobicContact CD2-CB 4.28Å; Y389-K436 HydrophobicContact CE2-CB 3.99Å; Y389-K436 HydrophobicContact CE2-CD 4.28Å; Y389-K436 HydrophobicContact CE2-CG 4.15Å; K436-A440 HydrophobicContact CD-CB 4.3Å; K436-T443 HydrophobicContact CB-CG2 3.72Å; K436-T443 WeakPolarHBondContact CB-OG1 3.1Å
437	V	87.1	Confident	88.8	Confident	70 Å²	70	43.4 Å²	43.4	42%	0.424	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	109.1	163.8	-179.3	0	0	0	0	107.1	S423 S424 D426	S423-V437 CarbonylContact C-O 3.47Å; S423-V437 VanDerWaalsContact CA-O 3.24Å; S423-V437 WeakPolarHBondContact CA-O 3.47Å; S423-V437 VanDerWaalsContact CB-O 3.24Å; S423-V437 WeakPolarHBondContact CB-O 3.37Å; S424-V437 PolarHBondContact N-O 3.07Å; S424-V437 PolarHBondContact O-N 3.43Å; S424-V437 WeakPolarHBondContact OG-CB 3.38Å; D426-V437 HydrophobicContact CB-CG2 3.73Å
438	G	85.3	Confident	89.1	Confident	49 Å²	49	42.1 Å²	42.1	51%	0.505	24%	0.24	S	C	.	.	S	Bend	trans	104.6	-146.7	-173.3	0	0	0	0	0	113.6
439	E	80.9	Confident	89.6	Confident	41 Å²	41	40.7 Å²	40.7	19%	0.192	23%	0.233	C	C	.	.			trans	-85.1	137.8	-173.8	-63.9	-157	148.6	0	0	112.4	R174 S186 S423 T441 E442 T443	R174-E439 IonicContact CZ-OE1 3.46Å; R174-E439 IonicContact NH1-OE1 3.21Å; R174-E439 PolarHBondContact NH1-OE1 2.99Å; R174-E439 IonicContact NH1-OE2 3Å; R174-E439 PolarHBondContact NH1-OE2 3.29Å; R174-E439 VanDerWaalsContact NH1-OE2 3.12Å; S186-E439 PolarHBondContact OG-OE1 3.37Å; S423-E439 PolarHBondContact OG-N 2.63Å; E439-T441 VanDerWaalsContact C-N 3.27Å; E439-T441 PolarHBondContact O-N 2.96Å; E439-E442 HydrophobicContact CB-CB 4.35Å; E439-E442 HydrophobicContact CB-CG 4.23Å; E439-E442 PolarHBondContact O-N 2.64Å; E439-T443 PolarHBondContact O-N 3.45Å; E439-T443 PolarHBondContact O-OG1 3.07Å
440	A	85.4	Confident	90	Very high	7 Å²	7	33.3 Å²	33.3	6%	0.058	20%	0.198	C	C	.	.	H	α-helix	trans	-53.5	-43.4	179.4	0	0	0	0	0	112.8	M361 Y389 K436 E442 A444	M361-A440 HydrophobicContact CB-CB 4Å; Y389-A440 VanDerWaalsContact OH-CB 3.23Å; Y389-A440 WeakPolarHBondContact OH-CB 3.26Å; K436-A440 HydrophobicContact CD-CB 4.3Å; A440-E442 VanDerWaalsContact C-N 3.28Å; A440-E442 PolarHBondContact O-N 3.01Å; A440-A444 WeakPolarHBondContact O-CB 3.4Å; A440-A444 PolarHBondContact O-N 3.37Å
441	T	88.8	Confident	90.6	Very high	8 Å²	8	28.9 Å²	28.9	5%	0.049	17%	0.165	C	C	.	.	H	α-helix	trans	-58.4	-40.7	177.6	-51.7	0	0	0	0	111.9	E439 L559 M596	E439-T441 VanDerWaalsContact C-N 3.27Å; E439-T441 PolarHBondContact O-N 2.96Å; T441-L559 HydrophobicContact CG2-CD1 3.82Å; T441-M596 HydrophobicContact CG2-CE 4.06Å; T441-M596 HydrophobicContact CG2-SD 3.61Å
442	E	92.9	Very high	91.6	Very high	11 Å²	11	22.7 Å²	22.7	5%	0.051	14%	0.138	C	C	.	.	H	α-helix	trans	-82.5	-39.3	-176.1	-68.9	-158.7	157.4	0	0	112.2	N421 D422 S423 E439 A440 A444 L445 T446 M494 K512	N421-E442 PolarHBondContact ND2-O 3.28Å; N421-E442 WeakPolarHBondContact OD1-CB 3.44Å; N421-E442 PolarHBondContact OD1-OE2 3.24Å; D422-E442 PolarHBondContact N-OE2 3.17Å; S423-E442 VanDerWaalsContact CB-CB 3.49Å; S423-E442 PolarHBondContact N-OE2 2.99Å; S423-E442 WeakPolarHBondContact OG-CB 3.41Å; S423-E442 PolarHBondContact OG-OE2 3.31Å; E439-E442 HydrophobicContact CB-CB 4.35Å; E439-E442 HydrophobicContact CB-CG 4.23Å; E439-E442 PolarHBondContact O-N 2.64Å; A440-E442 VanDerWaalsContact C-N 3.28Å; A440-E442 PolarHBondContact O-N 3.01Å; E442-A444 PolarHBondContact O-N 2.95Å; E442-L445 WeakPolarHBondContact O-CA 3.47Å; E442-L445 WeakPolarHBondContact O-CB 3.5Å; E442-L445 PolarHBondContact O-N 3.1Å; E442-T446 PolarHBondContact O-N 3.22Å; E442-T446 PolarHBondContact O-OG1 3.16Å; E442-M494 WeakPolarHBondContact OE1-CE 3.43Å; E442-K512 WeakPolarHBondContact OE1-CE 3.19Å; E442-K512 IonicContact OE1-NZ 3.44Å; E442-K512 PolarHBondContact OE1-NZ 2.85Å
443	T	94.5	Very high	92	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.7	-36.5	171.8	-55.4	0	0	0	0	111.2	Y389 L425 K436 E439 L445 T446 T447	Y389-T443 HydrophobicContact CD1-CG2 3.64Å; Y389-T443 HydrophobicContact CE1-CG2 3.92Å; Y389-T443 HydrophobicContact CG-CG2 4.18Å; L425-T443 HydrophobicContact CD1-CG2 3.61Å; K436-T443 HydrophobicContact CB-CG2 3.72Å; K436-T443 WeakPolarHBondContact CB-OG1 3.1Å; E439-T443 PolarHBondContact O-N 3.45Å; E439-T443 PolarHBondContact O-OG1 3.07Å; T443-L445 PolarHBondContact O-N 3.47Å; T443-T446 WeakPolarHBondContact O-CA 3.36Å; T443-T446 WeakPolarHBondContact O-CB 3.42Å; T443-T446 PolarHBondContact O-N 3.22Å; T443-T447 PolarHBondContact O-N 2.92Å; T443-T447 PolarHBondContact O-OG1 3.32Å
444	A	95	Very high	92.4	Very high	2 Å²	2	19.2 Å²	19.2	2%	0.017	11%	0.109	C	C	.	.	H	α-helix	trans	-57.6	-36.7	173	0	0	0	0	0	112.6	M361 V363 A440 E442 L448 M596	M361-A444 HydrophobicContact CB-CB 4.15Å; M361-A444 HydrophobicContact CG-CB 3.94Å; M361-A444 WeakPolarHBondContact O-CB 3.34Å; V363-A444 HydrophobicContact CG2-CB 4.24Å; A440-A444 WeakPolarHBondContact O-CB 3.4Å; A440-A444 PolarHBondContact O-N 3.37Å; E442-A444 PolarHBondContact O-N 2.95Å; A444-L448 WeakPolarHBondContact O-CB 3.23Å; A444-L448 PolarHBondContact O-N 2.83Å; A444-M596 HydrophobicContact CB-SD 4.26Å
445	L	97.1	Very high	92.5	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-70.9	-39.8	174.4	-56	177.9	0	0	0	111.4	V363 C417 E442 T443 L448 V449 K512 L559 V594 M596	V363-L445 HydrophobicContact CG2-CD2 4.26Å; C417-L445 HydrophobicContact CB-CB 4.1Å; E442-L445 WeakPolarHBondContact O-CA 3.47Å; E442-L445 WeakPolarHBondContact O-CB 3.5Å; E442-L445 PolarHBondContact O-N 3.1Å; T443-L445 PolarHBondContact O-N 3.47Å; L445-L448 WeakPolarHBondContact O-CB 3.13Å; L445-L448 PolarHBondContact O-N 3.09Å; L445-V449 WeakPolarHBondContact O-CG2 3.47Å; L445-V449 PolarHBondContact O-N 2.96Å; L445-K512 HydrophobicContact CD1-CD 3.96Å; L445-L559 HydrophobicContact CD1-CD1 4.34Å; L445-V594 HydrophobicContact CD2-CG2 3.78Å; L445-M596 HydrophobicContact CD2-CE 3.79Å; L445-M596 HydrophobicContact CG-CE 4.41Å
446	T	96.8	Very high	92.8	Very high	3 Å²	3	25 Å²	25	2%	0.018	13%	0.134	C	C	.	.	H	α-helix	trans	-59.5	-49.2	174.5	-55	0	0	0	0	110.5	N421 S423 L425 E442 T443 L448 V449 E450 N472	N421-T446 PolarHBondContact ND2-OG1 2.8Å; N421-T446 VanDerWaalsContact ND2-OG1 3.14Å; S423-T446 PolarHBondContact O-OG1 2.77Å; L425-T446 HydrophobicContact CB-CG2 4.39Å; E442-T446 PolarHBondContact O-N 3.22Å; E442-T446 PolarHBondContact O-OG1 3.16Å; T443-T446 WeakPolarHBondContact O-CA 3.36Å; T443-T446 WeakPolarHBondContact O-CB 3.42Å; T443-T446 PolarHBondContact O-N 3.22Å; T446-L448 VanDerWaalsContact C-N 3.34Å; T446-L448 PolarHBondContact O-N 2.62Å; T446-V449 PolarHBondContact O-N 2.92Å; T446-E450 PolarHBondContact O-N 2.92Å; T446-E450 VanDerWaalsContact O-N 3.16Å; T446-N472 WeakPolarHBondContact CG2-ND2 3.32Å; T446-N472 PolarHBondContact O-ND2 2.82Å
447	T	96.8	Very high	92.9	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-61	-40.3	175	-59.1	0	0	0	0	111.8	Y389 L425 T443 V449 E450 K451	Y389-T447 VanDerWaalsContact O-CG2 3.29Å; Y389-T447 WeakPolarHBondContact O-CG2 3.47Å; Y389-T447 PolarHBondContact O-OG1 2.95Å; L425-T447 WeakPolarHBondContact CD1-OG1 3.22Å; T443-T447 PolarHBondContact O-N 2.92Å; T443-T447 PolarHBondContact O-OG1 3.32Å; T447-V449 VanDerWaalsContact C-N 3.33Å; T447-V449 PolarHBondContact O-N 3.35Å; T447-E450 PolarHBondContact O-N 3.35Å; T447-K451 HydrophobicContact CG2-CD 4.23Å; T447-K451 WeakPolarHBondContact O-CG 3.24Å; T447-K451 PolarHBondContact O-N 3.43Å
448	L	97.4	Very high	93.2	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-58.2	-46	175.5	174	65.6	0	0	0	111.1	V363 M366 I384 I395 L413 A444 L445 T446 E450 K451 M452 V594	V363-L448 HydrophobicContact CB-CB 4.27Å; V363-L448 HydrophobicContact CB-CD1 4.25Å; V363-L448 HydrophobicContact CB-CD2 4.25Å; V363-L448 HydrophobicContact CB-CG 4.46Å; V363-L448 HydrophobicContact CG1-CD1 4.2Å; V363-L448 HydrophobicContact CG1-CD2 3.96Å; V363-L448 HydrophobicContact CG2-CB 4.04Å; V363-L448 HydrophobicContact CG2-CD2 4.09Å; M366-L448 HydrophobicContact SD-CD1 4.25Å; M366-L448 HydrophobicContact SD-CD2 4.42Å; I384-L448 HydrophobicContact CD1-CD1 4.42Å; I384-L448 HydrophobicContact CG1-CD1 3.92Å; I384-L448 HydrophobicContact CG2-CD1 4.44Å; I395-L448 HydrophobicContact CD1-CD1 4.29Å; L413-L448 HydrophobicContact CD2-CD2 4.3Å; A444-L448 WeakPolarHBondContact O-CB 3.23Å; A444-L448 PolarHBondContact O-N 2.83Å; L445-L448 WeakPolarHBondContact O-CB 3.13Å; L445-L448 PolarHBondContact O-N 3.09Å; T446-L448 VanDerWaalsContact C-N 3.34Å; T446-L448 PolarHBondContact O-N 2.62Å; L448-E450 VanDerWaalsContact C-N 3.31Å; L448-E450 PolarHBondContact O-N 2.9Å; L448-K451 PolarHBondContact O-N 2.98Å; L448-K451 VanDerWaalsContact O-N 3.13Å; L448-M452 HydrophobicContact CD1-CG 3.96Å; L448-M452 HydrophobicContact CD1-SD 3.98Å; L448-M452 HydrophobicContact CD2-SD 4.12Å; L448-M452 HydrophobicContact CG-CG 4.19Å; L448-M452 HydrophobicContact CG-SD 3.71Å; L448-M452 VanDerWaalsContact O-CG 3.25Å; L448-M452 WeakPolarHBondContact O-CG 3.47Å; L448-M452 PolarHBondContact O-N 3.39Å; L448-V594 HydrophobicContact CD2-CG1 3.85Å
449	V	97.4	Very high	93.4	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.012	13%	0.126	C	C	.	.	H	α-helix	trans	-60.2	-42.3	178.2	171	0	0	0	0	111.2	A414 C417 L445 T446 T447 K451 M452 N453 C471 I475	A414-V449 HydrophobicContact CB-CG2 4.41Å; A414-V449 WeakPolarHBondContact O-CG2 3.1Å; C417-V449 HydrophobicContact CB-CG2 3.58Å; L445-V449 WeakPolarHBondContact O-CG2 3.47Å; L445-V449 PolarHBondContact O-N 2.96Å; T446-V449 PolarHBondContact O-N 2.92Å; T447-V449 VanDerWaalsContact C-N 3.33Å; T447-V449 PolarHBondContact O-N 3.35Å; V449-K451 VanDerWaalsContact C-N 3.31Å; V449-K451 PolarHBondContact O-N 3.11Å; V449-M452 PolarHBondContact O-N 3.49Å; V449-N453 PolarHBondContact O-N 2.81Å; V449-C471 HydrophobicContact CG1-CB 4.23Å; V449-I475 HydrophobicContact CG1-CD1 3.65Å
450	E	96.6	Very high	93.7	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-64	-34.1	175.9	-64.2	-54.4	143.5	0	0	113.1	P391 T446 T447 L448 R467 G469 A470 C471 N472	P391-E450 HydrophobicContact CB-CB 3.58Å; P391-E450 HydrophobicContact CB-CG 4.23Å; T446-E450 PolarHBondContact O-N 2.92Å; T446-E450 VanDerWaalsContact O-N 3.16Å; T447-E450 PolarHBondContact O-N 3.35Å; L448-E450 VanDerWaalsContact C-N 3.31Å; L448-E450 PolarHBondContact O-N 2.9Å; E450-R467 PolarHBondContact O-NH2 2.93Å; E450-R467 IonicContact OE2-CZ 3.84Å; E450-R467 IonicContact OE2-NH1 3.64Å; E450-R467 PolarHBondContact OE2-NH1 3.15Å; E450-G469 WeakPolarHBondContact OE1-CA 3.3Å; E450-A470 PolarHBondContact OE1-N 3.06Å; E450-A470 PolarHBondContact OE2-N 3.29Å; E450-C471 PolarHBondContact OE1-N 3.02Å; E450-C471 VanDerWaalsContact OE1-N 3.13Å; E450-C471 VanDerWaalsContact OE2-CB 3.29Å; E450-C471 WeakPolarHBondContact OE2-CB 3.49Å; E450-C471 PolarHBondContact OE2-N 3.19Å; E450-C471 PolarHBondContact OE2-SG 3.21Å; E450-N472 WeakPolarHBondContact OE1-CB 3.29Å; E450-N472 PolarHBondContact OE1-N 2.83Å; E450-N472 PolarHBondContact OE1-ND2 2.97Å
451	K	95.7	Very high	93.7	Very high	18 Å²	18	31.2 Å²	31.2	8%	0.078	19%	0.186	C	C	.	.	H	α-helix	trans	-75.2	-34.2	175.3	-70.1	175.7	179.9	-179	0	112.6	I384 T385 G386 E392 I395 T447 L448 V449	I384-K451 HydrophobicContact CG2-CD 3.86Å; T385-K451 PolarHBondContact O-NZ 3.22Å; G386-K451 PolarHBondContact O-NZ 3.06Å; G386-K451 VanDerWaalsContact O-NZ 3.08Å; E392-K451 VanDerWaalsContact O-CE 3.3Å; E392-K451 WeakPolarHBondContact O-CE 3.36Å; I395-K451 HydrophobicContact CD1-CB 4.35Å; T447-K451 HydrophobicContact CG2-CD 4.23Å; T447-K451 WeakPolarHBondContact O-CG 3.24Å; T447-K451 PolarHBondContact O-N 3.43Å; L448-K451 PolarHBondContact O-N 2.98Å; L448-K451 VanDerWaalsContact O-N 3.13Å; V449-K451 VanDerWaalsContact C-N 3.31Å; V449-K451 PolarHBondContact O-N 3.11Å
452	M	96	Very high	93.9	Very high	3 Å²	3	34 Å²	34	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-71.6	-37.3	-178.2	-72.1	173	74.5	0	0	112.6	M366 I395 C404 L410 L413 A414 L448 V449 V454	M366-M452 HydrophobicContact CE-CE 4.13Å; M366-M452 HydrophobicContact CE-CG 4.37Å; M366-M452 HydrophobicContact CE-SD 4.38Å; M366-M452 HydrophobicContact SD-CE 4.21Å; M366-M452 HydrophobicContact SD-SD 4.16Å; I395-M452 HydrophobicContact CD1-CG 4.16Å; I395-M452 HydrophobicContact CG1-CG 4.28Å; C404-M452 HydrophobicContact CB-CB 4.21Å; C404-M452 HydrophobicContact CB-CE 4.47Å; C404-M452 WeakPolarHBondContact CB-O 3.23Å; L410-M452 HydrophobicContact CB-CE 3.76Å; L410-M452 HydrophobicContact CD2-CE 4.13Å; L410-M452 HydrophobicContact CG-CE 4.38Å; L410-M452 WeakPolarHBondContact O-CE 3.28Å; L413-M452 HydrophobicContact CD2-CE 4.15Å; L413-M452 HydrophobicContact CD2-SD 4.22Å; A414-M452 HydrophobicContact CB-CE 3.87Å; A414-M452 HydrophobicContact CB-SD 4.06Å; L448-M452 HydrophobicContact CD1-CG 3.96Å; L448-M452 HydrophobicContact CD1-SD 3.98Å; L448-M452 HydrophobicContact CD2-SD 4.12Å; L448-M452 HydrophobicContact CG-CG 4.19Å; L448-M452 HydrophobicContact CG-SD 3.71Å; L448-M452 VanDerWaalsContact O-CG 3.25Å; L448-M452 WeakPolarHBondContact O-CG 3.47Å; L448-M452 PolarHBondContact O-N 3.39Å; V449-M452 PolarHBondContact O-N 3.49Å; M452-V454 VanDerWaalsContact C-N 3.28Å; M452-V454 HydrophobicContact CB-CG1 3.88Å; M452-V454 HydrophobicContact CE-CG1 3.85Å; M452-V454 PolarHBondContact O-N 3.2Å
453	N	95.6	Very high	93.9	Very high	23 Å²	23	37.2 Å²	37.2	12%	0.123	22%	0.22	C	C	.	.			trans	39.4	55.4	-177.3	-170.1	9.9	0	0	0	112.9	V449 F455 K456 T457	V449-N453 PolarHBondContact O-N 2.81Å; N453-F455 PolarHBondContact O-N 3.16Å; N453-F455 VanDerWaalsContact O-N 3.11Å; N453-K456 PolarHBondContact O-N 2.82Å; N453-K456 PolarHBondContact OD1-N 3.21Å; N453-T457 PolarHBondContact ND2-O 2.78Å; N453-T457 WeakPolarHBondContact OD1-CB 3.48Å; N453-T457 PolarHBondContact OD1-N 3Å
454	V	94.8	Very high	93.8	Very high	9 Å²	9	42.6 Å²	42.6	6%	0.055	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-23.5	-170.2	-62.9	0	0	0	0	113.5	C404 G405 L411 A414 M452	C404-V454 HydrophobicContact CB-CG1 3.94Å; G405-V454 WeakPolarHBondContact CA-O 3.49Å; L411-V454 HydrophobicContact CG-CG2 4.31Å; A414-V454 HydrophobicContact CB-CG1 3.69Å; A414-V454 HydrophobicContact CB-CG2 3.97Å; M452-V454 VanDerWaalsContact C-N 3.28Å; M452-V454 HydrophobicContact CB-CG1 3.88Å; M452-V454 HydrophobicContact CE-CG1 3.85Å; M452-V454 PolarHBondContact O-N 3.2Å
455	F	93.6	Very high	93.6	Very high	77 Å²	77	45.6 Å²	45.6	34%	0.338	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	5.9	178.2	-70.6	-71.8	0	0	0	114.3	L411 N453 T457 V474 I475 L478	L411-F455 HydrophobicContact CD1-CD1 4.41Å; L411-F455 HydrophobicContact CD1-CE1 3.79Å; L411-F455 HydrophobicContact CD1-CZ 3.89Å; L411-F455 HydrophobicContact CD2-CZ 4.14Å; L411-F455 HydrophobicContact CG-CE1 4.45Å; L411-F455 HydrophobicContact CG-CZ 4.04Å; N453-F455 PolarHBondContact O-N 3.16Å; N453-F455 VanDerWaalsContact O-N 3.11Å; F455-T457 PolarHBondContact O-N 3.3Å; F455-V474 HydrophobicContact CB-CG1 4.23Å; F455-V474 HydrophobicContact CD2-CG1 4.02Å; F455-V474 HydrophobicContact CG-CG1 4.21Å; F455-I475 HydrophobicContact CD2-CG1 4.26Å; F455-I475 HydrophobicContact CE2-CG1 3.93Å; F455-L478 HydrophobicContact CE1-CD1 3.92Å; F455-L478 HydrophobicContact CE2-CD1 3.66Å; F455-L478 HydrophobicContact CZ-CD1 3.3Å
456	K	92.6	Very high	93.4	Very high	119 Å²	119	50.8 Å²	50.8	52%	0.517	29%	0.286	S	S	.	.			trans	54.4	37.2	-179.2	-49.9	-176.6	-175.5	-174.7	0	111.6	Q403 D406 N453 D458	Q403-K456 HydrophobicContact CG-CD 4.38Å; Q403-K456 HydrophobicContact CG-CG 4.45Å; D406-K456 IonicContact OD1-NZ 3.1Å; D406-K456 PolarHBondContact OD1-NZ 2.88Å; N453-K456 PolarHBondContact O-N 2.82Å; N453-K456 PolarHBondContact OD1-N 3.21Å; K456-D458 PolarHBondContact O-N 2.78Å
457	T	91.9	Very high	93.2	Very high	38 Å²	38	52.2 Å²	52.2	23%	0.233	29%	0.291	C	S	.	.			trans	-58.7	136.4	177.1	-53.7	0	0	0	0	108.9	N453 F455 L459 V474	N453-T457 PolarHBondContact ND2-O 2.78Å; N453-T457 WeakPolarHBondContact OD1-CB 3.48Å; N453-T457 PolarHBondContact OD1-N 3Å; F455-T457 PolarHBondContact O-N 3.3Å; T457-L459 HydrophobicContact CG2-CD2 4.48Å; T457-L459 PolarHBondContact O-N 2.93Å; T457-V474 HydrophobicContact CG2-CG2 4.12Å
458	D	91.7	Very high	93	Very high	118 Å²	118	52.3 Å²	52.3	63%	0.631	29%	0.292	S	S	*	.			trans	-70.3	117.1	172.9	-171.3	4.2	0	0	0	109	K456 S460	K456-D458 PolarHBondContact O-N 2.78Å; D458-S460 VanDerWaalsContact OD1-CB 3.31Å; D458-S460 WeakPolarHBondContact OD1-CB 3.16Å; D458-S460 PolarHBondContact OD1-N 3.15Å; D458-S460 PolarHBondContact OD1-OG 3.19Å; D458-S460 PolarHBondContact OD2-OG 3.3Å
459	L	90.9	Very high	92.7	Very high	44 Å²	44	53.4 Å²	53.4	23%	0.23	30%	0.303	C	S	.	.			trans	-103.7	-3.9	-179.8	-59.1	171.1	0	0	0	111.2	T457 L462 A470	T457-L459 HydrophobicContact CG2-CD2 4.48Å; T457-L459 PolarHBondContact O-N 2.93Å; L459-L462 HydrophobicContact CD2-CD1 4.02Å; L459-A470 HydrophobicContact CD2-CB 3.82Å
460	S	86.9	Confident	92.5	Very high	90 Å²	90	54 Å²	54	63%	0.629	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	134.8	179.8	71.2	0	0	0	0	110.2	D458 L462	D458-S460 VanDerWaalsContact OD1-CB 3.31Å; D458-S460 WeakPolarHBondContact OD1-CB 3.16Å; D458-S460 PolarHBondContact OD1-N 3.15Å; D458-S460 PolarHBondContact OD1-OG 3.19Å; D458-S460 PolarHBondContact OD2-OG 3.3Å; S460-L462 VanDerWaalsContact C-N 3.32Å; S460-L462 PolarHBondContact O-N 3.31Å
461	G	85.9	Confident	92.5	Very high	85 Å²	85	54.3 Å²	54.3	88%	0.876	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-4.2	-179.9	0	0	0	0	0	116.1
462	L	92.6	Very high	92.4	Very high	68 Å²	68	53.5 Å²	53.5	36%	0.356	31%	0.308	S	S	.	.			trans	-70.3	140.9	171.7	-64.2	-179.3	0	0	0	111.1	L459 S460 E466 A470	L459-L462 HydrophobicContact CD2-CD1 4.02Å; S460-L462 VanDerWaalsContact C-N 3.32Å; S460-L462 PolarHBondContact O-N 3.31Å; L462-E466 HydrophobicContact CB-CB 4.32Å; L462-E466 HydrophobicContact CD2-CB 4.32Å; L462-A470 HydrophobicContact CD1-CB 3.79Å
463	T	92.9	Very high	92.3	Very high	77 Å²	77	55.9 Å²	55.9	47%	0.472	33%	0.325	S	S	.	.			trans	-67.8	161.9	169.1	63	0	0	0	0	110.7	V465 E466 R467	T463-V465 PolarHBondContact O-N 3.39Å; T463-E466 WeakPolarHBondContact CB-OE2 3.46Å; T463-E466 WeakPolarHBondContact CG2-OE2 3.4Å; T463-E466 PolarHBondContact N-OE2 3.2Å; T463-E466 PolarHBondContact O-N 3.1Å; T463-E466 VanDerWaalsContact OG1-CG 3.24Å; T463-E466 WeakPolarHBondContact OG1-CG 3.23Å; T463-E466 PolarHBondContact OG1-N 3.37Å; T463-E466 PolarHBondContact OG1-OE2 3.01Å; T463-R467 VanDerWaalsContact O-CB 3.3Å; T463-R467 WeakPolarHBondContact O-CB 3.24Å; T463-R467 PolarHBondContact O-N 3.2Å
464	K	92.3	Very high	92.3	Very high	114 Å²	114	56.5 Å²	56.5	50%	0.496	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-34.1	178.8	-70.7	-172.2	178.7	-174	0	112.9	Y427 Y434 A468	Y427-K464 HydrophobicContact CD1-CB 3.82Å; Y427-K464 HydrophobicContact CD2-CB 3.98Å; Y427-K464 HydrophobicContact CD2-CD 4.33Å; Y427-K464 HydrophobicContact CE1-CB 3.84Å; Y427-K464 HydrophobicContact CE1-CD 3.95Å; Y427-K464 HydrophobicContact CE2-CB 4.01Å; Y427-K464 HydrophobicContact CE2-CD 3.54Å; Y427-K464 HydrophobicContact CE2-CG 4.41Å; Y427-K464 HydrophobicContact CG-CB 3.88Å; Y427-K464 VanDerWaalsContact OH-CD 3.23Å; Y427-K464 WeakPolarHBondContact OH-CD 3.3Å; Y427-K464 PolarHBondContact OH-NZ 3.13Å; Y434-K464 VanDerWaalsContact CE1-O 3.29Å; Y434-K464 WeakPolarHBondContact CE1-O 3.45Å; Y434-K464 WeakPolarHBondContact OH-CA 3.49Å; Y434-K464 PolarHBondContact OH-O 3.13Å; K464-A468 PolarHBondContact O-N 2.62Å
465	V	91.1	Very high	92.2	Very high	64 Å²	64	56.1 Å²	56.1	39%	0.388	33%	0.327	S	S	.	.	H	α-helix	trans	-66.9	-50.4	176.2	-179.5	0	0	0	0	110.6	Y427 E429 T463 R467 A468	Y427-V465 HydrophobicContact CD1-CG2 3.9Å; E429-V465 HydrophobicContact CG-CG2 4.17Å; T463-V465 PolarHBondContact O-N 3.39Å; V465-R467 VanDerWaalsContact C-N 3.28Å; V465-R467 PolarHBondContact O-N 3.02Å; V465-A468 VanDerWaalsContact O-CB 3.25Å; V465-A468 WeakPolarHBondContact O-CB 3.39Å; V465-A468 PolarHBondContact O-N 2.98Å
466	E	91.7	Very high	92.1	Very high	109 Å²	109	57.8 Å²	57.8	51%	0.509	33%	0.331	S	S	.	.	H	α-helix	trans	-64	-35.3	178	-68.7	163.6	149.1	0	0	112.2	L462 T463 A468	L462-E466 HydrophobicContact CB-CB 4.32Å; L462-E466 HydrophobicContact CD2-CB 4.32Å; T463-E466 WeakPolarHBondContact CB-OE2 3.46Å; T463-E466 WeakPolarHBondContact CG2-OE2 3.4Å; T463-E466 PolarHBondContact N-OE2 3.2Å; T463-E466 PolarHBondContact O-N 3.1Å; T463-E466 VanDerWaalsContact OG1-CG 3.24Å; T463-E466 WeakPolarHBondContact OG1-CG 3.23Å; T463-E466 PolarHBondContact OG1-N 3.37Å; T463-E466 PolarHBondContact OG1-OE2 3.01Å; E466-A468 PolarHBondContact O-N 2.93Å
467	R	93.4	Very high	92.1	Very high	34 Å²	34	58.8 Å²	58.8	13%	0.128	34%	0.337	C	S	.	.	H	α-helix	trans	-61.2	-25.9	178.3	-178.8	65.4	-163.6	101.7	-6.6	112.7	P391 E450 T463 V465 G469	P391-R467 HydrophobicContact CG-CG 3.81Å; P391-R467 PolarHBondContact O-NH2 3.15Å; E450-R467 PolarHBondContact O-NH2 2.93Å; E450-R467 IonicContact OE2-CZ 3.84Å; E450-R467 IonicContact OE2-NH1 3.64Å; E450-R467 PolarHBondContact OE2-NH1 3.15Å; T463-R467 VanDerWaalsContact O-CB 3.3Å; T463-R467 WeakPolarHBondContact O-CB 3.24Å; T463-R467 PolarHBondContact O-N 3.2Å; V465-R467 VanDerWaalsContact C-N 3.28Å; V465-R467 PolarHBondContact O-N 3.02Å; R467-G469 PolarHBondContact O-N 2.99Å
468	A	91.3	Very high	92	Very high	4 Å²	4	60.7 Å²	60.7	3%	0.033	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.9	-174	0	0	0	0	0	113.7	L425 Y434 K464 V465 E466	L425-A468 HydrophobicContact CB-CB 4.2Å; L425-A468 WeakPolarHBondContact CB-O 3.47Å; L425-A468 HydrophobicContact CD2-CB 4.09Å; L425-A468 HydrophobicContact CG-CB 4.49Å; Y434-A468 HydrophobicContact CD1-CB 4.21Å; Y434-A468 HydrophobicContact CE1-CB 3.93Å; K464-A468 PolarHBondContact O-N 2.62Å; V465-A468 VanDerWaalsContact O-CB 3.25Å; V465-A468 WeakPolarHBondContact O-CB 3.39Å; V465-A468 PolarHBondContact O-N 2.98Å; E466-A468 PolarHBondContact O-N 2.93Å
469	G	91.2	Very high	91.9	Very high	24 Å²	24	56.2 Å²	56.2	25%	0.247	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.9	19.4	-176.5	0	0	0	0	0	114.9	E450 R467 S473	E450-G469 WeakPolarHBondContact OE1-CA 3.3Å; R467-G469 PolarHBondContact O-N 2.99Å; G469-S473 VanDerWaalsContact O-CB 3.23Å; G469-S473 WeakPolarHBondContact O-CB 3.36Å; G469-S473 PolarHBondContact O-N 3.42Å; G469-S473 PolarHBondContact O-OG 2.89Å
470	A	94.4	Very high	91.9	Very high	16 Å²	16	59.6 Å²	59.6	13%	0.132	33%	0.334	C	S	.	.	H	α-helix	trans	-60.4	-55.3	-171.7	0	0	0	0	0	112.8	E450 L459 L462 S473 V474	E450-A470 PolarHBondContact OE1-N 3.06Å; E450-A470 PolarHBondContact OE2-N 3.29Å; L459-A470 HydrophobicContact CD2-CB 3.82Å; L462-A470 HydrophobicContact CD1-CB 3.79Å; A470-S473 PolarHBondContact O-N 3.19Å; A470-V474 WeakPolarHBondContact O-CG2 3.46Å; A470-V474 PolarHBondContact O-N 2.81Å
471	C	95.5	Very high	92.2	Very high	6 Å²	6	58.8 Å²	58.8	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-70.6	-38.6	-178	-61.9	0	0	0	0	111.9	V449 E450 S473 V474 I475	V449-C471 HydrophobicContact CG1-CB 4.23Å; E450-C471 PolarHBondContact OE1-N 3.02Å; E450-C471 VanDerWaalsContact OE1-N 3.13Å; E450-C471 VanDerWaalsContact OE2-CB 3.29Å; E450-C471 WeakPolarHBondContact OE2-CB 3.49Å; E450-C471 PolarHBondContact OE2-N 3.19Å; E450-C471 PolarHBondContact OE2-SG 3.21Å; C471-S473 VanDerWaalsContact C-N 3.3Å; C471-S473 PolarHBondContact O-N 2.7Å; C471-V474 PolarHBondContact O-N 3.38Å; C471-I475 PolarHBondContact O-N 2.67Å
472	N	94.8	Very high	92.5	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.011	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-39.6	175.4	-81.1	-84.3	0	0	0	111.7	S418 T446 E450 V474 I475 R476	S418-N472 VanDerWaalsContact CB-OD1 3.3Å; S418-N472 WeakPolarHBondContact CB-OD1 3.47Å; S418-N472 PolarHBondContact OG-OD1 3.21Å; T446-N472 WeakPolarHBondContact CG2-ND2 3.32Å; T446-N472 PolarHBondContact O-ND2 2.82Å; E450-N472 WeakPolarHBondContact OE1-CB 3.29Å; E450-N472 PolarHBondContact OE1-N 2.83Å; E450-N472 PolarHBondContact OE1-ND2 2.97Å; N472-V474 VanDerWaalsContact C-N 3.33Å; N472-V474 PolarHBondContact O-N 2.76Å; N472-I475 PolarHBondContact O-N 2.92Å; N472-R476 WeakPolarHBondContact O-CG 3.35Å; N472-R476 PolarHBondContact O-N 2.9Å
473	S	93.5	Very high	92.3	Very high	53 Å²	53	55.4 Å²	55.4	37%	0.371	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-39.1	177.5	-62.9	0	0	0	0	112	G469 A470 C471 I475 R476 Q477	G469-S473 VanDerWaalsContact O-CB 3.23Å; G469-S473 WeakPolarHBondContact O-CB 3.36Å; G469-S473 PolarHBondContact O-N 3.42Å; G469-S473 PolarHBondContact O-OG 2.89Å; A470-S473 PolarHBondContact O-N 3.19Å; C471-S473 VanDerWaalsContact C-N 3.3Å; C471-S473 PolarHBondContact O-N 2.7Å; S473-I475 VanDerWaalsContact C-N 3.35Å; S473-I475 PolarHBondContact O-N 3.22Å; S473-R476 PolarHBondContact O-N 2.94Å; S473-Q477 WeakPolarHBondContact O-CG 3.45Å; S473-Q477 PolarHBondContact O-N 2.93Å; S473-Q477 VanDerWaalsContact O-N 3.1Å
474	V	94.9	Very high	92.1	Very high	35 Å²	35	53.4 Å²	53.4	21%	0.212	27%	0.266	C	S	.	.	H	α-helix	trans	-60.1	-44.4	174.7	173.9	0	0	0	0	111.2	F455 T457 A470 C471 N472 R476 Q477	F455-V474 HydrophobicContact CB-CG1 4.23Å; F455-V474 HydrophobicContact CD2-CG1 4.02Å; F455-V474 HydrophobicContact CG-CG1 4.21Å; T457-V474 HydrophobicContact CG2-CG2 4.12Å; A470-V474 WeakPolarHBondContact O-CG2 3.46Å; A470-V474 PolarHBondContact O-N 2.81Å; C471-V474 PolarHBondContact O-N 3.38Å; N472-V474 VanDerWaalsContact C-N 3.33Å; N472-V474 PolarHBondContact O-N 2.76Å; V474-R476 PolarHBondContact O-N 3.35Å; V474-Q477 WeakPolarHBondContact O-CB 3.21Å; V474-Q477 PolarHBondContact O-N 2.95Å
475	I	93.6	Very high	91.9	Very high	2 Å²	2	48 Å²	48	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-43	178.1	-63.1	179.9	0	0	0	111.2	A414 T415 M419 V449 F455 C471 N472 S473 Q477 L478 M479	A414-I475 HydrophobicContact CB-CD1 4.2Å; T415-I475 HydrophobicContact CG2-CG2 4.03Å; M419-I475 HydrophobicContact CG-CG2 4.06Å; M419-I475 HydrophobicContact SD-CG2 4.17Å; V449-I475 HydrophobicContact CG1-CD1 3.65Å; F455-I475 HydrophobicContact CD2-CG1 4.26Å; F455-I475 HydrophobicContact CE2-CG1 3.93Å; C471-I475 PolarHBondContact O-N 2.67Å; N472-I475 PolarHBondContact O-N 2.92Å; S473-I475 VanDerWaalsContact C-N 3.35Å; S473-I475 PolarHBondContact O-N 3.22Å; I475-Q477 PolarHBondContact O-N 3.34Å; I475-L478 WeakPolarHBondContact O-CB 3.48Å; I475-L478 PolarHBondContact O-N 3.01Å; I475-M479 PolarHBondContact O-N 3.39Å
476	R	91.4	Very high	91.5	Very high	111 Å²	111	49 Å²	49	42%	0.419	24%	0.243	S	C	.	.	H	α-helix	trans	-64	-21.4	177.9	-69.6	171.5	-176.8	172.8	-1	113.3	M419 N472 S473 V474 L478	M419-R476 HydrophobicContact SD-CG 4.05Å; N472-R476 WeakPolarHBondContact O-CG 3.35Å; N472-R476 PolarHBondContact O-N 2.9Å; S473-R476 PolarHBondContact O-N 2.94Å; V474-R476 PolarHBondContact O-N 3.35Å; R476-L478 VanDerWaalsContact C-N 3.34Å
477	Q	92.2	Very high	91.2	Very high	140 Å²	140	46.2 Å²	46.2	65%	0.654	23%	0.229	S	C	*	.	H	α-helix	trans	-77	-18.8	172.5	-70.4	172.4	5.7	0	0	113.2	S473 V474 I475 V501	S473-Q477 WeakPolarHBondContact O-CG 3.45Å; S473-Q477 PolarHBondContact O-N 2.93Å; S473-Q477 VanDerWaalsContact O-N 3.1Å; V474-Q477 WeakPolarHBondContact O-CB 3.21Å; V474-Q477 PolarHBondContact O-N 2.95Å; I475-Q477 PolarHBondContact O-N 3.34Å; Q477-V501 WeakPolarHBondContact O-CG2 3.42Å
478	L	90.4	Very high	90.1	Very high	79 Å²	79	44.9 Å²	44.9	41%	0.414	23%	0.226	S	C	.	.	H	α-helix	trans	-85.6	-34.8	179.6	-60	174.8	0	0	0	112.3	F455 I475 R476 V501	F455-L478 HydrophobicContact CE1-CD1 3.92Å; F455-L478 HydrophobicContact CE2-CD1 3.66Å; F455-L478 HydrophobicContact CZ-CD1 3.3Å; I475-L478 WeakPolarHBondContact O-CB 3.48Å; I475-L478 PolarHBondContact O-N 3.01Å; R476-L478 VanDerWaalsContact C-N 3.34Å; L478-V501 PolarHBondContact O-N 3.3Å; L478-V501 VanDerWaalsContact O-N 3.08Å
479	M	89.6	Confident	88.8	Confident	24 Å²	24	49.9 Å²	49.9	12%	0.118	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	127.9	-175.4	-62.2	-66.4	-69.9	0	0	110	M419 I475 C498 T499 P500 K508 F510	M419-M479 HydrophobicContact CE-CB 3.85Å; M419-M479 WeakPolarHBondContact CE-O 3.27Å; M419-M479 HydrophobicContact SD-CB 4.29Å; I475-M479 PolarHBondContact O-N 3.39Å; M479-C498 HydrophobicContact CB-CB 4.24Å; M479-C498 HydrophobicContact CE-CB 3.65Å; M479-T499 CarbonylContact C-O 3.6Å; M479-P500 HydrophobicContact SD-CB 3.86Å; M479-K508 HydrophobicContact CE-CB 4.34Å; M479-F510 HydrophobicContact CE-CE2 4.07Å; M479-F510 HydrophobicContact CE-CZ 4.13Å; M479-F510 HydrophobicContact CG-CE2 4.38Å
480	K	91.2	Very high	87.7	Confident	115 Å²	115	53.7 Å²	53.7	50%	0.5	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	120	172	-175.8	-176.2	174.3	-141.9	0	109.6	E482 C498 T499 V501	K480-E482 WeakPolarHBondContact CD-OE1 3.39Å; K480-E482 WeakPolarHBondContact CE-OE1 3.31Å; K480-E482 IonicContact NZ-OE1 3.6Å; K480-E482 PolarHBondContact NZ-OE1 3.07Å; K480-E482 PolarHBondContact O-N 3.45Å; K480-C498 CarbonylContact O-C 3.56Å; K480-C498 VanDerWaalsContact O-CA 3.25Å; K480-C498 WeakPolarHBondContact O-CA 3.29Å; K480-T499 PolarHBondContact N-O 3.41Å; K480-T499 PolarHBondContact O-N 2.73Å; K480-V501 HydrophobicContact CB-CG2 4.37Å
481	K	92.7	Very high	87.2	Confident	72 Å²	72	53.4 Å²	53.4	31%	0.313	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	114.8	171.2	-174.9	173.4	173.9	176.3	0	108.7	M419 N421 D422 T484 V496	M419-K481 HydrophobicContact CE-CB 3.88Å; N421-K481 PolarHBondContact O-NZ 3.3Å; N421-K481 VanDerWaalsContact O-NZ 3.08Å; D422-K481 IonicContact OD1-NZ 2.93Å; D422-K481 PolarHBondContact OD1-NZ 3.25Å; K481-T484 WeakPolarHBondContact CE-OG1 3.42Å; K481-T484 PolarHBondContact NZ-OG1 3.28Å; K481-V496 HydrophobicContact CD-CG1 4.31Å; K481-V496 HydrophobicContact CG-CB 4.46Å
482	E	91.7	Very high	86.7	Confident	57 Å²	57	58.1 Å²	58.1	27%	0.266	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-48	-179.6	-74.5	-71.4	150.3	0	0	111.3	K480 Y497 T499 K570	K480-E482 WeakPolarHBondContact CD-OE1 3.39Å; K480-E482 WeakPolarHBondContact CE-OE1 3.31Å; K480-E482 IonicContact NZ-OE1 3.6Å; K480-E482 PolarHBondContact NZ-OE1 3.07Å; K480-E482 PolarHBondContact O-N 3.45Å; E482-Y497 HydrophobicContact CB-CD1 4.09Å; E482-Y497 HydrophobicContact CG-CD1 4.26Å; E482-Y497 PolarHBondContact N-O 2.81Å; E482-T499 HydrophobicContact CG-CG2 3.88Å; E482-T499 PolarHBondContact OE1-OG1 2.94Å; E482-K570 IonicContact OE2-NZ 3.07Å; E482-K570 PolarHBondContact OE2-NZ 2.87Å
483	F	88.6	Confident	86.4	Confident	25 Å²	25	58 Å²	58	11%	0.11	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	163	177.3	55.1	-91.6	0	0	0	110.8	L485 Y497 K570 M573 L575	F483-L485 HydrophobicContact CD2-CD2 4.06Å; F483-L485 HydrophobicContact CE2-CD2 3.97Å; F483-Y497 AromaticContact CE1-CD1 3.85Å; F483-Y497 HydrophobicContact CE1-CD1 3.85Å; F483-Y497 HydrophobicContact CE1-CD2 4.4Å; F483-Y497 AromaticContact CE1-CG 3.71Å; F483-Y497 HydrophobicContact CE1-CG 3.71Å; F483-Y497 VanDerWaalsContact CE2-CB 3.45Å; F483-Y497 HydrophobicContact CE2-CG 4.15Å; F483-Y497 HydrophobicContact CZ-CD1 4.08Å; F483-Y497 AromaticContact CZ-CD2 3.81Å; F483-Y497 HydrophobicContact CZ-CD2 3.81Å; F483-Y497 AromaticContact CZ-CG 3.46Å; F483-Y497 HydrophobicContact CZ-CG 3.46Å; F483-Y497 VanDerWaalsContact CZ-CG 3.46Å; F483-Y497 PolarHBondContact O-N 3.11Å; F483-K570 HydrophobicContact CD1-CD 4.45Å; F483-K570 HydrophobicContact CE1-CB 4.42Å; F483-K570 HydrophobicContact CE1-CD 4.01Å; F483-K570 HydrophobicContact CE1-CG 3.8Å; F483-M573 HydrophobicContact CE2-CE 3.79Å; F483-M573 HydrophobicContact CE2-SD 4.25Å; F483-M573 HydrophobicContact CZ-CE 3.98Å; F483-M573 HydrophobicContact CZ-SD 3.8Å; F483-L575 HydrophobicContact CB-CD1 4.43Å; F483-L575 HydrophobicContact CD1-CD1 4.05Å; F483-L575 HydrophobicContact CD2-CD1 4.09Å; F483-L575 HydrophobicContact CD2-CD2 3.67Å; F483-L575 HydrophobicContact CE1-CD1 4.34Å; F483-L575 HydrophobicContact CE2-CD1 4.36Å; F483-L575 HydrophobicContact CE2-CD2 3.42Å; F483-L575 VanDerWaalsContact CE2-CD2 3.42Å; F483-L575 HydrophobicContact CG-CD1 3.93Å; F483-L575 HydrophobicContact CG-CD2 4.35Å; F483-L575 HydrophobicContact CZ-CD1 4.48Å; F483-L575 HydrophobicContact CZ-CD2 3.92Å
484	T	89.4	Confident	86.4	Confident	36 Å²	36	55.8 Å²	55.8	22%	0.221	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.1	176	-55.5	0	0	0	0	109.1	K481 E486 M494 S495 V496	K481-T484 WeakPolarHBondContact CE-OG1 3.42Å; K481-T484 PolarHBondContact NZ-OG1 3.28Å; T484-E486 PolarHBondContact O-N 3.42Å; T484-M494 HydrophobicContact CG2-CG 4.11Å; T484-M494 HydrophobicContact CG2-SD 4.4Å; T484-S495 CarbonylContact C-O 3.58Å; T484-S495 WeakPolarHBondContact CG2-O 3.42Å; T484-V496 HydrophobicContact CG2-CG1 3.96Å
485	L	88	Confident	86.5	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	98.1	159	-55.4	-170.2	0	0	0	107.2	F483 R491 S495 M509 M573 L575 F581 Y584	F483-L485 HydrophobicContact CD2-CD2 4.06Å; F483-L485 HydrophobicContact CE2-CD2 3.97Å; L485-R491 PolarHBondContact O-NH2 3.22Å; L485-S495 WeakPolarHBondContact CB-OG 3.45Å; L485-S495 PolarHBondContact N-O 3.39Å; L485-S495 PolarHBondContact O-N 3.49Å; L485-S495 VanDerWaalsContact O-N 3.15Å; L485-M509 HydrophobicContact CD1-CE 3.57Å; L485-M509 HydrophobicContact CG-CE 4.32Å; L485-M573 HydrophobicContact CD1-CE 4Å; L485-M573 HydrophobicContact CD2-CE 4.31Å; L485-L575 HydrophobicContact CD2-CD2 3.93Å; L485-F581 HydrophobicContact CB-CB 4.44Å; L485-F581 HydrophobicContact CB-CD2 3.88Å; L485-F581 HydrophobicContact CB-CE2 4.24Å; L485-F581 HydrophobicContact CB-CG 4.07Å; L485-F581 HydrophobicContact CD1-CB 4.14Å; L485-F581 HydrophobicContact CD1-CD1 4.26Å; L485-F581 HydrophobicContact CD1-CG 4.16Å; L485-F581 HydrophobicContact CD2-CD1 3.86Å; L485-F581 HydrophobicContact CD2-CD2 4.4Å; L485-F581 HydrophobicContact CD2-CE1 3.78Å; L485-F581 HydrophobicContact CD2-CE2 4.32Å; L485-F581 HydrophobicContact CD2-CG 4.18Å; L485-F581 HydrophobicContact CD2-CZ 4.01Å; L485-F581 HydrophobicContact CG-CD1 4.47Å; L485-F581 HydrophobicContact CG-CG 4.37Å; L485-Y584 HydrophobicContact CD1-CD2 4.14Å
486	E	82.4	Confident	86.6	Confident	84 Å²	84	54 Å²	54	39%	0.393	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	143.5	-174.7	-61.9	175.6	169.9	0	0	111.6	T171 T484 S488 R491	T171-E486 WeakPolarHBondContact CB-OE2 3.38Å; T171-E486 WeakPolarHBondContact CG2-OE2 3.16Å; T171-E486 PolarHBondContact OG1-OE2 3.36Å; T484-E486 PolarHBondContact O-N 3.42Å; E486-S488 PolarHBondContact O-N 3.07Å; E486-R491 VanDerWaalsContact C-NH2 3.28Å; E486-R491 PolarHBondContact O-NH2 3.45Å
487	F	84.1	Confident	86.8	Confident	50 Å²	50	49.5 Å²	49.5	22%	0.219	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	126.7	179.5	177.7	-83.5	0	0	0	111.5	T172 I188 K492 S493 M494	T172-F487 WeakPolarHBondContact CG2-O 3.31Å; I188-F487 HydrophobicContact CD1-CD1 3.48Å; I188-F487 VanDerWaalsContact CD1-CD1 3.48Å; I188-F487 HydrophobicContact CD1-CE1 3.34Å; I188-F487 HydrophobicContact CD1-CZ 4.5Å; F487-K492 HydrophobicContact CE2-CB 4.49Å; F487-K492 HydrophobicContact CZ-CB 4.38Å; F487-S493 VanDerWaalsContact CA-O 3.22Å; F487-S493 WeakPolarHBondContact CA-O 3.24Å; F487-S493 WeakPolarHBondContact CD2-O 3.49Å; F487-M494 HydrophobicContact CB-CB 4.21Å; F487-M494 HydrophobicContact CB-CE 4.36Å
488	S	71.6	Confident	86.9	Confident	7 Å²	7	42.8 Å²	42.8	5%	0.049	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150	173.7	69.7	0	0	0	0	110.6	E486 D490 R491 K492	E486-S488 PolarHBondContact O-N 3.07Å; S488-D490 VanDerWaalsContact C-OD1 3.27Å; S488-D490 WeakPolarHBondContact CB-OD1 3.38Å; S488-D490 PolarHBondContact OG-OD1 2.91Å; S488-R491 WeakPolarHBondContact OG-CD 3.08Å; S488-R491 VanDerWaalsContact OG-CG 3.28Å; S488-R491 WeakPolarHBondContact OG-CG 3.13Å; S488-R491 PolarHBondContact OG-NE 3.49Å; S488-K492 WeakPolarHBondContact O-CA 3.16Å; S488-K492 PolarHBondContact O-N 2.87Å
489	R	63.4	Low	86.9	Confident	108 Å²	108	40.7 Å²	40.7	41%	0.408	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-29.9	-163.8	-156.8	-177.3	-176.5	-149.6	-2.2	113.4	H190 K492	H190-R489 PolarHBondContact CD2-NH1 3.1Å; H190-R489 PolarHBondContact NE2-NH1 2.78Å; H190-R489 VanDerWaalsContact NE2-NH1 3.19Å; R489-K492 WeakPolarHBondContact O-CG 3.42Å
490	D	69.1	Low	87	Confident	105 Å²	105	40.9 Å²	40.9	56%	0.561	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-48.3	171.4	57.4	-32	0	0	0	111.6	S488	S488-D490 VanDerWaalsContact C-OD1 3.27Å; S488-D490 WeakPolarHBondContact CB-OD1 3.38Å; S488-D490 PolarHBondContact OG-OD1 2.91Å
491	R	82.1	Confident	86.7	Confident	9 Å²	9	39.9 Å²	39.9	3%	0.034	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-15.5	-178.2	71.4	-167.4	177.6	89.6	-8.5	114.8	L485 E486 S488 S493 S517 R521 A582 E585	L485-R491 PolarHBondContact O-NH2 3.22Å; E486-R491 VanDerWaalsContact C-NH2 3.28Å; E486-R491 PolarHBondContact O-NH2 3.45Å; S488-R491 WeakPolarHBondContact OG-CD 3.08Å; S488-R491 VanDerWaalsContact OG-CG 3.28Å; S488-R491 WeakPolarHBondContact OG-CG 3.13Å; S488-R491 PolarHBondContact OG-NE 3.49Å; R491-S493 PolarHBondContact NH1-O 3.13Å; R491-S493 PolarHBondContact NH1-OG 2.92Å; R491-S493 PolarHBondContact NH2-O 3.45Å; R491-S493 PolarHBondContact O-N 2.82Å; R491-S493 VanDerWaalsContact O-N 3.11Å; R491-S517 WeakPolarHBondContact O-CB 3.25Å; R491-R521 PolarHBondContact O-NH2 2.9Å; R491-A582 HydrophobicContact CB-CB 4.28Å; R491-E585 IonicContact CZ-OE1 3.22Å; R491-E585 IonicContact CZ-OE2 3.4Å; R491-E585 IonicContact NH1-OE1 2.99Å; R491-E585 PolarHBondContact NH1-OE1 3.25Å; R491-E585 IonicContact NH1-OE2 2.75Å; R491-E585 PolarHBondContact NH1-OE2 3.47Å; R491-E585 IonicContact NH2-OE1 3.74Å
492	K	84.9	Confident	86.1	Confident	106 Å²	106	45 Å²	45	46%	0.461	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	35.8	-178.7	-56.7	-179.4	-177.3	168	0	114.2	F487 S488 R489 G513 A514	F487-K492 HydrophobicContact CE2-CB 4.49Å; F487-K492 HydrophobicContact CZ-CB 4.38Å; S488-K492 WeakPolarHBondContact O-CA 3.16Å; S488-K492 PolarHBondContact O-N 2.87Å; R489-K492 WeakPolarHBondContact O-CG 3.42Å; K492-G513 CarbonylContact O-C 3.52Å; K492-G513 VanDerWaalsContact O-CA 3.31Å; K492-G513 WeakPolarHBondContact O-CA 3.44Å; K492-A514 HydrophobicContact CB-CB 3.74Å; K492-A514 HydrophobicContact CD-CB 4.2Å; K492-A514 PolarHBondContact O-N 2.79Å
493	S	90.4	Very high	84.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	171.8	175.1	51.1	0	0	0	0	109.8	F487 R491 K512 R521 E585	F487-S493 VanDerWaalsContact CA-O 3.22Å; F487-S493 WeakPolarHBondContact CA-O 3.24Å; F487-S493 WeakPolarHBondContact CD2-O 3.49Å; R491-S493 PolarHBondContact NH1-O 3.13Å; R491-S493 PolarHBondContact NH1-OG 2.92Å; R491-S493 PolarHBondContact NH2-O 3.45Å; R491-S493 PolarHBondContact O-N 2.82Å; R491-S493 VanDerWaalsContact O-N 3.11Å; S493-K512 CarbonylContact C-O 3.26Å; S493-K512 WeakPolarHBondContact CA-O 3.29Å; S493-K512 VanDerWaalsContact CB-O 3.29Å; S493-K512 WeakPolarHBondContact CB-O 3.45Å; S493-R521 PolarHBondContact OG-NH1 2.7Å; S493-R521 PolarHBondContact OG-NH2 3.18Å; S493-E585 PolarHBondContact OG-OE2 3.06Å
494	M	93.1	Very high	83.5	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.025	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.8	167.3	173	-170.3	-83.8	0	0	106.7	C420 D422 E442 T484 F487 I511 K512	C420-M494 PolarHBondContact SG-O 3.04Å; C420-M494 VanDerWaalsContact SG-O 3.4Å; D422-M494 WeakPolarHBondContact OD2-CE 3.27Å; E442-M494 WeakPolarHBondContact OE1-CE 3.43Å; T484-M494 HydrophobicContact CG2-CG 4.11Å; T484-M494 HydrophobicContact CG2-SD 4.4Å; F487-M494 HydrophobicContact CB-CB 4.21Å; F487-M494 HydrophobicContact CB-CE 4.36Å; M494-I511 WeakPolarHBondContact O-CA 3.47Å; M494-K512 HydrophobicContact CB-CG 4.27Å; M494-K512 PolarHBondContact N-O 3.44Å; M494-K512 PolarHBondContact O-N 3Å; M494-K512 WeakPolarHBondContact SD-CE 3.49Å
495	S	96	Very high	82.7	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	163.1	168.4	64.3	0	0	0	0	113.2	T484 L485 M509 F510 E585	T484-S495 CarbonylContact C-O 3.58Å; T484-S495 WeakPolarHBondContact CG2-O 3.42Å; L485-S495 WeakPolarHBondContact CB-OG 3.45Å; L485-S495 PolarHBondContact N-O 3.39Å; L485-S495 PolarHBondContact O-N 3.49Å; L485-S495 VanDerWaalsContact O-N 3.15Å; S495-M509 WeakPolarHBondContact OG-CE 3.24Å; S495-F510 CarbonylContact C-O 3.55Å; S495-F510 WeakPolarHBondContact CA-O 3.33Å; S495-F510 VanDerWaalsContact CB-O 3.25Å; S495-F510 WeakPolarHBondContact CB-O 3.37Å; S495-E585 WeakPolarHBondContact CB-OE1 3.12Å; S495-E585 PolarHBondContact OG-OE1 3.06Å
496	V	96.3	Very high	82.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.5	175.3	-65	0	0	0	0	110.2	M419 C420 K481 T484 M509 F510	M419-V496 HydrophobicContact CB-CG2 4.13Å; M419-V496 WeakPolarHBondContact O-CG2 3.49Å; C420-V496 HydrophobicContact CB-CG1 4.47Å; C420-V496 HydrophobicContact CB-CG2 3.88Å; K481-V496 HydrophobicContact CD-CG1 4.31Å; K481-V496 HydrophobicContact CG-CB 4.46Å; T484-V496 HydrophobicContact CG2-CG1 3.96Å; V496-M509 CarbonylContact O-C 3.56Å; V496-M509 WeakPolarHBondContact O-CA 3.47Å; V496-F510 HydrophobicContact CG2-CB 3.87Å; V496-F510 HydrophobicContact CG2-CD2 4.16Å; V496-F510 PolarHBondContact N-O 2.76Å; V496-F510 PolarHBondContact O-N 3.49Å
497	Y	95.2	Very high	82.8	Confident	16 Å²	16	56.3 Å²	56.3	6%	0.063	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	125.4	173	-169.8	-80.4	0	0	0	109.3	E482 F483 T499 S507 M509 P567 P568 M573	E482-Y497 HydrophobicContact CB-CD1 4.09Å; E482-Y497 HydrophobicContact CG-CD1 4.26Å; E482-Y497 PolarHBondContact N-O 2.81Å; F483-Y497 AromaticContact CE1-CD1 3.85Å; F483-Y497 HydrophobicContact CE1-CD1 3.85Å; F483-Y497 HydrophobicContact CE1-CD2 4.4Å; F483-Y497 AromaticContact CE1-CG 3.71Å; F483-Y497 HydrophobicContact CE1-CG 3.71Å; F483-Y497 VanDerWaalsContact CE2-CB 3.45Å; F483-Y497 HydrophobicContact CE2-CG 4.15Å; F483-Y497 HydrophobicContact CZ-CD1 4.08Å; F483-Y497 AromaticContact CZ-CD2 3.81Å; F483-Y497 HydrophobicContact CZ-CD2 3.81Å; F483-Y497 AromaticContact CZ-CG 3.46Å; F483-Y497 HydrophobicContact CZ-CG 3.46Å; F483-Y497 VanDerWaalsContact CZ-CG 3.46Å; F483-Y497 PolarHBondContact O-N 3.11Å; Y497-T499 HydrophobicContact CE1-CG2 3.99Å; Y497-S507 VanDerWaalsContact CZ-CB 3.49Å; Y497-S507 WeakPolarHBondContact OH-CB 3.36Å; Y497-S507 PolarHBondContact OH-OG 2.92Å; Y497-M509 HydrophobicContact CD2-CG 3.56Å; Y497-M509 HydrophobicContact CD2-SD 4.02Å; Y497-M509 HydrophobicContact CE2-CG 4.4Å; Y497-M509 HydrophobicContact CG-CG 4.22Å; Y497-P567 HydrophobicContact CD2-CB 4.25Å; Y497-P567 HydrophobicContact CD2-CG 4.25Å; Y497-P567 HydrophobicContact CE2-CB 3.85Å; Y497-P567 HydrophobicContact CE2-CG 3.63Å; Y497-P568 WeakPolarHBondContact CE2-O 3.45Å; Y497-M573 HydrophobicContact CD2-SD 4.17Å; Y497-M573 HydrophobicContact CE2-SD 4.38Å
498	C	94.1	Very high	83.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134	-172.7	-65.4	0	0	0	0	111.4	M419 M479 K480 S507 K508 F510	M419-C498 HydrophobicContact CE-CB 4.47Å; M419-C498 VanDerWaalsContact CE-SG 3.51Å; M479-C498 HydrophobicContact CB-CB 4.24Å; M479-C498 HydrophobicContact CE-CB 3.65Å; K480-C498 CarbonylContact O-C 3.56Å; K480-C498 VanDerWaalsContact O-CA 3.25Å; K480-C498 WeakPolarHBondContact O-CA 3.29Å; C498-S507 WeakPolarHBondContact O-CA 3.49Å; C498-K508 PolarHBondContact N-O 3.19Å; C498-K508 PolarHBondContact O-N 2.78Å; C498-F510 HydrophobicContact CB-CD2 4.13Å; C498-F510 HydrophobicContact CB-CE2 3.83Å
499	T	91.8	Very high	84.5	Confident	34 Å²	34	56.5 Å²	56.5	21%	0.209	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	134.7	173	50.5	0	0	0	0	109.6	M479 K480 E482 Y497	M479-T499 CarbonylContact C-O 3.6Å; K480-T499 PolarHBondContact N-O 3.41Å; K480-T499 PolarHBondContact O-N 2.73Å; E482-T499 HydrophobicContact CG-CG2 3.88Å; E482-T499 PolarHBondContact OE1-OG1 2.94Å; Y497-T499 HydrophobicContact CE1-CG2 3.99Å
500	P	89.9	Confident	86.1	Confident	29 Å²	29	51.6 Å²	51.6	19%	0.188	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	140.9	176	22.5	-27.8	0	0	0	110.9	M479 K502 A505	M479-P500 HydrophobicContact SD-CB 3.86Å; P500-K502 VanDerWaalsContact C-N 3.33Å; P500-A505 HydrophobicContact CB-CB 3.8Å; P500-A505 HydrophobicContact CG-CB 3.4Å; P500-A505 WeakPolarHBondContact CG-O 3.38Å
501	V	85.1	Confident	87.5	Confident	94 Å²	94	46.6 Å²	46.6	57%	0.57	28%	0.28	S	S	*	.	S	Bend	trans	-71.6	-29.6	-179.2	177.8	0	0	0	0	111.7	Q477 L478 K480	Q477-V501 WeakPolarHBondContact O-CG2 3.42Å; L478-V501 PolarHBondContact O-N 3.3Å; L478-V501 VanDerWaalsContact O-N 3.08Å; K480-V501 HydrophobicContact CB-CG2 4.37Å
502	K	80.1	Confident	88.2	Confident	180 Å²	180	46.9 Å²	46.9	78%	0.783	28%	0.281	S	S	*	.	S	Bend	trans	-79.3	128.1	172.4	-71.2	-176.7	179	177.8	0	110.6	P500	P500-K502 VanDerWaalsContact C-N 3.33Å
503	A	61.7	Low	88.6	Confident	110 Å²	110	42 Å²	42	91%	0.909	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	133.9	178.5	0	0	0	0	0	111.9
504	G	64.6	Low	88.5	Confident	91 Å²	91	43.3 Å²	43.3	94%	0.938	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.5	-8.8	173.6	0	0	0	0	0	116.4
505	A	73.3	Confident	88.4	Confident	63 Å²	63	43.9 Å²	43.9	52%	0.521	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-91.7	148.2	173.9	0	0	0	0	0	111.8	P500	P500-A505 HydrophobicContact CB-CB 3.8Å; P500-A505 HydrophobicContact CG-CB 3.4Å; P500-A505 WeakPolarHBondContact CG-O 3.38Å
506	Q	81.6	Confident	88	Confident	145 Å²	145	49.6 Å²	49.6	68%	0.678	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-73.9	146.4	-179.2	-70.2	-175.4	-10.8	0	0	111.8
507	S	90.9	Very high	87.7	Confident	31 Å²	31	50.8 Å²	50.8	22%	0.217	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-61.1	149.8	171	-49.5	0	0	0	0	110.9	Y497 C498 P567	Y497-S507 VanDerWaalsContact CZ-CB 3.49Å; Y497-S507 WeakPolarHBondContact OH-CB 3.36Å; Y497-S507 PolarHBondContact OH-OG 2.92Å; C498-S507 WeakPolarHBondContact O-CA 3.49Å; S507-P567 WeakPolarHBondContact O-CD 3.46Å
508	K	94	Very high	87.6	Confident	61 Å²	61	50 Å²	50	27%	0.265	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.9	176	-72	-168	169.4	-166.6	0	110.4	E412 M479 C498 F510	E412-K508 IonicContact OE1-NZ 3.53Å; E412-K508 PolarHBondContact OE1-NZ 2.55Å; M479-K508 HydrophobicContact CE-CB 4.34Å; C498-K508 PolarHBondContact N-O 3.19Å; C498-K508 PolarHBondContact O-N 2.78Å; K508-F510 HydrophobicContact CB-CE1 4.4Å; K508-F510 HydrophobicContact CB-CZ 4.25Å; K508-F510 HydrophobicContact CD-CE1 4.18Å; K508-F510 HydrophobicContact CD-CZ 4.29Å
509	M	96.3	Very high	87.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	138.7	159.5	-62.8	168.6	62.4	0	0	110.4	L485 S495 V496 Y497 I511 T563 H564 P567 M573 E585	L485-M509 HydrophobicContact CD1-CE 3.57Å; L485-M509 HydrophobicContact CG-CE 4.32Å; S495-M509 WeakPolarHBondContact OG-CE 3.24Å; V496-M509 CarbonylContact O-C 3.56Å; V496-M509 WeakPolarHBondContact O-CA 3.47Å; Y497-M509 HydrophobicContact CD2-CG 3.56Å; Y497-M509 HydrophobicContact CD2-SD 4.02Å; Y497-M509 HydrophobicContact CE2-CG 4.4Å; Y497-M509 HydrophobicContact CG-CG 4.22Å; M509-I511 HydrophobicContact CB-CD1 4.32Å; M509-I511 WeakPolarHBondContact O-CD1 3.45Å; M509-T563 CarbonylContact O-C 3.49Å; M509-T563 VanDerWaalsContact O-CA 3.31Å; M509-T563 WeakPolarHBondContact O-CA 3.5Å; M509-H564 HydrophobicContact CB-CB 3.84Å; M509-H564 PolarHBondContact N-O 2.7Å; M509-H564 VanDerWaalsContact N-O 3.12Å; M509-H564 PolarHBondContact O-N 2.87Å; M509-P567 HydrophobicContact CB-CB 4.47Å; M509-P567 HydrophobicContact CG-CB 3.63Å; M509-P567 HydrophobicContact CG-CG 4.16Å; M509-P567 HydrophobicContact SD-CB 3.56Å; M509-P567 VanDerWaalsContact SD-CB 3.56Å; M509-M573 HydrophobicContact CE-CE 4.3Å; M509-M573 HydrophobicContact SD-CE 4.26Å; M509-E585 HydrophobicContact CE-CG 4.35Å
510	F	97.8	Very high	87.6	Confident	5 Å²	5	55 Å²	55	2%	0.022	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	132.8	173.4	-59	-61.7	0	0	0	108.8	T415 V416 M419 C420 M479 S495 V496 C498 K508 T563	T415-F510 HydrophobicContact CG2-CE1 3.98Å; T415-F510 HydrophobicContact CG2-CE2 3.94Å; T415-F510 HydrophobicContact CG2-CZ 3.55Å; V416-F510 HydrophobicContact CB-CB 4.49Å; V416-F510 HydrophobicContact CG1-CB 4.24Å; V416-F510 HydrophobicContact CG2-CB 4.28Å; V416-F510 HydrophobicContact CG2-CD1 3.83Å; V416-F510 HydrophobicContact CG2-CG 4.4Å; M419-F510 HydrophobicContact CB-CD2 3.67Å; M419-F510 HydrophobicContact CB-CE2 4.14Å; M419-F510 HydrophobicContact CB-CG 4.49Å; M419-F510 HydrophobicContact CG-CD2 4.11Å; M419-F510 HydrophobicContact CG-CE2 4.06Å; C420-F510 HydrophobicContact CB-CB 4.16Å; M479-F510 HydrophobicContact CE-CE2 4.07Å; M479-F510 HydrophobicContact CE-CZ 4.13Å; M479-F510 HydrophobicContact CG-CE2 4.38Å; S495-F510 CarbonylContact C-O 3.55Å; S495-F510 WeakPolarHBondContact CA-O 3.33Å; S495-F510 VanDerWaalsContact CB-O 3.25Å; S495-F510 WeakPolarHBondContact CB-O 3.37Å; V496-F510 HydrophobicContact CG2-CB 3.87Å; V496-F510 HydrophobicContact CG2-CD2 4.16Å; V496-F510 PolarHBondContact N-O 2.76Å; V496-F510 PolarHBondContact O-N 3.49Å; C498-F510 HydrophobicContact CB-CD2 4.13Å; C498-F510 HydrophobicContact CB-CE2 3.83Å; K508-F510 HydrophobicContact CB-CE1 4.4Å; K508-F510 HydrophobicContact CB-CZ 4.25Å; K508-F510 HydrophobicContact CD-CE1 4.18Å; K508-F510 HydrophobicContact CD-CZ 4.29Å; F510-T563 HydrophobicContact CD1-CG2 3.66Å; F510-T563 HydrophobicContact CE1-CG2 3.98Å
511	I	97.7	Very high	87.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.3	-170.4	-52.7	88.5	0	0	0	109.1	V416 M494 M509 A562 H564 E585 L588	V416-I511 WeakPolarHBondContact CG1-O 3.43Å; M494-I511 WeakPolarHBondContact O-CA 3.47Å; M509-I511 HydrophobicContact CB-CD1 4.32Å; M509-I511 WeakPolarHBondContact O-CD1 3.45Å; I511-A562 HydrophobicContact CB-CB 4.39Å; I511-A562 WeakPolarHBondContact CD1-O 3.44Å; I511-A562 PolarHBondContact N-O 3.29Å; I511-A562 PolarHBondContact O-N 2.62Å; I511-H564 HydrophobicContact CD1-CB 4.17Å; I511-H564 VanDerWaalsContact CD1-N 3.34Å; I511-E585 HydrophobicContact CG1-CG 4.44Å; I511-L588 HydrophobicContact CB-CD1 4.46Å; I511-L588 HydrophobicContact CD1-CD1 4.32Å; I511-L588 HydrophobicContact CD1-CD2 3.63Å; I511-L588 HydrophobicContact CG1-CD1 4.21Å; I511-L588 HydrophobicContact CG1-CD2 4.15Å; I511-L588 HydrophobicContact CG2-CD1 4.31Å
512	K	97.1	Very high	88.4	Confident	14 Å²	14	50.2 Å²	50.2	6%	0.061	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	148	166	73.5	-176	177.7	-165.8	0	110.3	C420 E442 L445 S493 M494 A560 L561	C420-K512 VanDerWaalsContact O-CD 3.23Å; C420-K512 WeakPolarHBondContact O-CD 3.4Å; C420-K512 WeakPolarHBondContact O-CE 3.24Å; C420-K512 PolarHBondContact O-NZ 3.07Å; E442-K512 WeakPolarHBondContact OE1-CE 3.19Å; E442-K512 IonicContact OE1-NZ 3.44Å; E442-K512 PolarHBondContact OE1-NZ 2.85Å; L445-K512 HydrophobicContact CD1-CD 3.96Å; S493-K512 CarbonylContact C-O 3.26Å; S493-K512 WeakPolarHBondContact CA-O 3.29Å; S493-K512 VanDerWaalsContact CB-O 3.29Å; S493-K512 WeakPolarHBondContact CB-O 3.45Å; M494-K512 HydrophobicContact CB-CG 4.27Å; M494-K512 PolarHBondContact N-O 3.44Å; M494-K512 PolarHBondContact O-N 3Å; M494-K512 WeakPolarHBondContact SD-CE 3.49Å; K512-A560 WeakPolarHBondContact CA-O 3.47Å; K512-L561 HydrophobicContact CB-CD2 3.59Å
513	G	93.2	Very high	89.2	Confident	3 Å²	3	45.7 Å²	45.7	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.3	-171.4	176.8	0	0	0	0	0	115.4	K492 L559 A560	K492-G513 CarbonylContact O-C 3.52Å; K492-G513 VanDerWaalsContact O-CA 3.31Å; K492-G513 WeakPolarHBondContact O-CA 3.44Å; G513-L559 WeakPolarHBondContact O-CD2 3.46Å; G513-A560 PolarHBondContact N-O 3.21Å; G513-A560 VanDerWaalsContact N-O 3.07Å; G513-A560 PolarHBondContact O-N 2.72Å
514	A	88.5	Confident	90.8	Very high	28 Å²	28	44.6 Å²	44.6	23%	0.231	25%	0.254	C	S	.	.			trans	-57.8	130.4	173.5	0	0	0	0	0	109.7	K492 E516 S517 V518	K492-A514 HydrophobicContact CB-CB 3.74Å; K492-A514 HydrophobicContact CD-CB 4.2Å; K492-A514 PolarHBondContact O-N 2.79Å; A514-E516 PolarHBondContact O-N 3.29Å; A514-S517 PolarHBondContact O-N 3.37Å; A514-V518 WeakPolarHBondContact O-CG2 3.44Å; A514-V518 PolarHBondContact O-N 2.82Å
515	P	91.4	Very high	92.3	Very high	17 Å²	17	40.3 Å²	40.3	11%	0.11	21%	0.21	C	C	.	.	H	α-helix	trans	-53.4	-46.8	-174.1	-30.9	36.1	0	0	0	114.8	S517 V518 M519 M543 I546 C558 A560	P515-S517 PolarHBondContact O-N 3.32Å; P515-V518 PolarHBondContact O-N 3.32Å; P515-M519 WeakPolarHBondContact O-CB 3.33Å; P515-M519 PolarHBondContact O-N 3.24Å; P515-M543 HydrophobicContact CB-SD 4.38Å; P515-I546 HydrophobicContact CB-CD1 4.13Å; P515-I546 HydrophobicContact CB-CG2 3.8Å; P515-I546 HydrophobicContact CG-CG2 3.78Å; P515-C558 WeakPolarHBondContact CD-O 3.41Å; P515-C558 HydrophobicContact CG-CB 4.03Å; P515-A560 HydrophobicContact CB-CB 4.25Å; P515-A560 HydrophobicContact CG-CB 4.46Å
516	E	88.4	Confident	93.4	Very high	121 Å²	121	38.1 Å²	38.1	57%	0.565	19%	0.188	S	C	*	.	H	α-helix	trans	-61.6	-50.3	-177.3	-40.4	-148	153.5	0	0	111.2	A514 V518 M519 E520 M543	A514-E516 PolarHBondContact O-N 3.29Å; E516-V518 PolarHBondContact O-N 2.61Å; E516-M519 PolarHBondContact O-N 3.06Å; E516-E520 WeakPolarHBondContact O-CG 3.31Å; E516-E520 PolarHBondContact O-N 3.18Å; E516-M543 HydrophobicContact CB-CE 4.28Å; E516-M543 HydrophobicContact CG-CE 3.65Å
517	S	88.4	Confident	94	Very high	24 Å²	24	32 Å²	32	17%	0.168	16%	0.161	C	C	.	.	H	α-helix	trans	-68.1	-33.5	-176.9	-53.2	0	0	0	0	113.5	R491 A514 P515 R521	R491-S517 WeakPolarHBondContact O-CB 3.25Å; A514-S517 PolarHBondContact O-N 3.37Å; P515-S517 PolarHBondContact O-N 3.32Å; S517-R521 PolarHBondContact O-NE 3.3Å; S517-R521 PolarHBondContact O-NH2 3.49Å
518	V	94.3	Very high	93.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-75.7	-40.9	175.8	175.2	0	0	0	0	110.2	A514 P515 E516 E520 R521 C522 A560 A562 L588	A514-V518 WeakPolarHBondContact O-CG2 3.44Å; A514-V518 PolarHBondContact O-N 2.82Å; P515-V518 PolarHBondContact O-N 3.32Å; E516-V518 PolarHBondContact O-N 2.61Å; V518-E520 PolarHBondContact O-N 3.08Å; V518-R521 PolarHBondContact O-N 2.95Å; V518-R521 VanDerWaalsContact O-N 3.14Å; V518-C522 PolarHBondContact O-N 2.86Å; V518-C522 PolarHBondContact O-SG 2.96Å; V518-A560 HydrophobicContact CB-CB 3.96Å; V518-A560 HydrophobicContact CG1-CB 4.07Å; V518-A560 HydrophobicContact CG2-CB 4.49Å; V518-A562 HydrophobicContact CG1-CB 3.79Å; V518-L588 HydrophobicContact CG1-CD1 4.41Å
519	M	92.8	Very high	93.7	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-34.5	-177.1	-169.2	69.6	77.1	0	0	112.9	P515 E516 R521 C522 M534 R539 L542 M543 I546 F590	P515-M519 WeakPolarHBondContact O-CB 3.33Å; P515-M519 PolarHBondContact O-N 3.24Å; E516-M519 PolarHBondContact O-N 3.06Å; M519-R521 PolarHBondContact O-N 3.08Å; M519-C522 PolarHBondContact O-N 3.38Å; M519-M534 HydrophobicContact SD-CE 3.87Å; M519-R539 HydrophobicContact CG-CG 3.49Å; M519-R539 VanDerWaalsContact CG-CG 3.49Å; M519-R539 PolarHBondContact O-NE 3.41Å; M519-R539 HydrophobicContact SD-CG 4.22Å; M519-L542 HydrophobicContact CE-CB 3.83Å; M519-L542 HydrophobicContact CE-CD1 3.98Å; M519-L542 HydrophobicContact SD-CD1 4.39Å; M519-M543 HydrophobicContact CB-SD 4.31Å; M519-M543 HydrophobicContact CE-SD 4.48Å; M519-M543 HydrophobicContact CG-CG 4.3Å; M519-M543 HydrophobicContact CG-SD 4.35Å; M519-I546 HydrophobicContact CE-CD1 4.34Å; M519-F590 HydrophobicContact CE-CD2 3.65Å; M519-F590 HydrophobicContact CE-CE1 4.35Å; M519-F590 HydrophobicContact CE-CE2 3.44Å; M519-F590 VanDerWaalsContact CE-CE2 3.44Å; M519-F590 HydrophobicContact CE-CG 4.2Å; M519-F590 HydrophobicContact CE-CZ 3.82Å; M519-F590 HydrophobicContact SD-CD2 3.97Å; M519-F590 HydrophobicContact SD-CE2 4.37Å; M519-F590 HydrophobicContact SD-CG 4.28Å
520	E	92.4	Very high	93.5	Very high	138 Å²	138	37.7 Å²	37.7	65%	0.645	20%	0.204	S	C	*	.	H	α-helix	trans	-59.8	-32.7	173	-78.4	177.1	172.8	0	0	112.9	E516 V518	E516-E520 WeakPolarHBondContact O-CG 3.31Å; E516-E520 PolarHBondContact O-N 3.18Å; V518-E520 PolarHBondContact O-N 3.08Å
521	R	95.3	Very high	93.2	Very high	22 Å²	22	42.6 Å²	42.6	8%	0.083	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-2.4	-179.4	-65	177.2	-73.5	162.4	-1.6	113.6	R491 S493 S517 V518 M519 E585 M586 G587 L588	R491-R521 PolarHBondContact O-NH2 2.9Å; S493-R521 PolarHBondContact OG-NH1 2.7Å; S493-R521 PolarHBondContact OG-NH2 3.18Å; S517-R521 PolarHBondContact O-NE 3.3Å; S517-R521 PolarHBondContact O-NH2 3.49Å; V518-R521 PolarHBondContact O-N 2.95Å; V518-R521 VanDerWaalsContact O-N 3.14Å; M519-R521 PolarHBondContact O-N 3.08Å; R521-E585 WeakPolarHBondContact CB-O 3.08Å; R521-E585 IonicContact CZ-OE2 3.12Å; R521-E585 VanDerWaalsContact NH1-CB 3.3Å; R521-E585 IonicContact NH1-OE2 3.99Å; R521-E585 PolarHBondContact NH1-OE2 2.81Å; R521-E585 IonicContact NH2-OE2 2.79Å; R521-M586 HydrophobicContact CB-SD 4.37Å; R521-M586 HydrophobicContact CG-SD 3.77Å; R521-G587 PolarHBondContact O-N 3Å; R521-L588 HydrophobicContact CB-CD1 4.14Å; R521-L588 HydrophobicContact CB-CG 4.39Å; R521-L588 PolarHBondContact O-N 2.73Å
522	C	96.5	Very high	93.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	117.7	176.1	-67.5	0	0	0	0	111	V518 M519 M534 R539 L588 F590	V518-C522 PolarHBondContact O-N 2.86Å; V518-C522 PolarHBondContact O-SG 2.96Å; M519-C522 PolarHBondContact O-N 3.38Å; C522-M534 HydrophobicContact CB-CE 4.36Å; C522-R539 PolarHBondContact O-NH2 3.06Å; C522-L588 CarbonylContact C-O 3.51Å; C522-L588 VanDerWaalsContact CA-O 3.3Å; C522-L588 WeakPolarHBondContact CA-O 3.38Å; C522-F590 HydrophobicContact CB-CB 4.18Å
523	N	96.3	Very high	92.9	Very high	84 Å²	84	47.3 Å²	47.3	45%	0.449	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-16	172.5	-71.4	-3.9	0	0	0	112	M534 L588	N523-M534 WeakPolarHBondContact O-CB 3.32Å; N523-M534 PolarHBondContact O-N 2.86Å; N523-L588 PolarHBondContact N-O 3.25Å
524	Y	96.6	Very high	92.9	Very high	88 Å²	88	48 Å²	48	35%	0.345	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	159.2	-176.9	-52.5	-79.5	0	0	0	111.4	V532 L588 T589 F590	Y524-V532 CarbonylContact C-O 3.49Å; Y524-V532 WeakPolarHBondContact CA-O 3.44Å; Y524-V532 WeakPolarHBondContact CB-O 3.42Å; Y524-L588 PolarHBondContact N-O 2.75Å; Y524-L588 VanDerWaalsContact N-O 3.12Å; Y524-T589 CarbonylContact O-C 3.58Å; Y524-T589 WeakPolarHBondContact O-CA 3.28Å; Y524-F590 PolarHBondContact O-N 2.87Å
525	L	95.7	Very high	93.1	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.1	171.9	173.9	62.6	0	0	0	108.7	A369 V372 V527 K531 V532 M534 L542 F590	A369-L525 HydrophobicContact CB-CD1 4.07Å; A369-L525 HydrophobicContact CB-CD2 4.18Å; A369-L525 HydrophobicContact CB-CG 4.22Å; V372-L525 HydrophobicContact CG2-CD2 3.89Å; L525-V527 HydrophobicContact CD2-CG2 4.49Å; L525-V527 HydrophobicContact CG-CG2 4.28Å; L525-K531 WeakPolarHBondContact O-CA 3.27Å; L525-V532 HydrophobicContact CB-CG2 3.86Å; L525-V532 HydrophobicContact CD2-CG2 4.36Å; L525-V532 HydrophobicContact CG-CG2 4.32Å; L525-V532 PolarHBondContact N-O 3.21Å; L525-V532 PolarHBondContact O-N 2.83Å; L525-M534 HydrophobicContact CB-CE 3.84Å; L525-M534 HydrophobicContact CB-SD 4.46Å; L525-M534 HydrophobicContact CD1-CE 4.27Å; L525-L542 HydrophobicContact CD1-CD1 4.22Å; L525-F590 HydrophobicContact CD1-CB 4.24Å; L525-F590 HydrophobicContact CD1-CD1 3.57Å; L525-F590 HydrophobicContact CD1-CE1 4.45Å; L525-F590 HydrophobicContact CD1-CG 4.38Å
526	R	96.3	Very high	93.1	Very high	18 Å²	18	53.1 Å²	53.1	7%	0.068	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.2	173.5	-173.7	70.4	69.1	-145.3	-9.9	109.8	A369 E412 G528 T530 T563 D565 T589 F590	A369-R526 WeakPolarHBondContact CB-O 3.37Å; E412-R526 IonicContact OE1-NE 2.71Å; E412-R526 IonicContact OE1-NH2 3.64Å; E412-R526 PolarHBondContact OE1-NH2 3.09Å; E412-R526 WeakPolarHBondContact OE2-CD 3.46Å; E412-R526 WeakPolarHBondContact OE2-CG 3.38Å; E412-R526 IonicContact OE2-CZ 3.89Å; E412-R526 IonicContact OE2-NE 2.8Å; E412-R526 PolarHBondContact OE2-NE 2.86Å; E412-R526 IonicContact OE2-NH2 3.02Å; R526-G528 WeakPolarHBondContact CD-O 3.42Å; R526-G528 VanDerWaalsContact CG-O 3.31Å; R526-G528 WeakPolarHBondContact CG-O 3.41Å; R526-T530 WeakPolarHBondContact CD-O 3.36Å; R526-T563 PolarHBondContact NH2-OG1 3.39Å; R526-T563 VanDerWaalsContact NH2-OG1 3.13Å; R526-D565 IonicContact CZ-OD1 2.81Å; R526-D565 IonicContact CZ-OD2 3.82Å; R526-D565 IonicContact NH1-OD2 2.66Å; R526-D565 PolarHBondContact NH1-OD2 3.4Å; R526-D565 IonicContact NH2-OD1 3.72Å; R526-D565 PolarHBondContact NH2-OD1 3.5Å; R526-D565 IonicContact NH2-OD2 3.12Å; R526-D565 PolarHBondContact NH2-OD2 2.95Å; R526-T589 HydrophobicContact CB-CG2 3.99Å; R526-F590 WeakPolarHBondContact CB-O 3.25Å; R526-F590 PolarHBondContact N-O 2.91Å
527	V	93.6	Very high	93.2	Very high	17 Å²	17	49.8 Å²	49.8	10%	0.103	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	100.9	175	-174.1	0	0	0	0	107.9	A369 D370 V372 L525 T529 T530 V532	A369-V527 HydrophobicContact CB-CG2 4.24Å; D370-V527 WeakPolarHBondContact O-CG1 3.34Å; V372-V527 HydrophobicContact CG2-CG2 3.74Å; L525-V527 HydrophobicContact CD2-CG2 4.49Å; L525-V527 HydrophobicContact CG-CG2 4.28Å; V527-T529 PolarHBondContact O-N 2.84Å; V527-T530 PolarHBondContact N-O 2.86Å; V527-T530 PolarHBondContact O-N 3.46Å; V527-T530 PolarHBondContact O-OG1 2.94Å; V527-V532 HydrophobicContact CG2-CG1 4.37Å; V527-V532 HydrophobicContact CG2-CG2 3.88Å
528	G	90	Very high	93.3	Very high	25 Å²	25	48.7 Å²	48.7	26%	0.258	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	-117	-166.5	0	0	0	0	0	111.1	R526	R526-G528 WeakPolarHBondContact CD-O 3.42Å; R526-G528 VanDerWaalsContact CG-O 3.31Å; R526-G528 WeakPolarHBondContact CG-O 3.41Å
529	T	89.7	Confident	93.2	Very high	106 Å²	106	52.2 Å²	52.2	65%	0.65	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-11.5	174.2	52.9	0	0	0	0	113.8	D408 V527	D408-T529 HydrophobicContact CB-CG2 3.92Å; V527-T529 PolarHBondContact O-N 2.84Å
530	T	92.3	Very high	93.2	Very high	80 Å²	80	56.9 Å²	56.9	49%	0.491	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	160.1	-176.7	68.6	0	0	0	0	111.8	R526 V527	R526-T530 WeakPolarHBondContact CD-O 3.36Å; V527-T530 PolarHBondContact N-O 2.86Å; V527-T530 PolarHBondContact O-N 3.46Å; V527-T530 PolarHBondContact O-OG1 2.94Å
531	K	91.7	Very high	93.2	Very high	108 Å²	108	53.9 Å²	53.9	47%	0.47	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.5	172.6	67.8	177.4	-175.9	176.5	0	110.6	L525 T589	L525-K531 WeakPolarHBondContact O-CA 3.27Å; K531-T589 HydrophobicContact CB-CG2 4.5Å
532	V	93.8	Very high	93.1	Very high	46 Å²	46	52.9 Å²	52.9	28%	0.279	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	155.8	174.7	-58.7	0	0	0	0	110	V372 Y524 L525 V527	V372-V532 HydrophobicContact CB-CG2 4.5Å; V372-V532 HydrophobicContact CG2-CG2 4.11Å; Y524-V532 CarbonylContact C-O 3.49Å; Y524-V532 WeakPolarHBondContact CA-O 3.44Å; Y524-V532 WeakPolarHBondContact CB-O 3.42Å; L525-V532 HydrophobicContact CB-CG2 3.86Å; L525-V532 HydrophobicContact CD2-CG2 4.36Å; L525-V532 HydrophobicContact CG-CG2 4.32Å; L525-V532 PolarHBondContact N-O 3.21Å; L525-V532 PolarHBondContact O-N 2.83Å; V527-V532 HydrophobicContact CG2-CG1 4.37Å; V527-V532 HydrophobicContact CG2-CG2 3.88Å
533	A	93.9	Very high	92.9	Very high	66 Å²	66	53.7 Å²	53.7	55%	0.545	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	136.4	178.1	0	0	0	0	0	111	T535	A533-T535 PolarHBondContact O-N 3.42Å
534	M	93.1	Very high	92.7	Very high	19 Å²	19	53.3 Å²	53.3	9%	0.094	30%	0.302	C	S	.	.			trans	-77.7	106.1	177.7	-174.8	67.5	76.6	0	0	109.8	M519 C522 N523 L525 L538 R539 L542 F590	M519-M534 HydrophobicContact SD-CE 3.87Å; C522-M534 HydrophobicContact CB-CE 4.36Å; N523-M534 WeakPolarHBondContact O-CB 3.32Å; N523-M534 PolarHBondContact O-N 2.86Å; L525-M534 HydrophobicContact CB-CE 3.84Å; L525-M534 HydrophobicContact CB-SD 4.46Å; L525-M534 HydrophobicContact CD1-CE 4.27Å; M534-L538 HydrophobicContact SD-CB 4.16Å; M534-R539 HydrophobicContact CG-CB 4.32Å; M534-R539 HydrophobicContact SD-CB 4.27Å; M534-L542 HydrophobicContact CE-CD1 4.11Å; M534-L542 HydrophobicContact SD-CD1 4.3Å; M534-F590 HydrophobicContact CE-CB 3.72Å; M534-F590 HydrophobicContact CE-CG 4.36Å
535	T	92.4	Very high	92.4	Very high	47 Å²	47	50.6 Å²	50.6	29%	0.288	29%	0.292	S	S	.	.			trans	-84.8	156.5	174	70.2	0	0	0	0	111	A533 A537 L538 R539	A533-T535 PolarHBondContact O-N 3.42Å; T535-A537 VanDerWaalsContact C-N 3.26Å; T535-A537 PolarHBondContact O-N 3.21Å; T535-L538 HydrophobicContact CG2-CD1 4.43Å; T535-L538 PolarHBondContact O-N 3.36Å; T535-L538 VanDerWaalsContact OG1-CG 3.28Å; T535-L538 WeakPolarHBondContact OG1-CG 3.39Å; T535-L538 PolarHBondContact OG1-N 2.77Å; T535-R539 PolarHBondContact O-N 2.8Å
536	P	91.1	Very high	92.2	Very high	104 Å²	104	51 Å²	51	68%	0.675	29%	0.294	S	S	*	.	H	α-helix	trans	-57.6	-36.2	176.5	-26.4	35.2	0	0	0	113.7	R539 E540	P536-R539 PolarHBondContact O-N 2.77Å; P536-E540 PolarHBondContact O-N 3.47Å
537	A	90.4	Very high	91.7	Very high	51 Å²	51	55.4 Å²	55.4	42%	0.421	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-44.6	177.4	0	0	0	0	0	111.9	T535 E540 Q541	T535-A537 VanDerWaalsContact C-N 3.26Å; T535-A537 PolarHBondContact O-N 3.21Å; A537-E540 PolarHBondContact O-N 2.94Å; A537-Q541 WeakPolarHBondContact O-CB 3.27Å; A537-Q541 PolarHBondContact O-N 3.34Å
538	L	91.2	Very high	91.5	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-62.7	-44.3	175.3	-71.8	176.4	0	0	0	111.6	V372 C377 M534 T535 E540 Q541 L542	V372-L538 HydrophobicContact CG1-CD1 3.89Å; V372-L538 HydrophobicContact CG1-CD2 4.24Å; C377-L538 HydrophobicContact CB-CD2 3.57Å; M534-L538 HydrophobicContact SD-CB 4.16Å; T535-L538 HydrophobicContact CG2-CD1 4.43Å; T535-L538 PolarHBondContact O-N 3.36Å; T535-L538 VanDerWaalsContact OG1-CG 3.28Å; T535-L538 WeakPolarHBondContact OG1-CG 3.39Å; T535-L538 PolarHBondContact OG1-N 2.77Å; L538-E540 VanDerWaalsContact C-N 3.34Å; L538-E540 PolarHBondContact O-N 3.06Å; L538-Q541 PolarHBondContact O-N 3.42Å; L538-L542 WeakPolarHBondContact O-CG 3.46Å; L538-L542 PolarHBondContact O-N 3.19Å
539	R	93.1	Very high	91.4	Very high	74 Å²	74	58.7 Å²	58.7	28%	0.279	32%	0.318	S	S	.	.	H	α-helix	trans	-57.1	-48.6	177.2	-174.5	178.1	-69.3	139.2	-1.6	111.2	M519 C522 M534 T535 P536 L542 M543	M519-R539 HydrophobicContact CG-CG 3.49Å; M519-R539 VanDerWaalsContact CG-CG 3.49Å; M519-R539 PolarHBondContact O-NE 3.41Å; M519-R539 HydrophobicContact SD-CG 4.22Å; C522-R539 PolarHBondContact O-NH2 3.06Å; M534-R539 HydrophobicContact CG-CB 4.32Å; M534-R539 HydrophobicContact SD-CB 4.27Å; T535-R539 PolarHBondContact O-N 2.8Å; P536-R539 PolarHBondContact O-N 2.77Å; R539-L542 PolarHBondContact O-N 2.99Å; R539-M543 WeakPolarHBondContact O-CB 3.41Å; R539-M543 WeakPolarHBondContact O-CG 3.19Å; R539-M543 PolarHBondContact O-N 2.81Å
540	E	92.4	Very high	90.9	Very high	100 Å²	100	55 Å²	55	47%	0.467	30%	0.301	S	S	.	.	H	α-helix	trans	-65.1	-41.9	-179.8	-174.3	59.8	-164.7	0	0	111.7	P536 A537 L538 L542 M543 V544 R547	P536-E540 PolarHBondContact O-N 3.47Å; A537-E540 PolarHBondContact O-N 2.94Å; L538-E540 VanDerWaalsContact C-N 3.34Å; L538-E540 PolarHBondContact O-N 3.06Å; E540-L542 PolarHBondContact O-N 3.28Å; E540-M543 PolarHBondContact O-N 3.36Å; E540-V544 HydrophobicContact CG-CG2 4.48Å; E540-V544 WeakPolarHBondContact O-CG2 3.47Å; E540-V544 PolarHBondContact O-N 2.99Å; E540-R547 IonicContact OE1-CZ 3.8Å; E540-R547 IonicContact OE1-NH2 2.68Å; E540-R547 PolarHBondContact OE1-NH2 3.47Å; E540-R547 IonicContact OE2-NH2 3.55Å
541	Q	92.1	Very high	90.1	Very high	74 Å²	74	56.8 Å²	56.8	35%	0.346	31%	0.312	S	S	.	.	H	α-helix	trans	-58	-46.5	176.9	-170.5	-170.2	-8.3	0	0	112.1	C377 A537 L538 V544 K545	C377-Q541 PolarHBondContact O-NE2 3.31Å; A537-Q541 WeakPolarHBondContact O-CB 3.27Å; A537-Q541 PolarHBondContact O-N 3.34Å; L538-Q541 PolarHBondContact O-N 3.42Å; Q541-V544 PolarHBondContact O-N 3.44Å; Q541-K545 PolarHBondContact O-N 3.45Å
542	L	93.3	Very high	89.2	Confident	1 Å²	1	53 Å²	53	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-63.4	-42.8	176.6	-66.3	171.8	0	0	0	111.5	F367 L379 M519 L525 M534 L538 R539 E540 V544 K545 I546 F590	F367-L542 HydrophobicContact CE2-CD2 3.84Å; F367-L542 HydrophobicContact CZ-CD2 4.36Å; L379-L542 HydrophobicContact CD1-CD2 4.28Å; L379-L542 HydrophobicContact CD2-CD2 3.69Å; M519-L542 HydrophobicContact CE-CB 3.83Å; M519-L542 HydrophobicContact CE-CD1 3.98Å; M519-L542 HydrophobicContact SD-CD1 4.39Å; L525-L542 HydrophobicContact CD1-CD1 4.22Å; M534-L542 HydrophobicContact CE-CD1 4.11Å; M534-L542 HydrophobicContact SD-CD1 4.3Å; L538-L542 WeakPolarHBondContact O-CG 3.46Å; L538-L542 PolarHBondContact O-N 3.19Å; R539-L542 PolarHBondContact O-N 2.99Å; E540-L542 PolarHBondContact O-N 3.28Å; L542-V544 PolarHBondContact O-N 2.91Å; L542-K545 PolarHBondContact O-N 2.86Å; L542-I546 WeakPolarHBondContact O-CD1 3.5Å; L542-I546 WeakPolarHBondContact O-CG1 3.28Å; L542-I546 PolarHBondContact O-N 3.48Å; L542-F590 HydrophobicContact CD1-CD1 4.12Å; L542-F590 HydrophobicContact CD1-CE1 4.11Å; L542-F590 HydrophobicContact CD2-CE1 4.48Å
543	M	92.4	Very high	88.1	Confident	17 Å²	17	57.1 Å²	57.1	8%	0.084	32%	0.318	C	S	.	.	H	α-helix	trans	-67	-32.6	178.8	-77.9	-56.7	-62.1	0	0	113.3	P515 E516 M519 R539 E540 I546 R547	P515-M543 HydrophobicContact CB-SD 4.38Å; E516-M543 HydrophobicContact CB-CE 4.28Å; E516-M543 HydrophobicContact CG-CE 3.65Å; M519-M543 HydrophobicContact CB-SD 4.31Å; M519-M543 HydrophobicContact CE-SD 4.48Å; M519-M543 HydrophobicContact CG-CG 4.3Å; M519-M543 HydrophobicContact CG-SD 4.35Å; R539-M543 WeakPolarHBondContact O-CB 3.41Å; R539-M543 WeakPolarHBondContact O-CG 3.19Å; R539-M543 PolarHBondContact O-N 2.81Å; E540-M543 PolarHBondContact O-N 3.36Å; M543-I546 HydrophobicContact SD-CD1 4.25Å; M543-R547 WeakPolarHBondContact O-CB 3.3Å; M543-R547 WeakPolarHBondContact O-CG 3.45Å; M543-R547 PolarHBondContact O-N 3.15Å; M543-R547 PolarHBondContact O-NE 3.18Å
544	V	92.1	Very high	87.1	Confident	76 Å²	76	55.7 Å²	55.7	46%	0.461	30%	0.301	S	S	.	.	H	α-helix	trans	-63.5	-45.3	172	168.3	0	0	0	0	110.4	E540 Q541 L542 I546 R547 E548	E540-V544 HydrophobicContact CG-CG2 4.48Å; E540-V544 WeakPolarHBondContact O-CG2 3.47Å; E540-V544 PolarHBondContact O-N 2.99Å; Q541-V544 PolarHBondContact O-N 3.44Å; L542-V544 PolarHBondContact O-N 2.91Å; V544-I546 PolarHBondContact O-N 3.23Å; V544-R547 PolarHBondContact O-N 3.37Å; V544-E548 PolarHBondContact O-N 3.15Å
545	K	90.6	Very high	86.5	Confident	32 Å²	32	55.5 Å²	55.5	14%	0.139	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-42.1	177.7	-171.5	71.8	-164.9	-177	0	112.5	F367 L379 E381 Q541 L542 R547 E548 W549	F367-K545 HydrophobicContact CD1-CG 4.31Å; F367-K545 HydrophobicContact CE1-CG 4.14Å; L379-K545 HydrophobicContact CD1-CB 4.46Å; L379-K545 HydrophobicContact CD1-CG 4.16Å; E381-K545 WeakPolarHBondContact OE1-CE 3.31Å; E381-K545 IonicContact OE1-NZ 2.94Å; E381-K545 PolarHBondContact OE1-NZ 2.77Å; E381-K545 WeakPolarHBondContact OE2-CE 3.36Å; E381-K545 IonicContact OE2-NZ 3.18Å; E381-K545 PolarHBondContact OE2-NZ 2.66Å; Q541-K545 PolarHBondContact O-N 3.45Å; L542-K545 PolarHBondContact O-N 2.86Å; K545-R547 VanDerWaalsContact C-N 3.35Å; K545-E548 WeakPolarHBondContact CD-OE2 3.39Å; K545-E548 IonicContact NZ-OE2 3.81Å; K545-E548 PolarHBondContact NZ-OE2 3.39Å; K545-E548 WeakPolarHBondContact O-CB 3.49Å; K545-E548 PolarHBondContact O-N 3.43Å; K545-W549 PolarHBondContact O-N 3.33Å; K545-W549 VanDerWaalsContact O-N 3.13Å
546	I	90.6	Very high	86.2	Confident	9 Å²	9	53.8 Å²	53.8	5%	0.046	29%	0.29	C	S	.	.	H	α-helix	trans	-65.5	-40.3	177.6	-67.5	162.7	0	0	0	110.9	F367 P515 M519 L542 M543 V544 W549 G550 C558 C593	F367-I546 HydrophobicContact CE1-CG1 3.83Å; F367-I546 HydrophobicContact CZ-CD1 4.05Å; F367-I546 HydrophobicContact CZ-CG1 3.84Å; P515-I546 HydrophobicContact CB-CD1 4.13Å; P515-I546 HydrophobicContact CB-CG2 3.8Å; P515-I546 HydrophobicContact CG-CG2 3.78Å; M519-I546 HydrophobicContact CE-CD1 4.34Å; L542-I546 WeakPolarHBondContact O-CD1 3.5Å; L542-I546 WeakPolarHBondContact O-CG1 3.28Å; L542-I546 PolarHBondContact O-N 3.48Å; M543-I546 HydrophobicContact SD-CD1 4.25Å; V544-I546 PolarHBondContact O-N 3.23Å; I546-W549 PolarHBondContact O-N 2.99Å; I546-G550 PolarHBondContact O-N 3.33Å; I546-C558 HydrophobicContact CG2-CB 3.84Å; I546-C593 HydrophobicContact CD1-CB 4.4Å; I546-C593 HydrophobicContact CG1-CB 4.33Å
547	R	86.6	Confident	86	Confident	109 Å²	109	54.5 Å²	54.5	41%	0.411	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-43.6	173.3	-80	-179.2	-79.1	178.3	-4.9	111.5	E540 M543 V544 K545 W549 G550 T551	E540-R547 IonicContact OE1-CZ 3.8Å; E540-R547 IonicContact OE1-NH2 2.68Å; E540-R547 PolarHBondContact OE1-NH2 3.47Å; E540-R547 IonicContact OE2-NH2 3.55Å; M543-R547 WeakPolarHBondContact O-CB 3.3Å; M543-R547 WeakPolarHBondContact O-CG 3.45Å; M543-R547 PolarHBondContact O-N 3.15Å; M543-R547 PolarHBondContact O-NE 3.18Å; V544-R547 PolarHBondContact O-N 3.37Å; K545-R547 VanDerWaalsContact C-N 3.35Å; R547-W549 VanDerWaalsContact C-N 3.29Å; R547-W549 PolarHBondContact O-N 2.98Å; R547-G550 PolarHBondContact O-N 3.06Å; R547-G550 VanDerWaalsContact O-N 3.08Å; R547-T551 PolarHBondContact O-N 2.87Å; R547-T551 PolarHBondContact O-OG1 3.27Å
548	E	88.6	Confident	86.1	Confident	107 Å²	107	52.9 Å²	52.9	50%	0.5	27%	0.265	S	S	.	.	H	α-helix	trans	-53.3	-45.3	174.6	-171.1	-165	169.6	0	0	111.7	V544 K545 G552	V544-E548 PolarHBondContact O-N 3.15Å; K545-E548 WeakPolarHBondContact CD-OE2 3.39Å; K545-E548 IonicContact NZ-OE2 3.81Å; K545-E548 PolarHBondContact NZ-OE2 3.39Å; K545-E548 WeakPolarHBondContact O-CB 3.49Å; K545-E548 PolarHBondContact O-N 3.43Å; E548-G552 WeakPolarHBondContact O-CA 3.23Å; E548-G552 PolarHBondContact O-N 3.44Å
549	W	88.3	Confident	86.3	Confident	5 Å²	5	53.8 Å²	53.8	2%	0.019	27%	0.269	C	S	.	.	H	α-helix	trans	-67.3	-39.6	176.2	-73.6	4.8	0	0	0	113.1	R365 F367 K545 I546 R547 T555 L556	R365-W549 HydrophobicContact CB-CD2 4.22Å; R365-W549 HydrophobicContact CB-CE3 4.05Å; R365-W549 HydrophobicContact CB-CH2 3.47Å; R365-W549 VanDerWaalsContact CB-CH2 3.47Å; R365-W549 HydrophobicContact CB-CZ2 3.67Å; R365-W549 HydrophobicContact CB-CZ3 3.69Å; R365-W549 HydrophobicContact CG-CZ2 4.31Å; F367-W549 HydrophobicContact CB-CH2 4.09Å; F367-W549 HydrophobicContact CD1-CE3 4.42Å; F367-W549 AromaticContact CD1-CH2 3.42Å; F367-W549 HydrophobicContact CD1-CH2 3.42Å; F367-W549 VanDerWaalsContact CD1-CH2 3.42Å; F367-W549 AromaticContact CD1-CZ2 3.89Å; F367-W549 HydrophobicContact CD1-CZ2 3.89Å; F367-W549 AromaticContact CD1-CZ3 3.72Å; F367-W549 HydrophobicContact CD1-CZ3 3.72Å; F367-W549 HydrophobicContact CE1-CH2 4.32Å; F367-W549 HydrophobicContact CE1-CZ3 4.23Å; F367-W549 HydrophobicContact CG-CH2 4.21Å; K545-W549 PolarHBondContact O-N 3.33Å; K545-W549 VanDerWaalsContact O-N 3.13Å; I546-W549 PolarHBondContact O-N 2.99Å; R547-W549 VanDerWaalsContact C-N 3.29Å; R547-W549 PolarHBondContact O-N 2.98Å; W549-T555 CarbonylContact O-C 3.55Å; W549-T555 WeakPolarHBondContact O-CA 3.5Å; W549-T555 PolarHBondContact O-N 2.7Å; W549-T555 VanDerWaalsContact O-N 3.14Å; W549-L556 HydrophobicContact CB-CB 4.47Å; W549-L556 HydrophobicContact CB-CD1 4.23Å; W549-L556 HydrophobicContact CD2-CD1 4.27Å; W549-L556 HydrophobicContact CE3-CD1 4.3Å; W549-L556 HydrophobicContact CG-CD1 4.27Å; W549-L556 PolarHBondContact O-N 3.23Å
550	G	78.9	Confident	86.4	Confident	28 Å²	28	50.2 Å²	50.2	29%	0.289	26%	0.256	S	S	.	.	H	α-helix	trans	-73.7	-32.4	-177.8	0	0	0	0	0	114.7	I546 R547	I546-G550 PolarHBondContact O-N 3.33Å; R547-G550 PolarHBondContact O-N 3.06Å; R547-G550 VanDerWaalsContact O-N 3.08Å
551	T	74.5	Confident	86.7	Confident	118 Å²	118	45.5 Å²	45.5	72%	0.724	23%	0.234	S	C	*	.	H	α-helix	trans	-117.5	-10.2	-174.5	58	0	0	0	0	114.4	R547	R547-T551 PolarHBondContact O-N 2.87Å; R547-T551 PolarHBondContact O-OG1 3.27Å
552	G	73.1	Confident	87	Confident	29 Å²	29	42 Å²	42	30%	0.299	22%	0.217	S	C	.	.	S	Bend	trans	-81.5	-163.5	179.2	0	0	0	0	0	113.5	E548 D554 T555	E548-G552 WeakPolarHBondContact O-CA 3.23Å; E548-G552 PolarHBondContact O-N 3.44Å; G552-D554 PolarHBondContact O-N 3.25Å; G552-D554 VanDerWaalsContact O-N 3.1Å; G552-T555 WeakPolarHBondContact O-CG2 3.43Å; G552-T555 PolarHBondContact O-N 3.46Å
553	K	70.9	Confident	87.2	Confident	131 Å²	131	41.9 Å²	41.9	57%	0.57	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-24.9	-179.4	-69	-168.7	175.3	-168.3	0	113.6	E641 E642	K553-E641 IonicContact NZ-OE2 3.38Å; K553-E641 PolarHBondContact NZ-OE2 3.35Å; K553-E642 IonicContact NZ-OE1 3.69Å; K553-E642 PolarHBondContact NZ-OE1 3.46Å
554	D	73.6	Confident	87.4	Confident	36 Å²	36	42.1 Å²	42.1	19%	0.193	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-30.4	-177.3	-70.4	-29.7	0	0	0	113	R365 G552 L556	R365-D554 IonicContact CZ-OD2 3.77Å; R365-D554 IonicContact NE-OD2 3.59Å; R365-D554 PolarHBondContact NE-OD2 2.95Å; R365-D554 IonicContact NH2-OD1 2.58Å; R365-D554 IonicContact NH2-OD2 2.63Å; R365-D554 PolarHBondContact NH2-OD2 3.07Å; G552-D554 PolarHBondContact O-N 3.25Å; G552-D554 VanDerWaalsContact O-N 3.1Å; D554-L556 VanDerWaalsContact C-N 3.33Å; D554-L556 HydrophobicContact CB-CD1 4Å; D554-L556 HydrophobicContact CB-CD2 4.08Å; D554-L556 HydrophobicContact CB-CG 3.71Å; D554-L556 WeakPolarHBondContact O-CD2 3.06Å; D554-L556 PolarHBondContact O-N 3.3Å
555	T	79.8	Confident	87.4	Confident	16 Å²	16	39.5 Å²	39.5	10%	0.098	20%	0.201	C	C	.	.			trans	40.9	51.8	-177.7	52.7	0	0	0	0	115.2	W549 G552 A631	W549-T555 CarbonylContact O-C 3.55Å; W549-T555 WeakPolarHBondContact O-CA 3.5Å; W549-T555 PolarHBondContact O-N 2.7Å; W549-T555 VanDerWaalsContact O-N 3.14Å; G552-T555 WeakPolarHBondContact O-CG2 3.43Å; G552-T555 PolarHBondContact O-N 3.46Å; T555-A631 HydrophobicContact CG2-CB 3.25Å; T555-A631 WeakPolarHBondContact OG1-CB 3.19Å
556	L	86.4	Confident	87.4	Confident	10 Å²	10	42.3 Å²	42.3	5%	0.052	22%	0.221	C	C	.	.			trans	-83.7	142.4	-173.6	-53.9	177.4	0	0	0	112.1	R365 W549 D554 C558 M596 L597	R365-L556 HydrophobicContact CB-CD1 3.74Å; R365-L556 HydrophobicContact CG-CD1 3.46Å; R365-L556 VanDerWaalsContact CG-CD1 3.46Å; W549-L556 HydrophobicContact CB-CB 4.47Å; W549-L556 HydrophobicContact CB-CD1 4.23Å; W549-L556 HydrophobicContact CD2-CD1 4.27Å; W549-L556 HydrophobicContact CE3-CD1 4.3Å; W549-L556 HydrophobicContact CG-CD1 4.27Å; W549-L556 PolarHBondContact O-N 3.23Å; D554-L556 VanDerWaalsContact C-N 3.33Å; D554-L556 HydrophobicContact CB-CD1 4Å; D554-L556 HydrophobicContact CB-CD2 4.08Å; D554-L556 HydrophobicContact CB-CG 3.71Å; D554-L556 WeakPolarHBondContact O-CD2 3.06Å; D554-L556 PolarHBondContact O-N 3.3Å; L556-C558 PolarHBondContact O-N 3.26Å; L556-C558 PolarHBondContact O-SG 3.19Å; L556-M596 WeakPolarHBondContact CA-O 3.04Å; L556-L597 HydrophobicContact CD2-CB 3.89Å; L556-L597 HydrophobicContact CD2-CD2 3.45Å; L556-L597 VanDerWaalsContact CD2-CD2 3.45Å; L556-L597 HydrophobicContact CD2-CG 4.28Å
557	R	87.8	Confident	87.6	Confident	119 Å²	119	42.8 Å²	42.8	45%	0.449	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	108.8	160.3	-179.6	175.4	-178.8	151.4	-2.7	108.6	M596	R557-M596 HydrophobicContact CB-CG 3.9Å; R557-M596 HydrophobicContact CG-CG 4.29Å; R557-M596 PolarHBondContact N-O 3.28Å; R557-M596 WeakPolarHBondContact O-CG 3.46Å; R557-M596 PolarHBondContact O-N 3.27Å
558	C	91.3	Very high	87.8	Confident	17 Å²	17	39.8 Å²	39.8	12%	0.115	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	135.8	-177.9	-62.5	0	0	0	0	111.7	P515 I546 L556 V594	P515-C558 WeakPolarHBondContact CD-O 3.41Å; P515-C558 HydrophobicContact CG-CB 4.03Å; I546-C558 HydrophobicContact CG2-CB 3.84Å; L556-C558 PolarHBondContact O-N 3.26Å; L556-C558 PolarHBondContact O-SG 3.19Å; C558-V594 CarbonylContact C-O 3.59Å; C558-V594 WeakPolarHBondContact CA-O 3.49Å
559	L	95.3	Very high	87.8	Confident	21 Å²	21	42.1 Å²	42.1	11%	0.11	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129.8	169.7	-74.8	176	0	0	0	109.9	T441 L445 G513 C593 V594 M596	T441-L559 HydrophobicContact CG2-CD1 3.82Å; L445-L559 HydrophobicContact CD1-CD1 4.34Å; G513-L559 WeakPolarHBondContact O-CD2 3.46Å; L559-C593 WeakPolarHBondContact O-CA 3.46Å; L559-C593 PolarHBondContact O-SG 2.68Å; L559-V594 HydrophobicContact CB-CG2 3.89Å; L559-V594 PolarHBondContact N-O 2.86Å; L559-V594 PolarHBondContact O-N 3.25Å; L559-M596 HydrophobicContact CD1-CE 3.72Å; L559-M596 HydrophobicContact CG-CE 4.36Å
560	A	96.9	Very high	87.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	139.3	169.3	0	0	0	0	0	110	K512 G513 P515 V518 F590	K512-A560 WeakPolarHBondContact CA-O 3.47Å; G513-A560 PolarHBondContact N-O 3.21Å; G513-A560 VanDerWaalsContact N-O 3.07Å; G513-A560 PolarHBondContact O-N 2.72Å; P515-A560 HydrophobicContact CB-CB 4.25Å; P515-A560 HydrophobicContact CG-CB 4.46Å; V518-A560 HydrophobicContact CB-CB 3.96Å; V518-A560 HydrophobicContact CG1-CB 4.07Å; V518-A560 HydrophobicContact CG2-CB 4.49Å; A560-F590 HydrophobicContact CB-CE2 3.83Å
561	L	98	Very high	88.1	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.2	179.9	-57.4	174.4	0	0	0	108.5	L413 V416 C417 K512 V591 G592 V594	L413-L561 HydrophobicContact CD1-CD1 4.23Å; L413-L561 HydrophobicContact CD2-CD1 4.02Å; L413-L561 HydrophobicContact CG-CD1 3.67Å; V416-L561 HydrophobicContact CB-CB 4.43Å; V416-L561 HydrophobicContact CG1-CB 4.05Å; V416-L561 HydrophobicContact CG1-CD2 3.8Å; V416-L561 HydrophobicContact CG1-CG 4.41Å; C417-L561 VanDerWaalsContact SG-CD1 3.55Å; K512-L561 HydrophobicContact CB-CD2 3.59Å; L561-V591 WeakPolarHBondContact O-CB 3.38Å; L561-V591 PolarHBondContact O-N 3.46Å; L561-G592 PolarHBondContact N-O 3.46Å; L561-G592 PolarHBondContact O-N 2.76Å; L561-V594 HydrophobicContact CD1-CG1 3.84Å; L561-V594 HydrophobicContact CD1-CG2 4.26Å
562	A	97.9	Very high	88.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	162.6	-176.4	0	0	0	0	0	111.3	I511 V518 L588 T589	I511-A562 HydrophobicContact CB-CB 4.39Å; I511-A562 WeakPolarHBondContact CD1-O 3.44Å; I511-A562 PolarHBondContact N-O 3.29Å; I511-A562 PolarHBondContact O-N 2.62Å; V518-A562 HydrophobicContact CG1-CB 3.79Å; A562-L588 HydrophobicContact CB-CB 4.25Å; A562-L588 HydrophobicContact CB-CD1 4.27Å; A562-T589 CarbonylContact C-O 3.55Å; A562-T589 VanDerWaalsContact CA-O 3.25Å; A562-T589 WeakPolarHBondContact CA-O 3.39Å; A562-T589 WeakPolarHBondContact CB-O 3.45Å
563	T	97.4	Very high	89.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.5	172.5	66.5	0	0	0	0	111.2	E412 V416 M509 F510 R526 D565 T589 V591	E412-T563 HydrophobicContact CG-CG2 3.96Å; E412-T563 WeakPolarHBondContact OE1-CG2 3.19Å; V416-T563 HydrophobicContact CG2-CG2 3.97Å; M509-T563 CarbonylContact O-C 3.49Å; M509-T563 VanDerWaalsContact O-CA 3.31Å; M509-T563 WeakPolarHBondContact O-CA 3.5Å; F510-T563 HydrophobicContact CD1-CG2 3.66Å; F510-T563 HydrophobicContact CE1-CG2 3.98Å; R526-T563 PolarHBondContact NH2-OG1 3.39Å; R526-T563 VanDerWaalsContact NH2-OG1 3.13Å; T563-D565 PolarHBondContact OG1-OD1 3.29Å; T563-D565 VanDerWaalsContact OG1-OD1 3.05Å; T563-T589 PolarHBondContact N-O 3.25Å; T563-T589 PolarHBondContact O-N 3.28Å; T563-V591 HydrophobicContact CG2-CG2 3.75Å
564	H	96.3	Very high	90	Very high	21 Å²	21	46 Å²	46	10%	0.097	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	110.3	161.1	-161	-42.4	0	0	0	107.6	M509 I511 T566 P567 Y584 M586 L588	M509-H564 HydrophobicContact CB-CB 3.84Å; M509-H564 PolarHBondContact N-O 2.7Å; M509-H564 VanDerWaalsContact N-O 3.12Å; M509-H564 PolarHBondContact O-N 2.87Å; I511-H564 HydrophobicContact CD1-CB 4.17Å; I511-H564 VanDerWaalsContact CD1-N 3.34Å; H564-T566 PolarHBondContact CE1-O 3.07Å; H564-T566 VanDerWaalsContact ND1-C 3.28Å; H564-T566 PolarHBondContact ND1-N 2.99Å; H564-T566 PolarHBondContact ND1-O 2.81Å; H564-P567 HydrophobicContact CB-CB 4.42Å; H564-Y584 PolarHBondContact CD2-O 3.08Å; H564-M586 PolarHBondContact CD2-O 2.69Å; H564-M586 PolarHBondContact NE2-O 2.61Å; H564-M586 VanDerWaalsContact NE2-O 3.1Å; H564-L588 HydrophobicContact CB-CD2 3.86Å
565	D	92.9	Very high	90.4	Very high	21 Å²	21	47.5 Å²	47.5	11%	0.112	23%	0.232	C	C	.	.	S	Bend	trans	-73.5	-33.5	-173.5	-70.6	-30.1	0	0	0	113	R526 T563 T589	R526-D565 IonicContact CZ-OD1 2.81Å; R526-D565 IonicContact CZ-OD2 3.82Å; R526-D565 IonicContact NH1-OD2 2.66Å; R526-D565 PolarHBondContact NH1-OD2 3.4Å; R526-D565 IonicContact NH2-OD1 3.72Å; R526-D565 PolarHBondContact NH2-OD1 3.5Å; R526-D565 IonicContact NH2-OD2 3.12Å; R526-D565 PolarHBondContact NH2-OD2 2.95Å; T563-D565 PolarHBondContact OG1-OD1 3.29Å; T563-D565 VanDerWaalsContact OG1-OD1 3.05Å; D565-T589 PolarHBondContact OD2-OG1 3.11Å
566	T	91.4	Very high	90	Very high	92 Å²	92	55.9 Å²	55.9	56%	0.564	27%	0.27	S	S	*	.	S	Bend	trans	-130.3	69.5	179.5	53.4	0	0	0	0	111	H564	H564-T566 PolarHBondContact CE1-O 3.07Å; H564-T566 VanDerWaalsContact ND1-C 3.28Å; H564-T566 PolarHBondContact ND1-N 2.99Å; H564-T566 PolarHBondContact ND1-O 2.81Å
567	P	92.9	Very high	89.5	Confident	19 Å²	19	58.2 Å²	58.2	12%	0.123	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-66.8	159.9	-175.1	31.2	-36.5	0	0	0	111.9	Y497 S507 M509 H564	Y497-P567 HydrophobicContact CD2-CB 4.25Å; Y497-P567 HydrophobicContact CD2-CG 4.25Å; Y497-P567 HydrophobicContact CE2-CB 3.85Å; Y497-P567 HydrophobicContact CE2-CG 3.63Å; S507-P567 WeakPolarHBondContact O-CD 3.46Å; M509-P567 HydrophobicContact CB-CB 4.47Å; M509-P567 HydrophobicContact CG-CB 3.63Å; M509-P567 HydrophobicContact CG-CG 4.16Å; M509-P567 HydrophobicContact SD-CB 3.56Å; M509-P567 VanDerWaalsContact SD-CB 3.56Å; H564-P567 HydrophobicContact CB-CB 4.42Å
568	P	91.4	Very high	88.7	Confident	45 Å²	45	54.4 Å²	54.4	29%	0.292	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-53.6	151.6	169.4	-22.2	32.7	0	0	0	111.4	Y497 M573 Y584	Y497-P568 WeakPolarHBondContact CE2-O 3.45Å; P568-M573 HydrophobicContact CB-CG 4.07Å; P568-M573 HydrophobicContact CB-SD 4.4Å; P568-Y584 HydrophobicContact CG-CD1 4.35Å
569	R	88.9	Confident	88	Confident	156 Å²	156	57 Å²	57	59%	0.589	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-67.8	151	175.8	-60.8	176.6	-66.5	177.1	4.8	109.8	E571 D572	R569-E571 WeakPolarHBondContact CB-OE2 3.44Å; R569-E571 PolarHBondContact O-N 3.47Å; R569-E571 VanDerWaalsContact O-N 3.16Å; R569-D572 IonicContact CZ-OD2 2.7Å; R569-D572 IonicContact NE-OD2 3.81Å; R569-D572 PolarHBondContact NE-OD2 3.36Å; R569-D572 IonicContact NH2-OD1 3.54Å; R569-D572 PolarHBondContact NH2-OD1 3.4Å; R569-D572 IonicContact NH2-OD2 3.48Å; R569-D572 PolarHBondContact NH2-OD2 3.49Å; R569-D572 PolarHBondContact O-N 3.38Å
570	K	85.8	Confident	87.4	Confident	85 Å²	85	59.1 Å²	59.1	37%	0.37	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-55.3	-36.1	-178.3	-178.3	173.7	-174.9	178.7	0	112.5	E482 F483 D572 M573	E482-K570 IonicContact OE2-NZ 3.07Å; E482-K570 PolarHBondContact OE2-NZ 2.87Å; F483-K570 HydrophobicContact CD1-CD 4.45Å; F483-K570 HydrophobicContact CE1-CB 4.42Å; F483-K570 HydrophobicContact CE1-CD 4.01Å; F483-K570 HydrophobicContact CE1-CG 3.8Å; K570-D572 PolarHBondContact O-N 2.78Å; K570-M573 PolarHBondContact O-N 3.35Å
571	E	86.8	Confident	86.9	Confident	149 Å²	149	59.4 Å²	59.4	70%	0.696	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-71.2	-21.8	-179.3	-50.5	78.9	-146.5	0	0	113.1	R569 M573	R569-E571 WeakPolarHBondContact CB-OE2 3.44Å; R569-E571 PolarHBondContact O-N 3.47Å; R569-E571 VanDerWaalsContact O-N 3.16Å; E571-M573 VanDerWaalsContact C-N 3.33Å
572	D	89	Confident	86.3	Confident	90 Å²	90	60.9 Å²	60.9	48%	0.481	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-90.9	0.6	-179.1	-58.3	-41.6	0	0	0	111.7	R569 K570	R569-D572 IonicContact CZ-OD2 2.7Å; R569-D572 IonicContact NE-OD2 3.81Å; R569-D572 PolarHBondContact NE-OD2 3.36Å; R569-D572 IonicContact NH2-OD1 3.54Å; R569-D572 PolarHBondContact NH2-OD1 3.4Å; R569-D572 IonicContact NH2-OD2 3.48Å; R569-D572 PolarHBondContact NH2-OD2 3.49Å; R569-D572 PolarHBondContact O-N 3.38Å; K570-D572 PolarHBondContact O-N 2.78Å
573	M	86.6	Confident	85.9	Confident	15 Å²	15	67.1 Å²	67.1	7%	0.074	34%	0.343	C	S	.	.			trans	-106.7	123.8	-177.7	-64.2	177.4	72.5	0	0	111.8	F483 L485 Y497 M509 P568 K570 E571 L575 Y584	F483-M573 HydrophobicContact CE2-CE 3.79Å; F483-M573 HydrophobicContact CE2-SD 4.25Å; F483-M573 HydrophobicContact CZ-CE 3.98Å; F483-M573 HydrophobicContact CZ-SD 3.8Å; L485-M573 HydrophobicContact CD1-CE 4Å; L485-M573 HydrophobicContact CD2-CE 4.31Å; Y497-M573 HydrophobicContact CD2-SD 4.17Å; Y497-M573 HydrophobicContact CE2-SD 4.38Å; M509-M573 HydrophobicContact CE-CE 4.3Å; M509-M573 HydrophobicContact SD-CE 4.26Å; P568-M573 HydrophobicContact CB-CG 4.07Å; P568-M573 HydrophobicContact CB-SD 4.4Å; K570-M573 PolarHBondContact O-N 3.35Å; E571-M573 VanDerWaalsContact C-N 3.33Å; M573-L575 HydrophobicContact CB-CD2 3.99Å; M573-L575 HydrophobicContact CE-CD2 4.4Å; M573-L575 PolarHBondContact O-N 2.82Å; M573-Y584 HydrophobicContact CB-CE2 4.15Å; M573-Y584 HydrophobicContact CE-CD2 3.61Å; M573-Y584 HydrophobicContact CE-CE2 4.29Å; M573-Y584 HydrophobicContact CE-CG 3.76Å; M573-Y584 HydrophobicContact CG-CD1 4.33Å; M573-Y584 HydrophobicContact CG-CD2 4.44Å; M573-Y584 HydrophobicContact CG-CE1 4.29Å; M573-Y584 HydrophobicContact CG-CE2 4.39Å; M573-Y584 HydrophobicContact CG-CG 4.43Å
574	D	84.6	Confident	85.6	Confident	54 Å²	54	68.1 Å²	68.1	29%	0.289	35%	0.347	S	S	.	.			trans	-89.2	94.6	173.9	177.8	2.1	0	0	0	109.1	E576 N577 K580 Y584	D574-E576 VanDerWaalsContact C-N 3.29Å; D574-E576 PolarHBondContact O-N 2.91Å; D574-E576 PolarHBondContact OD1-N 3.5Å; D574-N577 PolarHBondContact OD1-N 3.14Å; D574-N577 WeakPolarHBondContact OD2-CB 3.32Å; D574-K580 HydrophobicContact CB-CD 3.99Å; D574-K580 IonicContact OD2-NZ 2.89Å; D574-K580 PolarHBondContact OD2-NZ 3.13Å; D574-Y584 PolarHBondContact N-OH 3.33Å
575	L	80.5	Confident	85.5	Confident	68 Å²	68	67.1 Å²	67.1	36%	0.356	34%	0.342	S	S	.	.	S	Bend	trans	-76.9	-15.7	-174	-55.7	-178.2	0	0	0	113.3	F483 L485 M573 F581	F483-L575 HydrophobicContact CB-CD1 4.43Å; F483-L575 HydrophobicContact CD1-CD1 4.05Å; F483-L575 HydrophobicContact CD2-CD1 4.09Å; F483-L575 HydrophobicContact CD2-CD2 3.67Å; F483-L575 HydrophobicContact CE1-CD1 4.34Å; F483-L575 HydrophobicContact CE2-CD1 4.36Å; F483-L575 HydrophobicContact CE2-CD2 3.42Å; F483-L575 VanDerWaalsContact CE2-CD2 3.42Å; F483-L575 HydrophobicContact CG-CD1 3.93Å; F483-L575 HydrophobicContact CG-CD2 4.35Å; F483-L575 HydrophobicContact CZ-CD1 4.48Å; F483-L575 HydrophobicContact CZ-CD2 3.92Å; L485-L575 HydrophobicContact CD2-CD2 3.93Å; M573-L575 HydrophobicContact CB-CD2 3.99Å; M573-L575 HydrophobicContact CE-CD2 4.4Å; M573-L575 PolarHBondContact O-N 2.82Å; L575-F581 WeakPolarHBondContact O-CZ 3.42Å
576	E	72.7	Confident	85.5	Confident	191 Å²	191	71.1 Å²	71.1	89%	0.893	36%	0.362	S	S	*	.	S	Bend	trans	-82.4	-23.1	178.7	-63.4	-173.5	173.6	0	0	111.6	D574	D574-E576 VanDerWaalsContact C-N 3.29Å; D574-E576 PolarHBondContact O-N 2.91Å; D574-E576 PolarHBondContact OD1-N 3.5Å
577	N	74.4	Confident	85.6	Confident	59 Å²	59	67.8 Å²	67.8	32%	0.316	35%	0.345	S	S	.	.			trans	-102.2	94.1	-178.9	-169	-9.1	0	0	0	112.9	D574 S579 K580	D574-N577 PolarHBondContact OD1-N 3.14Å; D574-N577 WeakPolarHBondContact OD2-CB 3.32Å; N577-S579 PolarHBondContact O-N 3.48Å; N577-S579 VanDerWaalsContact O-N 3.13Å; N577-S579 PolarHBondContact OD1-N 2.86Å; N577-S579 PolarHBondContact OD1-OG 3.25Å; N577-K580 HydrophobicContact CB-CD 4.44Å; N577-K580 PolarHBondContact O-N 2.89Å; N577-K580 VanDerWaalsContact O-N 3.16Å
578	S	72.7	Confident	85.8	Confident	39 Å²	39	66.9 Å²	66.9	27%	0.273	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-60	-23.3	-179.6	59.8	0	0	0	0	115.7	K580 F581	S578-K580 PolarHBondContact O-N 3.26Å; S578-F581 VanDerWaalsContact O-CB 3.32Å; S578-F581 WeakPolarHBondContact O-CB 3.31Å; S578-F581 VanDerWaalsContact O-CG 3.28Å; S578-F581 WeakPolarHBondContact O-CG 3.4Å; S578-F581 PolarHBondContact O-N 3.1Å; S578-F581 VanDerWaalsContact O-N 3.12Å
579	S	74.8	Confident	86.1	Confident	72 Å²	72	64.8 Å²	64.8	50%	0.503	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-64.8	-25.6	178	66.4	0	0	0	0	113.2	N577 F581	N577-S579 PolarHBondContact O-N 3.48Å; N577-S579 VanDerWaalsContact O-N 3.13Å; N577-S579 PolarHBondContact OD1-N 2.86Å; N577-S579 PolarHBondContact OD1-OG 3.25Å; S579-F581 VanDerWaalsContact C-N 3.33Å
580	K	83	Confident	86.5	Confident	65 Å²	65	57.4 Å²	57.4	28%	0.283	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-81.7	-10.3	177.6	-66.6	178.7	179.3	168	0	113.3	D574 N577 S578 A582 E583 Y584	D574-K580 HydrophobicContact CB-CD 3.99Å; D574-K580 IonicContact OD2-NZ 2.89Å; D574-K580 PolarHBondContact OD2-NZ 3.13Å; N577-K580 HydrophobicContact CB-CD 4.44Å; N577-K580 PolarHBondContact O-N 2.89Å; N577-K580 VanDerWaalsContact O-N 3.16Å; S578-K580 PolarHBondContact O-N 3.26Å; K580-A582 PolarHBondContact O-N 2.92Å; K580-E583 WeakPolarHBondContact O-CB 3.47Å; K580-E583 PolarHBondContact O-N 3.32Å; K580-Y584 HydrophobicContact CB-CE2 3.84Å; K580-Y584 WeakPolarHBondContact O-CD2 3.21Å; K580-Y584 PolarHBondContact O-N 2.81Å
581	F	86.5	Confident	87	Confident	7 Å²	7	53.4 Å²	53.4	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-31.3	-175.9	-64.8	-3.8	0	0	0	112.3	L485 L575 S578 S579 E583 Y584 E585	L485-F581 HydrophobicContact CB-CB 4.44Å; L485-F581 HydrophobicContact CB-CD2 3.88Å; L485-F581 HydrophobicContact CB-CE2 4.24Å; L485-F581 HydrophobicContact CB-CG 4.07Å; L485-F581 HydrophobicContact CD1-CB 4.14Å; L485-F581 HydrophobicContact CD1-CD1 4.26Å; L485-F581 HydrophobicContact CD1-CG 4.16Å; L485-F581 HydrophobicContact CD2-CD1 3.86Å; L485-F581 HydrophobicContact CD2-CD2 4.4Å; L485-F581 HydrophobicContact CD2-CE1 3.78Å; L485-F581 HydrophobicContact CD2-CE2 4.32Å; L485-F581 HydrophobicContact CD2-CG 4.18Å; L485-F581 HydrophobicContact CD2-CZ 4.01Å; L485-F581 HydrophobicContact CG-CD1 4.47Å; L485-F581 HydrophobicContact CG-CG 4.37Å; L575-F581 WeakPolarHBondContact O-CZ 3.42Å; S578-F581 VanDerWaalsContact O-CB 3.32Å; S578-F581 WeakPolarHBondContact O-CB 3.31Å; S578-F581 VanDerWaalsContact O-CG 3.28Å; S578-F581 WeakPolarHBondContact O-CG 3.4Å; S578-F581 PolarHBondContact O-N 3.1Å; S578-F581 VanDerWaalsContact O-N 3.12Å; S579-F581 VanDerWaalsContact C-N 3.33Å; F581-E583 VanDerWaalsContact C-N 3.32Å; F581-E583 PolarHBondContact O-N 3.06Å; F581-Y584 HydrophobicContact CD1-CD2 4.18Å; F581-Y584 HydrophobicContact CD1-CE2 4.29Å; F581-Y584 PolarHBondContact O-N 2.75Å; F581-E585 WeakPolarHBondContact O-CG 3.48Å; F581-E585 PolarHBondContact O-N 3.05Å
582	A	85.3	Confident	87.5	Confident	30 Å²	30	46.3 Å²	46.3	25%	0.248	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-37.8	174.2	0	0	0	0	0	112.2	R491 K580 E585	R491-A582 HydrophobicContact CB-CB 4.28Å; K580-A582 PolarHBondContact O-N 2.92Å; A582-E585 CarbonylContact O-C 3.55Å; A582-E585 PolarHBondContact O-N 3.39Å
583	E	90	Very high	87.8	Confident	132 Å²	132	42 Å²	42	62%	0.617	23%	0.225	S	C	*	.	H	α-helix	trans	-67.3	-38.3	178.3	-57.6	177.4	-172.1	0	0	111.5	K580 F581 E585 M586	K580-E583 WeakPolarHBondContact O-CB 3.47Å; K580-E583 PolarHBondContact O-N 3.32Å; F581-E583 VanDerWaalsContact C-N 3.32Å; F581-E583 PolarHBondContact O-N 3.06Å; E583-E585 PolarHBondContact O-N 2.88Å; E583-M586 WeakPolarHBondContact O-CG 3.37Å; E583-M586 PolarHBondContact O-N 2.85Å
584	Y	92.1	Very high	88.3	Confident	20 Å²	20	41.3 Å²	41.3	8%	0.078	22%	0.222	C	C	.	.	H	α-helix	trans	-69.2	-16.6	175.3	-54.6	-33.1	0	0	0	113.3	L485 H564 P568 M573 D574 K580 F581	L485-Y584 HydrophobicContact CD1-CD2 4.14Å; H564-Y584 PolarHBondContact CD2-O 3.08Å; P568-Y584 HydrophobicContact CG-CD1 4.35Å; M573-Y584 HydrophobicContact CB-CE2 4.15Å; M573-Y584 HydrophobicContact CE-CD2 3.61Å; M573-Y584 HydrophobicContact CE-CE2 4.29Å; M573-Y584 HydrophobicContact CE-CG 3.76Å; M573-Y584 HydrophobicContact CG-CD1 4.33Å; M573-Y584 HydrophobicContact CG-CD2 4.44Å; M573-Y584 HydrophobicContact CG-CE1 4.29Å; M573-Y584 HydrophobicContact CG-CE2 4.39Å; M573-Y584 HydrophobicContact CG-CG 4.43Å; D574-Y584 PolarHBondContact N-OH 3.33Å; K580-Y584 HydrophobicContact CB-CE2 3.84Å; K580-Y584 WeakPolarHBondContact O-CD2 3.21Å; K580-Y584 PolarHBondContact O-N 2.81Å; F581-Y584 HydrophobicContact CD1-CD2 4.18Å; F581-Y584 HydrophobicContact CD1-CE2 4.29Å; F581-Y584 PolarHBondContact O-N 2.75Å
585	E	92.8	Very high	88.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	29.2	179.4	-69.3	-180	178.5	0	0	112.4	R491 S493 S495 M509 I511 R521 F581 A582 E583 L588	R491-E585 IonicContact CZ-OE1 3.22Å; R491-E585 IonicContact CZ-OE2 3.4Å; R491-E585 IonicContact NH1-OE1 2.99Å; R491-E585 PolarHBondContact NH1-OE1 3.25Å; R491-E585 IonicContact NH1-OE2 2.75Å; R491-E585 PolarHBondContact NH1-OE2 3.47Å; R491-E585 IonicContact NH2-OE1 3.74Å; S493-E585 PolarHBondContact OG-OE2 3.06Å; S495-E585 WeakPolarHBondContact CB-OE1 3.12Å; S495-E585 PolarHBondContact OG-OE1 3.06Å; M509-E585 HydrophobicContact CE-CG 4.35Å; I511-E585 HydrophobicContact CG1-CG 4.44Å; R521-E585 WeakPolarHBondContact CB-O 3.08Å; R521-E585 IonicContact CZ-OE2 3.12Å; R521-E585 VanDerWaalsContact NH1-CB 3.3Å; R521-E585 IonicContact NH1-OE2 3.99Å; R521-E585 PolarHBondContact NH1-OE2 2.81Å; R521-E585 IonicContact NH2-OE2 2.79Å; F581-E585 WeakPolarHBondContact O-CG 3.48Å; F581-E585 PolarHBondContact O-N 3.05Å; A582-E585 CarbonylContact O-C 3.55Å; A582-E585 PolarHBondContact O-N 3.39Å; E583-E585 PolarHBondContact O-N 2.88Å; E585-L588 WeakPolarHBondContact O-CD1 3.43Å; E585-L588 WeakPolarHBondContact O-CD2 3.17Å; E585-L588 WeakPolarHBondContact O-CG 3.2Å
586	M	92.6	Very high	89.3	Confident	105 Å²	105	35.5 Å²	35.5	52%	0.517	19%	0.191	S	C	.	.			trans	-94.3	151.9	176.1	-67.8	-64.2	-72.5	0	0	111.8	R521 H564 E583	R521-M586 HydrophobicContact CB-SD 4.37Å; R521-M586 HydrophobicContact CG-SD 3.77Å; H564-M586 PolarHBondContact CD2-O 2.69Å; H564-M586 PolarHBondContact NE2-O 2.61Å; H564-M586 VanDerWaalsContact NE2-O 3.1Å; E583-M586 WeakPolarHBondContact O-CG 3.37Å; E583-M586 PolarHBondContact O-N 2.85Å
587	G	93.7	Very high	90	Very high	22 Å²	22	27.2 Å²	27.2	23%	0.227	15%	0.152	C	C	.	.	S	Bend	trans	73.2	32.1	174.6	0	0	0	0	0	114.2	R521	R521-G587 PolarHBondContact O-N 3Å
588	L	97	Very high	90.4	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	160.1	-175.1	-53.4	-178.6	0	0	0	112.7	I511 V518 R521 C522 N523 Y524 A562 H564 E585	I511-L588 HydrophobicContact CB-CD1 4.46Å; I511-L588 HydrophobicContact CD1-CD1 4.32Å; I511-L588 HydrophobicContact CD1-CD2 3.63Å; I511-L588 HydrophobicContact CG1-CD1 4.21Å; I511-L588 HydrophobicContact CG1-CD2 4.15Å; I511-L588 HydrophobicContact CG2-CD1 4.31Å; V518-L588 HydrophobicContact CG1-CD1 4.41Å; R521-L588 HydrophobicContact CB-CD1 4.14Å; R521-L588 HydrophobicContact CB-CG 4.39Å; R521-L588 PolarHBondContact O-N 2.73Å; C522-L588 CarbonylContact C-O 3.51Å; C522-L588 VanDerWaalsContact CA-O 3.3Å; C522-L588 WeakPolarHBondContact CA-O 3.38Å; N523-L588 PolarHBondContact N-O 3.25Å; Y524-L588 PolarHBondContact N-O 2.75Å; Y524-L588 VanDerWaalsContact N-O 3.12Å; A562-L588 HydrophobicContact CB-CB 4.25Å; A562-L588 HydrophobicContact CB-CD1 4.27Å; H564-L588 HydrophobicContact CB-CD2 3.86Å; E585-L588 WeakPolarHBondContact O-CD1 3.43Å; E585-L588 WeakPolarHBondContact O-CD2 3.17Å; E585-L588 WeakPolarHBondContact O-CG 3.2Å
589	T	97.7	Very high	90.9	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.012	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	115.1	168.2	-55.2	0	0	0	0	109	Y524 R526 K531 A562 T563 D565	Y524-T589 CarbonylContact O-C 3.58Å; Y524-T589 WeakPolarHBondContact O-CA 3.28Å; R526-T589 HydrophobicContact CB-CG2 3.99Å; K531-T589 HydrophobicContact CB-CG2 4.5Å; A562-T589 CarbonylContact C-O 3.55Å; A562-T589 VanDerWaalsContact CA-O 3.25Å; A562-T589 WeakPolarHBondContact CA-O 3.39Å; A562-T589 WeakPolarHBondContact CB-O 3.45Å; T563-T589 PolarHBondContact N-O 3.25Å; T563-T589 PolarHBondContact O-N 3.28Å; D565-T589 PolarHBondContact OD2-OG1 3.11Å
590	F	97.7	Very high	91.3	Very high	1 Å²	1	21.2 Å²	21.2	0%	0.004	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	130.5	175.7	-177.1	-94	0	0	0	110.4	F367 M519 C522 Y524 L525 R526 M534 L542 A560 G592 C593	F367-F590 HydrophobicContact CE2-CE1 4.01Å; F367-F590 HydrophobicContact CE2-CZ 4.13Å; F367-F590 HydrophobicContact CZ-CZ 4.31Å; M519-F590 HydrophobicContact CE-CD2 3.65Å; M519-F590 HydrophobicContact CE-CE1 4.35Å; M519-F590 HydrophobicContact CE-CE2 3.44Å; M519-F590 VanDerWaalsContact CE-CE2 3.44Å; M519-F590 HydrophobicContact CE-CG 4.2Å; M519-F590 HydrophobicContact CE-CZ 3.82Å; M519-F590 HydrophobicContact SD-CD2 3.97Å; M519-F590 HydrophobicContact SD-CE2 4.37Å; M519-F590 HydrophobicContact SD-CG 4.28Å; C522-F590 HydrophobicContact CB-CB 4.18Å; Y524-F590 PolarHBondContact O-N 2.87Å; L525-F590 HydrophobicContact CD1-CB 4.24Å; L525-F590 HydrophobicContact CD1-CD1 3.57Å; L525-F590 HydrophobicContact CD1-CE1 4.45Å; L525-F590 HydrophobicContact CD1-CG 4.38Å; R526-F590 WeakPolarHBondContact CB-O 3.25Å; R526-F590 PolarHBondContact N-O 2.91Å; M534-F590 HydrophobicContact CE-CB 3.72Å; M534-F590 HydrophobicContact CE-CG 4.36Å; L542-F590 HydrophobicContact CD1-CD1 4.12Å; L542-F590 HydrophobicContact CD1-CE1 4.11Å; L542-F590 HydrophobicContact CD2-CE1 4.48Å; A560-F590 HydrophobicContact CB-CE2 3.83Å; F590-G592 VanDerWaalsContact CZ-C 3.48Å; F590-G592 WeakPolarHBondContact CZ-O 3.46Å; F590-C593 HydrophobicContact CZ-CB 4.37Å
591	V	97.1	Very high	91.3	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.006	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-48.2	-179	179.4	0	0	0	0	111.2	E412 L413 L561 T563	E412-V591 HydrophobicContact CB-CG1 4.16Å; E412-V591 HydrophobicContact CG-CG1 4.29Å; E412-V591 HydrophobicContact CG-CG2 4.17Å; L413-V591 HydrophobicContact CB-CG1 4.21Å; L561-V591 WeakPolarHBondContact O-CB 3.38Å; L561-V591 PolarHBondContact O-N 3.46Å; T563-V591 HydrophobicContact CG2-CG2 3.75Å
592	G	96.4	Very high	91.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.6	-174.7	-175.4	0	0	0	0	0	113	F367 L561 F590	F367-G592 VanDerWaalsContact O-CA 3.22Å; F367-G592 WeakPolarHBondContact O-CA 3.23Å; L561-G592 PolarHBondContact N-O 3.46Å; L561-G592 PolarHBondContact O-N 2.76Å; F590-G592 VanDerWaalsContact CZ-C 3.48Å; F590-G592 WeakPolarHBondContact CZ-O 3.46Å
593	C	96.6	Very high	91.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	144.6	178.2	-172.9	0	0	0	0	110.7	M366 F367 I546 L559 F590	M366-C593 CarbonylContact C-O 3.58Å; M366-C593 WeakPolarHBondContact CA-O 3.25Å; M366-C593 WeakPolarHBondContact CB-O 3.47Å; F367-C593 HydrophobicContact CD1-CB 3.99Å; F367-C593 HydrophobicContact CE1-CB 3.4Å; F367-C593 HydrophobicContact CE2-CB 4.06Å; F367-C593 HydrophobicContact CZ-CB 3.42Å; F367-C593 VanDerWaalsContact CZ-CB 3.42Å; F367-C593 PolarHBondContact N-O 2.9Å; F367-C593 PolarHBondContact O-N 3.16Å; F367-C593 VanDerWaalsContact O-N 3.08Å; I546-C593 HydrophobicContact CD1-CB 4.4Å; I546-C593 HydrophobicContact CG1-CB 4.33Å; L559-C593 WeakPolarHBondContact O-CA 3.46Å; L559-C593 PolarHBondContact O-SG 2.68Å; F590-C593 HydrophobicContact CZ-CB 4.37Å
594	V	97	Very high	91.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.3	171.7	-64.2	0	0	0	0	109.3	V363 M366 L413 L445 L448 C558 L559 L561 M596	V363-V594 HydrophobicContact CG1-CB 3.99Å; V363-V594 HydrophobicContact CG1-CG1 4.41Å; M366-V594 HydrophobicContact CB-CG1 3.92Å; L413-V594 HydrophobicContact CD1-CG1 4.41Å; L413-V594 HydrophobicContact CD2-CG1 3.99Å; L445-V594 HydrophobicContact CD2-CG2 3.78Å; L448-V594 HydrophobicContact CD2-CG1 3.85Å; C558-V594 CarbonylContact C-O 3.59Å; C558-V594 WeakPolarHBondContact CA-O 3.49Å; L559-V594 HydrophobicContact CB-CG2 3.89Å; L559-V594 PolarHBondContact N-O 2.86Å; L559-V594 PolarHBondContact O-N 3.25Å; L561-V594 HydrophobicContact CD1-CG1 3.84Å; L561-V594 HydrophobicContact CD1-CG2 4.26Å; V594-M596 HydrophobicContact CG2-CE 4.25Å
595	G	94.4	Very high	91	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.7	174.9	0	0	0	0	0	110	C364 R365	C364-G595 PolarHBondContact N-O 3.33Å; R365-G595 PolarHBondContact N-O 3.29Å; R365-G595 VanDerWaalsContact N-O 3.11Å; R365-G595 PolarHBondContact O-N 3.43Å
596	M	91.4	Very high	91	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	150.1	179.4	62.1	-170.7	75	0	0	111.5	M361 S362 V363 T441 A444 L445 L556 R557 L559 V594	M361-M596 HydrophobicContact CG-CB 4.2Å; M361-M596 HydrophobicContact CG-CG 3.94Å; M361-M596 HydrophobicContact CG-SD 3.59Å; M361-M596 VanDerWaalsContact CG-SD 3.59Å; M361-M596 HydrophobicContact SD-CB 4.08Å; M361-M596 HydrophobicContact SD-CG 3.69Å; M361-M596 HydrophobicContact SD-SD 4.05Å; S362-M596 CarbonylContact O-C 3.59Å; S362-M596 WeakPolarHBondContact O-CA 3.5Å; S362-M596 VanDerWaalsContact O-CB 3.28Å; S362-M596 WeakPolarHBondContact O-CB 3.26Å; V363-M596 HydrophobicContact CG2-CB 4.18Å; V363-M596 HydrophobicContact CG2-CE 4.25Å; T441-M596 HydrophobicContact CG2-CE 4.06Å; T441-M596 HydrophobicContact CG2-SD 3.61Å; A444-M596 HydrophobicContact CB-SD 4.26Å; L445-M596 HydrophobicContact CD2-CE 3.79Å; L445-M596 HydrophobicContact CG-CE 4.41Å; L556-M596 WeakPolarHBondContact CA-O 3.04Å; R557-M596 HydrophobicContact CB-CG 3.9Å; R557-M596 HydrophobicContact CG-CG 4.29Å; R557-M596 PolarHBondContact N-O 3.28Å; R557-M596 WeakPolarHBondContact O-CG 3.46Å; R557-M596 PolarHBondContact O-N 3.27Å; L559-M596 HydrophobicContact CD1-CE 3.72Å; L559-M596 HydrophobicContact CG-CE 4.36Å; V594-M596 HydrophobicContact CG2-CE 4.25Å
597	L	87.2	Confident	91	Very high	16 Å²	16	24.8 Å²	24.8	8%	0.084	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	166.4	168.1	77	142	0	0	0	110.9	M361 S362 C364 L556 P599	M361-L597 VanDerWaalsContact SD-C 3.59Å; S362-L597 PolarHBondContact N-O 3.5Å; S362-L597 PolarHBondContact O-N 3.34Å; C364-L597 HydrophobicContact CB-CD2 3.71Å; C364-L597 WeakPolarHBondContact SG-CD2 3.43Å; L556-L597 HydrophobicContact CD2-CB 3.89Å; L556-L597 HydrophobicContact CD2-CD2 3.45Å; L556-L597 VanDerWaalsContact CD2-CD2 3.45Å; L556-L597 HydrophobicContact CD2-CG 4.28Å; L597-P599 HydrophobicContact CD1-CB 4.33Å; L597-P599 HydrophobicContact CG-CB 4.45Å; L597-P599 WeakPolarHBondContact O-CD 3.48Å
598	D	83.2	Confident	91	Very high	14 Å²	14	23.8 Å²	23.8	8%	0.075	12%	0.124	C	C	.	.			trans	-87.7	102.3	160.9	178.2	23.8	0	0	0	108.4	K352 T357 N359 Q360	K352-D598 IonicContact NZ-OD2 3.71Å; T357-D598 VanDerWaalsContact CB-CG 3.44Å; T357-D598 WeakPolarHBondContact CB-OD1 3.37Å; T357-D598 WeakPolarHBondContact CB-OD2 3.46Å; T357-D598 VanDerWaalsContact OG1-CG 3.25Å; T357-D598 PolarHBondContact OG1-OD1 2.86Å; T357-D598 PolarHBondContact OG1-OD2 3.36Å; N359-D598 WeakPolarHBondContact CA-OD1 3.29Å; N359-D598 PolarHBondContact N-OD1 2.97Å; Q360-D598 PolarHBondContact N-OD1 3.31Å
599	P	82.5	Confident	90.8	Very high	12 Å²	12	29.9 Å²	29.9	8%	0.078	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-75.4	145.1	-167.8	30.3	-33.1	0	0	0	112.4	T357 T358 Q360 S387 L597	T357-P599 VanDerWaalsContact CA-O 3.29Å; T357-P599 WeakPolarHBondContact CA-O 3.47Å; T357-P599 WeakPolarHBondContact CB-O 3.26Å; T358-P599 PolarHBondContact N-O 2.89Å; Q360-P599 WeakPolarHBondContact O-CD 3.49Å; S387-P599 WeakPolarHBondContact O-CG 3.41Å; L597-P599 HydrophobicContact CD1-CB 4.33Å; L597-P599 HydrophobicContact CG-CB 4.45Å; L597-P599 WeakPolarHBondContact O-CD 3.48Å
600	P	83.7	Confident	90.6	Very high	19 Å²	19	33.4 Å²	33.4	12%	0.123	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-59.5	148.8	168.9	-22.5	33.2	0	0	0	112.2	L356 I632 I636	L356-P600 WeakPolarHBondContact O-CA 3.45Å; P600-I632 HydrophobicContact CG-CG2 4.45Å; P600-I636 HydrophobicContact CB-CG2 3.54Å; P600-I636 HydrophobicContact CG-CG2 3.67Å
601	R	82.6	Confident	90.4	Very high	43 Å²	43	33.3 Å²	33.3	16%	0.162	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-67.3	146.5	169.2	-59.3	177.6	-178.9	-95.6	2.4	109.8	G354 T355 L356 T357 T358 E603 V604 D735	G354-R601 PolarHBondContact O-NH2 2.75Å; T355-R601 WeakPolarHBondContact O-CD 3.32Å; T355-R601 PolarHBondContact O-NE 3.3Å; L356-R601 PolarHBondContact O-N 3.1Å; T357-R601 PolarHBondContact O-NE 3.41Å; T358-R601 HydrophobicContact CG2-CG 3.99Å; R601-E603 VanDerWaalsContact C-N 3.28Å; R601-E603 PolarHBondContact O-N 3.19Å; R601-V604 HydrophobicContact CB-CG2 3.76Å; R601-V604 PolarHBondContact O-N 3.09Å; R601-D735 PolarHBondContact NE-O 2.84Å; R601-D735 PolarHBondContact NH2-O 3.47Å
602	K	82.5	Confident	90.1	Very high	168 Å²	168	36.6 Å²	36.6	73%	0.73	19%	0.186	S	C	*	.	H	α-helix	trans	-65.7	-34.4	-175	-66.6	179	-178.5	174.6	0	111.8	V604	K602-V604 VanDerWaalsContact C-N 3.34Å
603	E	85.7	Confident	89.9	Confident	85 Å²	85	41.3 Å²	41.3	40%	0.397	21%	0.208	S	C	.	.	H	α-helix	trans	-76.8	-21.8	-174.7	-44.5	77.4	-136.8	0	0	112.6	R601 I605 G606 S607 N736	R601-E603 VanDerWaalsContact C-N 3.28Å; R601-E603 PolarHBondContact O-N 3.19Å; E603-I605 VanDerWaalsContact C-N 3.3Å; E603-I605 PolarHBondContact O-N 3.02Å; E603-G606 PolarHBondContact O-N 3.47Å; E603-S607 WeakPolarHBondContact O-CB 3.28Å; E603-S607 PolarHBondContact O-N 3.3Å; E603-S607 PolarHBondContact O-OG 3Å; E603-N736 PolarHBondContact OE2-ND2 3.09Å
604	V	89.6	Confident	89.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-39	-176.8	169.2	0	0	0	0	111.5	L356 R601 K602 G606 S607 V608 I636 F737	L356-V604 HydrophobicContact CD2-CG1 3.8Å; L356-V604 HydrophobicContact CD2-CG2 4.43Å; R601-V604 HydrophobicContact CB-CG2 3.76Å; R601-V604 PolarHBondContact O-N 3.09Å; K602-V604 VanDerWaalsContact C-N 3.34Å; V604-G606 PolarHBondContact O-N 3.4Å; V604-S607 PolarHBondContact O-N 2.84Å; V604-V608 HydrophobicContact CG1-CG2 4.01Å; V604-V608 WeakPolarHBondContact O-CG2 3.18Å; V604-V608 PolarHBondContact O-N 3.47Å; V604-I636 HydrophobicContact CG1-CB 4.09Å; V604-I636 HydrophobicContact CG1-CD1 4.19Å; V604-I636 HydrophobicContact CG1-CG2 4.25Å; V604-F737 HydrophobicContact CG2-CB 3.88Å
605	I	89.7	Confident	89.5	Confident	90 Å²	90	42.3 Å²	42.3	46%	0.462	22%	0.218	S	C	.	.	H	α-helix	trans	-61.3	-46.9	-178.1	-53.7	178.6	0	0	0	110.9	E603 S607 K609	E603-I605 VanDerWaalsContact C-N 3.3Å; E603-I605 PolarHBondContact O-N 3.02Å; I605-S607 VanDerWaalsContact C-N 3.33Å; I605-K609 PolarHBondContact O-N 3.23Å
606	G	92.6	Very high	89.5	Confident	40 Å²	40	42.4 Å²	42.4	41%	0.412	22%	0.219	S	C	.	.	H	α-helix	trans	-66.5	-37.2	176.6	0	0	0	0	0	112.2	E603 V604 K609 L610	E603-G606 PolarHBondContact O-N 3.47Å; V604-G606 PolarHBondContact O-N 3.4Å; G606-K609 WeakPolarHBondContact O-CB 3.27Å; G606-K609 PolarHBondContact O-N 2.95Å; G606-L610 WeakPolarHBondContact O-CG 3.3Å; G606-L610 PolarHBondContact O-N 3.44Å
607	S	93.8	Very high	89.7	Confident	8 Å²	8	44.4 Å²	44.4	6%	0.056	23%	0.226	C	C	.	.	H	α-helix	trans	-68	-43.4	-179.9	-55	0	0	0	0	112.4	E603 V604 I605 K609 L610 C611 S738	E603-S607 WeakPolarHBondContact O-CB 3.28Å; E603-S607 PolarHBondContact O-N 3.3Å; E603-S607 PolarHBondContact O-OG 3Å; V604-S607 PolarHBondContact O-N 2.84Å; I605-S607 VanDerWaalsContact C-N 3.33Å; S607-K609 VanDerWaalsContact C-N 3.28Å; S607-K609 PolarHBondContact O-N 3.41Å; S607-L610 PolarHBondContact O-N 3.22Å; S607-C611 PolarHBondContact O-N 3.16Å; S607-C611 PolarHBondContact O-SG 3.31Å; S607-C611 VanDerWaalsContact O-SG 3.32Å; S607-S738 VanDerWaalsContact OG-CA 3.29Å; S607-S738 WeakPolarHBondContact OG-CA 3.32Å; S607-S738 VanDerWaalsContact OG-CB 3.23Å; S607-S738 WeakPolarHBondContact OG-CB 3.44Å
608	V	93.4	Very high	90.2	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-38	174.5	171.7	0	0	0	0	110.7	V604 C611 N612 I638 F737	V604-V608 HydrophobicContact CG1-CG2 4.01Å; V604-V608 WeakPolarHBondContact O-CG2 3.18Å; V604-V608 PolarHBondContact O-N 3.47Å; V608-C611 PolarHBondContact O-N 3.1Å; V608-N612 PolarHBondContact O-N 2.85Å; V608-N612 PolarHBondContact O-ND2 3.14Å; V608-I638 HydrophobicContact CG1-CG1 4.07Å; V608-I638 HydrophobicContact CG2-CG1 4.47Å; V608-F737 HydrophobicContact CG2-CE1 4.27Å
609	K	92.8	Very high	90.8	Very high	128 Å²	128	43.1 Å²	43.1	56%	0.557	22%	0.22	S	C	*	.	H	α-helix	trans	-62.6	-48.2	174.3	-174.4	-176.1	169.7	-164.8	0	111.8	I605 G606 S607 C611 N612 E613	I605-K609 PolarHBondContact O-N 3.23Å; G606-K609 WeakPolarHBondContact O-CB 3.27Å; G606-K609 PolarHBondContact O-N 2.95Å; S607-K609 VanDerWaalsContact C-N 3.28Å; S607-K609 PolarHBondContact O-N 3.41Å; K609-C611 VanDerWaalsContact C-N 3.33Å; K609-C611 PolarHBondContact O-N 3.32Å; K609-N612 WeakPolarHBondContact O-CB 3.27Å; K609-N612 PolarHBondContact O-N 3.49Å; K609-N612 VanDerWaalsContact O-N 3.15Å; K609-E613 WeakPolarHBondContact CE-OE1 3.31Å; K609-E613 IonicContact NZ-OE1 2.76Å; K609-E613 PolarHBondContact O-N 3.38Å
610	L	92.6	Very high	91.4	Very high	75 Å²	75	42.6 Å²	42.6	39%	0.393	22%	0.216	S	C	.	.	H	α-helix	trans	-60.1	-41.1	176	-75.8	169.2	0	0	0	112	G606 S607 N612 E613 A614 V741	G606-L610 WeakPolarHBondContact O-CG 3.3Å; G606-L610 PolarHBondContact O-N 3.44Å; S607-L610 PolarHBondContact O-N 3.22Å; L610-N612 VanDerWaalsContact C-N 3.33Å; L610-N612 PolarHBondContact O-N 3.42Å; L610-E613 PolarHBondContact O-N 3.04Å; L610-A614 VanDerWaalsContact O-CB 3.26Å; L610-A614 WeakPolarHBondContact O-CB 3.49Å; L610-A614 PolarHBondContact O-N 3.05Å; L610-V741 HydrophobicContact CB-CG1 4.13Å; L610-V741 HydrophobicContact CD1-CG1 4.34Å
611	C	94.6	Very high	91.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.6	-46.7	173.5	-70.6	0	0	0	0	111.5	S607 V608 K609 E613 A614 G615 I616 V618	S607-C611 PolarHBondContact O-N 3.16Å; S607-C611 PolarHBondContact O-SG 3.31Å; S607-C611 VanDerWaalsContact O-SG 3.32Å; V608-C611 PolarHBondContact O-N 3.1Å; K609-C611 VanDerWaalsContact C-N 3.33Å; K609-C611 PolarHBondContact O-N 3.32Å; C611-E613 PolarHBondContact O-N 3.48Å; C611-A614 CarbonylContact O-C 3.53Å; C611-A614 PolarHBondContact O-N 2.78Å; C611-G615 PolarHBondContact O-N 2.69Å; C611-I616 CarbonylContact C-O 3.57Å; C611-I616 HydrophobicContact CB-CB 4.06Å; C611-I616 HydrophobicContact CB-CG2 4.48Å; C611-I616 WeakPolarHBondContact O-CA 3.44Å; C611-I616 PolarHBondContact O-N 3.48Å; C611-V618 HydrophobicContact CB-CG2 3.77Å
612	N	90.8	Very high	91.8	Very high	70 Å²	70	39.7 Å²	39.7	37%	0.374	20%	0.203	S	C	.	.	H	α-helix	trans	-63.6	-40	178.7	-71.8	-34.7	0	0	0	112.4	V608 K609 L610 G615	V608-N612 PolarHBondContact O-N 2.85Å; V608-N612 PolarHBondContact O-ND2 3.14Å; K609-N612 WeakPolarHBondContact O-CB 3.27Å; K609-N612 PolarHBondContact O-N 3.49Å; K609-N612 VanDerWaalsContact O-N 3.15Å; L610-N612 VanDerWaalsContact C-N 3.33Å; L610-N612 PolarHBondContact O-N 3.42Å; N612-G615 PolarHBondContact O-N 3.37Å
613	E	91	Very high	91.4	Very high	98 Å²	98	32.5 Å²	32.5	46%	0.458	18%	0.177	S	C	.	.	H	α-helix	trans	-64.7	-39.5	175.2	-71.8	172.2	166.7	0	0	111.4	K609 L610 C611 G615	K609-E613 WeakPolarHBondContact CE-OE1 3.31Å; K609-E613 IonicContact NZ-OE1 2.76Å; K609-E613 PolarHBondContact O-N 3.38Å; L610-E613 PolarHBondContact O-N 3.04Å; C611-E613 PolarHBondContact O-N 3.48Å; E613-G615 PolarHBondContact O-N 3.09Å
614	A	91.2	Very high	90.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	5.5	177.2	0	0	0	0	0	114.8	L610 C611 I616 R748 M814 K816 P818	L610-A614 VanDerWaalsContact O-CB 3.26Å; L610-A614 WeakPolarHBondContact O-CB 3.49Å; L610-A614 PolarHBondContact O-N 3.05Å; C611-A614 CarbonylContact O-C 3.53Å; C611-A614 PolarHBondContact O-N 2.78Å; A614-I616 VanDerWaalsContact C-N 3.32Å; A614-I616 HydrophobicContact CB-CD1 4.16Å; A614-I616 HydrophobicContact CB-CG1 4.22Å; A614-I616 PolarHBondContact O-N 2.79Å; A614-R748 PolarHBondContact O-NH2 2.88Å; A614-M814 WeakPolarHBondContact CA-O 3.31Å; A614-M814 HydrophobicContact CB-CE 3.85Å; A614-M814 WeakPolarHBondContact CB-O 3.48Å; A614-M814 PolarHBondContact N-O 2.89Å; A614-K816 VanDerWaalsContact O-O 3.09Å; A614-P818 WeakPolarHBondContact O-CD 3.41Å
615	G	93.4	Very high	90.1	Very high	21 Å²	21	33.5 Å²	33.5	22%	0.216	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	19.2	-179	0	0	0	0	0	115.2	C611 N612 E613 P818	C611-G615 PolarHBondContact O-N 2.69Å; N612-G615 PolarHBondContact O-N 3.37Å; E613-G615 PolarHBondContact O-N 3.09Å; G615-P818 WeakPolarHBondContact O-CD 3.46Å
616	I	95.9	Very high	89.8	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.015	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-96.6	123.9	179.9	-53.8	173.1	0	0	0	109.7	S346 I348 C611 A614 V744 P818	S346-I616 WeakPolarHBondContact O-CA 3.46Å; I348-I616 HydrophobicContact CD1-CG2 3.83Å; I348-I616 HydrophobicContact CG1-CG2 3.8Å; C611-I616 CarbonylContact C-O 3.57Å; C611-I616 HydrophobicContact CB-CB 4.06Å; C611-I616 HydrophobicContact CB-CG2 4.48Å; C611-I616 WeakPolarHBondContact O-CA 3.44Å; C611-I616 PolarHBondContact O-N 3.48Å; A614-I616 VanDerWaalsContact C-N 3.32Å; A614-I616 HydrophobicContact CB-CD1 4.16Å; A614-I616 HydrophobicContact CB-CG1 4.22Å; A614-I616 PolarHBondContact O-N 2.79Å; I616-V744 HydrophobicContact CD1-CG1 3.74Å; I616-P818 HydrophobicContact CG1-CG 4.02Å
617	R	95.7	Very high	89.3	Confident	41 Å²	41	32.6 Å²	32.6	16%	0.155	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	129.1	179	-177.7	169	60.3	127.5	-9	111.3	S346 V347 I348 I619 V667 K668 A670	S346-R617 PolarHBondContact O-N 2.96Å; V347-R617 CarbonylContact C-O 3.56Å; V347-R617 VanDerWaalsContact CA-O 3.32Å; V347-R617 WeakPolarHBondContact CA-O 3.4Å; V347-R617 HydrophobicContact CG2-CB 4.37Å; I348-R617 PolarHBondContact N-O 3.24Å; R617-I619 HydrophobicContact CG-CG1 4.37Å; R617-V667 PolarHBondContact NH1-O 3.02Å; R617-V667 PolarHBondContact NH2-O 3Å; R617-K668 PolarHBondContact NH1-O 3.24Å; R617-A670 PolarHBondContact NH1-O 3.32Å
618	V	96.2	Very high	88.5	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.024	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.5	174.2	-173.8	0	0	0	0	110.4	I348 C611 I638 F737	I348-V618 CarbonylContact O-C 3.58Å; I348-V618 WeakPolarHBondContact O-CA 3.38Å; C611-V618 HydrophobicContact CB-CG2 3.77Å; V618-I638 HydrophobicContact CB-CD1 4.47Å; V618-I638 HydrophobicContact CB-CG1 4.39Å; V618-I638 HydrophobicContact CG1-CD1 3.84Å; V618-I638 HydrophobicContact CG1-CG1 4.21Å; V618-F737 HydrophobicContact CG1-CE2 4.49Å; V618-F737 HydrophobicContact CG1-CZ 4.15Å; V618-F737 HydrophobicContact CG2-CZ 4.18Å
619	I	96.6	Very high	88.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.2	175.9	-54.6	-178	0	0	0	108.5	V347 I348 C349 S350 R617 I621 R671 F673 L688	V347-I619 HydrophobicContact CG1-CD1 3.63Å; V347-I619 HydrophobicContact CG1-CG1 3.94Å; I348-I619 PolarHBondContact O-N 2.97Å; C349-I619 CarbonylContact C-O 3.58Å; C349-I619 WeakPolarHBondContact CA-O 3.49Å; S350-I619 PolarHBondContact N-O 3.45Å; R617-I619 HydrophobicContact CG-CG1 4.37Å; I619-I621 HydrophobicContact CG2-CG1 4.38Å; I619-R671 CarbonylContact C-O 3.59Å; I619-R671 WeakPolarHBondContact CA-O 3.39Å; I619-F673 HydrophobicContact CG2-CD2 3.76Å; I619-F673 HydrophobicContact CG2-CE2 3.94Å; I619-L688 HydrophobicContact CD1-CD1 4.34Å; I619-L688 HydrophobicContact CD1-CD2 4.45Å
620	M	94.6	Very high	87.8	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	132.6	171.9	-177	-174.5	-70.4	0	0	110.4	S350 K352 L356 I632 C633 I636 I638 R671 C672 F673	S350-M620 WeakPolarHBondContact O-CA 3.43Å; K352-M620 HydrophobicContact CB-CG 4.17Å; K352-M620 HydrophobicContact CB-SD 4.12Å; K352-M620 HydrophobicContact CG-CE 4.39Å; K352-M620 HydrophobicContact CG-SD 4.08Å; L356-M620 HydrophobicContact CD1-CB 4.34Å; L356-M620 HydrophobicContact CD1-CE 3.57Å; L356-M620 HydrophobicContact CD1-CG 3.98Å; M620-I632 HydrophobicContact CE-CB 4.18Å; M620-I632 HydrophobicContact CE-CG2 3.58Å; M620-I632 HydrophobicContact SD-CG2 4.45Å; M620-C633 PolarHBondContact SD-SG 2.84Å; M620-I636 HydrophobicContact CE-CD1 3.45Å; M620-I636 VanDerWaalsContact CE-CD1 3.45Å; M620-I636 HydrophobicContact CE-CG1 4.45Å; M620-I638 HydrophobicContact CB-CD1 3.98Å; M620-I638 HydrophobicContact CE-CD1 4.28Å; M620-R671 PolarHBondContact N-O 3.08Å; M620-C672 CarbonylContact O-C 3.6Å; M620-C672 WeakPolarHBondContact O-CA 3.38Å; M620-F673 PolarHBondContact O-N 3.22Å
621	I	91.6	Very high	87.4	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.6	171.4	-54.4	-178.2	0	0	0	108.1	C349 S350 D351 K352 I619 F673 V676 K681 I684 M697	C349-I621 HydrophobicContact CB-CD1 3.94Å; S350-I621 PolarHBondContact O-N 2.91Å; D351-I621 WeakPolarHBondContact CA-O 3.42Å; K352-I621 PolarHBondContact N-O 2.91Å; K352-I621 VanDerWaalsContact N-O 3.11Å; I619-I621 HydrophobicContact CG2-CG1 4.38Å; I621-F673 CarbonylContact C-O 3.59Å; I621-F673 WeakPolarHBondContact CA-O 3.28Å; I621-V676 HydrophobicContact CG2-CB 3.92Å; I621-V676 HydrophobicContact CG2-CG1 3.84Å; I621-V676 HydrophobicContact CG2-CG2 3.91Å; I621-K681 HydrophobicContact CG2-CD 4.39Å; I621-K681 HydrophobicContact CG2-CG 4.05Å; I621-I684 HydrophobicContact CD1-CD1 4.23Å; I621-M697 HydrophobicContact CD1-CE 4.15Å; I621-M697 HydrophobicContact CD1-SD 4.1Å
622	T	84.1	Confident	87	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.012	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	152.2	-176.3	-173.9	0	0	0	0	114	D624 A629 F673 A674 R675 V676	T622-D624 VanDerWaalsContact C-N 3.28Å; T622-D624 HydrophobicContact CG2-CB 4Å; T622-D624 PolarHBondContact OG1-N 3.27Å; T622-D624 VanDerWaalsContact OG1-N 3.14Å; T622-A629 HydrophobicContact CG2-CB 3.53Å; T622-F673 PolarHBondContact N-O 2.78Å; T622-A674 HydrophobicContact CG2-CB 4.35Å; T622-A674 CarbonylContact O-C 3.45Å; T622-A674 WeakPolarHBondContact O-CA 3.35Å; T622-R675 PolarHBondContact O-N 3.37Å; T622-V676 PolarHBondContact O-N 2.88Å
623	G	74.5	Confident	87	Confident	17 Å²	17	22.2 Å²	22.2	18%	0.175	13%	0.133	C	C	.	.	S	Bend	trans	-76.8	-9.2	167.8	0	0	0	0	0	114.3	R675	G623-R675 WeakPolarHBondContact O-CD 3.39Å
624	D	73.4	Confident	86.9	Confident	34 Å²	34	21.6 Å²	21.6	18%	0.182	13%	0.127	C	C	.	.	S	Bend	trans	-65.6	164.9	179.5	-85.8	-23.9	0	0	0	112.9	K352 T622 A674 R675	K352-D624 WeakPolarHBondContact CD-OD2 3.41Å; K352-D624 WeakPolarHBondContact CE-OD2 3.42Å; K352-D624 IonicContact NZ-OD1 2.82Å; K352-D624 IonicContact NZ-OD2 2.91Å; K352-D624 PolarHBondContact NZ-OD2 2.98Å; T622-D624 VanDerWaalsContact C-N 3.28Å; T622-D624 HydrophobicContact CG2-CB 4Å; T622-D624 PolarHBondContact OG1-N 3.27Å; T622-D624 VanDerWaalsContact OG1-N 3.14Å; D624-A674 WeakPolarHBondContact O-CB 3.23Å; D624-R675 WeakPolarHBondContact O-CG 3.4Å; D624-R675 PolarHBondContact O-N 2.95Å; D624-R675 VanDerWaalsContact O-N 3.11Å
625	N	74.4	Confident	86.7	Confident	72 Å²	72	27.6 Å²	27.6	39%	0.385	15%	0.149	S	C	.	.			trans	-66.1	154.9	169.6	76.9	61.3	0	0	0	110.9	G627 T628 A629	N625-G627 VanDerWaalsContact C-N 3.31Å; N625-G627 PolarHBondContact O-N 2.81Å; N625-G627 WeakPolarHBondContact OD1-CA 3.24Å; N625-G627 PolarHBondContact OD1-N 2.81Å; N625-T628 PolarHBondContact ND2-OG1 3.24Å; N625-T628 PolarHBondContact O-N 2.86Å; N625-T628 PolarHBondContact OD1-N 3.44Å; N625-T628 PolarHBondContact OD1-OG1 3.33Å; N625-A629 WeakPolarHBondContact O-CB 3.25Å; N625-A629 PolarHBondContact O-N 3.43Å
626	K	83.1	Confident	86.5	Confident	63 Å²	63	26.6 Å²	26.6	27%	0.274	14%	0.139	S	C	.	.	H	α-helix	trans	-58.5	-37.5	-176.6	-174.5	171	176.4	171	0	113.8	A629 V630 A649 T651 E654 A674	K626-A629 PolarHBondContact O-N 2.99Å; K626-V630 HydrophobicContact CG-CG2 4.45Å; K626-V630 WeakPolarHBondContact O-CB 3.49Å; K626-V630 VanDerWaalsContact O-CG2 3.3Å; K626-V630 WeakPolarHBondContact O-CG2 3.32Å; K626-V630 PolarHBondContact O-N 3.4Å; K626-A649 WeakPolarHBondContact CE-O 3.32Å; K626-A649 PolarHBondContact NZ-O 2.72Å; K626-T651 HydrophobicContact CB-CG2 3.87Å; K626-T651 HydrophobicContact CD-CG2 3.94Å; K626-T651 HydrophobicContact CG-CG2 4.42Å; K626-E654 IonicContact NZ-OE1 2.77Å; K626-E654 PolarHBondContact NZ-OE1 3.17Å; K626-E654 IonicContact NZ-OE2 3.3Å; K626-E654 PolarHBondContact NZ-OE2 3.34Å; K626-A674 HydrophobicContact CB-CB 4.14Å
627	G	81.3	Confident	86.2	Confident	47 Å²	47	28.1 Å²	28.1	49%	0.485	16%	0.155	S	C	.	.	H	α-helix	trans	-64.3	-49.5	-179.5	0	0	0	0	0	112.2	N625 V630 A631	N625-G627 VanDerWaalsContact C-N 3.31Å; N625-G627 PolarHBondContact O-N 2.81Å; N625-G627 WeakPolarHBondContact OD1-CA 3.24Å; N625-G627 PolarHBondContact OD1-N 2.81Å; G627-V630 PolarHBondContact O-N 3.05Å; G627-A631 PolarHBondContact O-N 2.85Å; G627-A631 VanDerWaalsContact O-N 3.09Å
628	T	77.7	Confident	86.1	Confident	24 Å²	24	26.3 Å²	26.3	15%	0.147	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-45.7	175.2	-57.2	0	0	0	0	111.3	N625 V630 A631 I632	N625-T628 PolarHBondContact ND2-OG1 3.24Å; N625-T628 PolarHBondContact O-N 2.86Å; N625-T628 PolarHBondContact OD1-N 3.44Å; N625-T628 PolarHBondContact OD1-OG1 3.33Å; T628-V630 PolarHBondContact O-N 2.95Å; T628-A631 PolarHBondContact O-N 3.17Å; T628-I632 HydrophobicContact CG2-CD1 4.04Å; T628-I632 WeakPolarHBondContact O-CG1 3.44Å; T628-I632 PolarHBondContact O-N 3.34Å
629	A	84.3	Confident	86	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.9	-45.4	179.6	0	0	0	0	0	112.5	T622 N625 K626 I632 C633 A674	T622-A629 HydrophobicContact CG2-CB 3.53Å; N625-A629 WeakPolarHBondContact O-CB 3.25Å; N625-A629 PolarHBondContact O-N 3.43Å; K626-A629 PolarHBondContact O-N 2.99Å; A629-I632 PolarHBondContact O-N 2.96Å; A629-C633 PolarHBondContact O-N 3.49Å; A629-C633 PolarHBondContact O-SG 3.37Å; A629-A674 HydrophobicContact CB-CB 3.94Å
630	V	87.9	Confident	85.6	Confident	16 Å²	16	28 Å²	28	10%	0.097	17%	0.166	C	C	.	.	H	α-helix	trans	-64.2	-41.5	177.1	168	0	0	0	0	111.6	K626 G627 T628 C633 R634 V645 A649	K626-V630 HydrophobicContact CG-CG2 4.45Å; K626-V630 WeakPolarHBondContact O-CB 3.49Å; K626-V630 VanDerWaalsContact O-CG2 3.3Å; K626-V630 WeakPolarHBondContact O-CG2 3.32Å; K626-V630 PolarHBondContact O-N 3.4Å; G627-V630 PolarHBondContact O-N 3.05Å; T628-V630 PolarHBondContact O-N 2.95Å; V630-C633 WeakPolarHBondContact O-CB 3.43Å; V630-C633 PolarHBondContact O-N 3.02Å; V630-R634 WeakPolarHBondContact O-CG 3.25Å; V630-R634 PolarHBondContact O-N 3.49Å; V630-V645 HydrophobicContact CG1-CG1 4.08Å; V630-V645 HydrophobicContact CG1-CG2 4.07Å; V630-V645 HydrophobicContact CG2-CG2 4.34Å; V630-A649 HydrophobicContact CG2-CB 3.78Å
631	A	83.9	Confident	85.1	Confident	14 Å²	14	33.8 Å²	33.8	12%	0.116	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-41.1	178.6	0	0	0	0	0	112.4	T555 G627 T628 R634 R635	T555-A631 HydrophobicContact CG2-CB 3.25Å; T555-A631 WeakPolarHBondContact OG1-CB 3.19Å; G627-A631 PolarHBondContact O-N 2.85Å; G627-A631 VanDerWaalsContact O-N 3.09Å; T628-A631 PolarHBondContact O-N 3.17Å; A631-R634 PolarHBondContact O-N 3.47Å; A631-R635 PolarHBondContact O-N 2.73Å
632	I	85.6	Confident	84.9	Confident	11 Å²	11	40.8 Å²	40.8	6%	0.056	23%	0.226	C	C	.	.	H	α-helix	trans	-64.7	-45	174.6	-62.5	176.2	0	0	0	110.2	K352 P600 M620 T628 A629 R634 R635 I636	K352-I632 HydrophobicContact CD-CD1 3.59Å; K352-I632 HydrophobicContact CG-CD1 4.27Å; P600-I632 HydrophobicContact CG-CG2 4.45Å; M620-I632 HydrophobicContact CE-CB 4.18Å; M620-I632 HydrophobicContact CE-CG2 3.58Å; M620-I632 HydrophobicContact SD-CG2 4.45Å; T628-I632 HydrophobicContact CG2-CD1 4.04Å; T628-I632 WeakPolarHBondContact O-CG1 3.44Å; T628-I632 PolarHBondContact O-N 3.34Å; A629-I632 PolarHBondContact O-N 2.96Å; I632-R634 VanDerWaalsContact C-N 3.27Å; I632-R634 PolarHBondContact O-N 3.32Å; I632-R635 PolarHBondContact O-N 3.45Å; I632-I636 HydrophobicContact CG2-CG2 4.38Å; I632-I636 WeakPolarHBondContact O-CG1 3.46Å; I632-I636 PolarHBondContact O-N 3.25Å
633	C	90.3	Very high	85.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-55.7	-40.1	176.1	-72.8	0	0	0	0	112.6	M620 A629 V630 G637 I638 F639	M620-C633 PolarHBondContact SD-SG 2.84Å; A629-C633 PolarHBondContact O-N 3.49Å; A629-C633 PolarHBondContact O-SG 3.37Å; V630-C633 WeakPolarHBondContact O-CB 3.43Å; V630-C633 PolarHBondContact O-N 3.02Å; C633-G637 PolarHBondContact O-N 3.28Å; C633-I638 HydrophobicContact CB-CB 4.08Å; C633-I638 HydrophobicContact CB-CG2 4.29Å; C633-I638 PolarHBondContact O-N 3.16Å; C633-F639 HydrophobicContact CB-CD2 3.35Å; C633-F639 HydrophobicContact CB-CE2 3.74Å; C633-F639 HydrophobicContact CB-CG 4.28Å; C633-F639 PolarHBondContact O-N 2.71Å
634	R	89.3	Confident	85.8	Confident	85 Å²	85	47.5 Å²	47.5	32%	0.321	26%	0.256	S	S	.	.	H	α-helix	trans	-65.2	-43.7	174	-72.9	178.8	173.9	-177.9	-4.1	111.9	V630 A631 I632 I636 G637 F639 E641 E643	V630-R634 WeakPolarHBondContact O-CG 3.25Å; V630-R634 PolarHBondContact O-N 3.49Å; A631-R634 PolarHBondContact O-N 3.47Å; I632-R634 VanDerWaalsContact C-N 3.27Å; I632-R634 PolarHBondContact O-N 3.32Å; R634-I636 VanDerWaalsContact C-N 3.33Å; R634-I636 PolarHBondContact O-N 2.93Å; R634-G637 PolarHBondContact O-N 2.91Å; R634-F639 HydrophobicContact CG-CB 3.93Å; R634-E641 WeakPolarHBondContact CD-O 3.39Å; R634-E641 PolarHBondContact NE-O 2.95Å; R634-E641 PolarHBondContact NH1-O 3.18Å; R634-E643 PolarHBondContact NH2-O 3.35Å
635	R	86.2	Confident	86.5	Confident	125 Å²	125	47 Å²	47	47%	0.472	26%	0.255	S	S	.	.	H	α-helix	trans	-66.2	-33.5	-177.4	-168.5	169.7	-175	156.2	2	113.5	A631 I632	A631-R635 PolarHBondContact O-N 2.73Å; I632-R635 PolarHBondContact O-N 3.45Å
636	I	89.4	Confident	87.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-93.6	-3.2	179.8	70.7	179	0	0	0	114	L356 P600 V604 M620 I632 R634 I638	L356-I636 HydrophobicContact CD1-CD1 3.94Å; L356-I636 HydrophobicContact CD2-CD1 4.42Å; P600-I636 HydrophobicContact CB-CG2 3.54Å; P600-I636 HydrophobicContact CG-CG2 3.67Å; V604-I636 HydrophobicContact CG1-CB 4.09Å; V604-I636 HydrophobicContact CG1-CD1 4.19Å; V604-I636 HydrophobicContact CG1-CG2 4.25Å; M620-I636 HydrophobicContact CE-CD1 3.45Å; M620-I636 VanDerWaalsContact CE-CD1 3.45Å; M620-I636 HydrophobicContact CE-CG1 4.45Å; I632-I636 HydrophobicContact CG2-CG2 4.38Å; I632-I636 WeakPolarHBondContact O-CG1 3.46Å; I632-I636 PolarHBondContact O-N 3.25Å; R634-I636 VanDerWaalsContact C-N 3.33Å; R634-I636 PolarHBondContact O-N 2.93Å; I636-I638 HydrophobicContact CD1-CD1 3.68Å; I636-I638 HydrophobicContact CD1-CG1 4.06Å; I636-I638 HydrophobicContact CG1-CD1 4.16Å; I636-I638 HydrophobicContact CG1-CG1 4Å
637	G	90.4	Very high	87.4	Confident	35 Å²	35	49.8 Å²	49.8	36%	0.361	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	15.7	175.5	0	0	0	0	0	116	C633 R634	C633-G637 PolarHBondContact O-N 3.28Å; R634-G637 PolarHBondContact O-N 2.91Å
638	I	93.6	Very high	87.9	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.015	26%	0.258	C	S	.	.	S	Bend	trans	-70.7	-39.1	169.6	-69.9	178.3	0	0	0	110.5	V608 V618 M620 C633 I636 R671	V608-I638 HydrophobicContact CG1-CG1 4.07Å; V608-I638 HydrophobicContact CG2-CG1 4.47Å; V618-I638 HydrophobicContact CB-CD1 4.47Å; V618-I638 HydrophobicContact CB-CG1 4.39Å; V618-I638 HydrophobicContact CG1-CD1 3.84Å; V618-I638 HydrophobicContact CG1-CG1 4.21Å; M620-I638 HydrophobicContact CB-CD1 3.98Å; M620-I638 HydrophobicContact CE-CD1 4.28Å; C633-I638 HydrophobicContact CB-CB 4.08Å; C633-I638 HydrophobicContact CB-CG2 4.29Å; C633-I638 PolarHBondContact O-N 3.16Å; I636-I638 HydrophobicContact CD1-CD1 3.68Å; I636-I638 HydrophobicContact CD1-CG1 4.06Å; I636-I638 HydrophobicContact CG1-CD1 4.16Å; I636-I638 HydrophobicContact CG1-CG1 4Å; I638-R671 HydrophobicContact CG2-CB 3.64Å; I638-R671 HydrophobicContact CG2-CG 4.47Å; I638-R671 PolarHBondContact O-NH1 3.15Å
639	F	93.3	Very high	88.7	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.018	25%	0.252	C	S	.	.	S	Bend	trans	-113.3	148.7	169.9	-66	-50.5	0	0	0	110	C633 R634 E643 V645 K648 R671 C672	C633-F639 HydrophobicContact CB-CD2 3.35Å; C633-F639 HydrophobicContact CB-CE2 3.74Å; C633-F639 HydrophobicContact CB-CG 4.28Å; C633-F639 PolarHBondContact O-N 2.71Å; R634-F639 HydrophobicContact CG-CB 3.93Å; F639-E643 WeakPolarHBondContact CA-OE2 3.4Å; F639-V645 HydrophobicContact CB-CG1 4.45Å; F639-V645 HydrophobicContact CD1-CG1 4.09Å; F639-V645 HydrophobicContact CD2-CG1 3.7Å; F639-V645 HydrophobicContact CE1-CG1 4.24Å; F639-V645 HydrophobicContact CE2-CB 4.49Å; F639-V645 HydrophobicContact CE2-CG1 3.88Å; F639-V645 HydrophobicContact CG-CG1 3.83Å; F639-V645 HydrophobicContact CZ-CG1 4.15Å; F639-K648 HydrophobicContact CE1-CB 3.86Å; F639-K648 HydrophobicContact CE1-CD 4.26Å; F639-K648 HydrophobicContact CZ-CB 4.1Å; F639-R671 HydrophobicContact CE1-CB 3.74Å; F639-R671 HydrophobicContact CE1-CG 4.22Å; F639-R671 HydrophobicContact CZ-CB 3.84Å; F639-C672 HydrophobicContact CE2-CB 3.75Å; F639-C672 HydrophobicContact CZ-CB 3.94Å
640	G	89.1	Confident	89.2	Confident	36 Å²	36	50.5 Å²	50.5	37%	0.371	26%	0.255	S	S	.	.			trans	-64.6	152.5	165.1	0	0	0	0	0	111.5	E642 E643	G640-E642 VanDerWaalsContact C-N 3.27Å; G640-E642 PolarHBondContact O-N 3.4Å; G640-E643 PolarHBondContact N-OE2 3.23Å; G640-E643 WeakPolarHBondContact O-CB 3.4Å; G640-E643 PolarHBondContact O-N 3.24Å
641	E	84.5	Confident	89.2	Confident	122 Å²	122	51 Å²	51	57%	0.57	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-41.1	-175.6	-75.3	-161.3	-160.7	0	0	113.7	K553 R634	K553-E641 IonicContact NZ-OE2 3.38Å; K553-E641 PolarHBondContact NZ-OE2 3.35Å; R634-E641 WeakPolarHBondContact CD-O 3.39Å; R634-E641 PolarHBondContact NE-O 2.95Å; R634-E641 PolarHBondContact NH1-O 3.18Å
642	E	85.8	Confident	89.3	Confident	147 Å²	147	50.4 Å²	50.4	69%	0.687	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	14.9	-177.1	-54.9	-57.7	151.3	0	0	112.2	K553 G640	K553-E642 IonicContact NZ-OE1 3.69Å; K553-E642 PolarHBondContact NZ-OE1 3.46Å; G640-E642 VanDerWaalsContact C-N 3.27Å; G640-E642 PolarHBondContact O-N 3.4Å
643	E	88.4	Confident	89.1	Confident	45 Å²	45	57.9 Å²	57.9	21%	0.21	28%	0.281	C	S	.	.			trans	-68.1	135.4	179.6	-172.9	-176.3	165.3	0	0	111.2	R634 F639 G640 V645 K648	R634-E643 PolarHBondContact NH2-O 3.35Å; F639-E643 WeakPolarHBondContact CA-OE2 3.4Å; G640-E643 PolarHBondContact N-OE2 3.23Å; G640-E643 WeakPolarHBondContact O-CB 3.4Å; G640-E643 PolarHBondContact O-N 3.24Å; E643-V645 PolarHBondContact O-N 3.49Å; E643-K648 IonicContact OE1-NZ 2.88Å; E643-K648 PolarHBondContact OE1-NZ 3.26Å
644	D	88.8	Confident	89.1	Confident	114 Å²	114	61.7 Å²	61.7	61%	0.61	30%	0.299	S	S	*	.			trans	-70.4	118.6	168.5	-173.8	10.4	0	0	0	110	K646	D644-K646 VanDerWaalsContact OD1-CB 3.28Å; D644-K646 WeakPolarHBondContact OD1-CB 3.15Å; D644-K646 PolarHBondContact OD1-N 3.49Å
645	V	89.1	Confident	89.3	Confident	25 Å²	25	57.7 Å²	57.7	15%	0.152	28%	0.284	C	S	.	.			trans	-94.8	1.8	-178.4	-61.5	0	0	0	0	112.6	V630 F639 E643 G647 K648 A649	V630-V645 HydrophobicContact CG1-CG1 4.08Å; V630-V645 HydrophobicContact CG1-CG2 4.07Å; V630-V645 HydrophobicContact CG2-CG2 4.34Å; F639-V645 HydrophobicContact CB-CG1 4.45Å; F639-V645 HydrophobicContact CD1-CG1 4.09Å; F639-V645 HydrophobicContact CD2-CG1 3.7Å; F639-V645 HydrophobicContact CE1-CG1 4.24Å; F639-V645 HydrophobicContact CE2-CB 4.49Å; F639-V645 HydrophobicContact CE2-CG1 3.88Å; F639-V645 HydrophobicContact CG-CG1 3.83Å; F639-V645 HydrophobicContact CZ-CG1 4.15Å; E643-V645 PolarHBondContact O-N 3.49Å; V645-G647 PolarHBondContact O-N 2.69Å; V645-K648 PolarHBondContact O-N 3.48Å; V645-A649 HydrophobicContact CB-CB 4.43Å; V645-A649 PolarHBondContact O-N 3.25Å
646	K	88.1	Confident	89.4	Confident	178 Å²	178	54.2 Å²	54.2	77%	0.774	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	125.3	177.2	-167	175.8	-178.6	-179	0	110	D644 K648	D644-K646 VanDerWaalsContact OD1-CB 3.28Å; D644-K646 WeakPolarHBondContact OD1-CB 3.15Å; D644-K646 PolarHBondContact OD1-N 3.49Å; K646-K648 PolarHBondContact O-N 3.15Å
647	G	87.4	Confident	89.5	Confident	15 Å²	15	59.2 Å²	59.2	16%	0.155	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	-0	-174.5	0	0	0	0	0	115.1	V645 Y650 R669	V645-G647 PolarHBondContact O-N 2.69Å; G647-Y650 VanDerWaalsContact C-OH 3.29Å; G647-Y650 VanDerWaalsContact CA-OH 3.27Å; G647-Y650 WeakPolarHBondContact CA-OH 3.31Å; G647-Y650 VanDerWaalsContact O-CE2 3.24Å; G647-Y650 WeakPolarHBondContact O-CE2 3.35Å; G647-Y650 PolarHBondContact O-OH 2.99Å; G647-R669 VanDerWaalsContact O-CD 3.27Å; G647-R669 WeakPolarHBondContact O-CD 3.06Å; G647-R669 WeakPolarHBondContact O-CG 3.33Å; G647-R669 PolarHBondContact O-NE 3.25Å
648	K	92.9	Very high	89.6	Confident	65 Å²	65	59.7 Å²	59.7	28%	0.283	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-16.1	176.9	-62.4	176.1	179.8	166.3	0	113.8	F639 E643 V645 K646 A670 R671 C672	F639-K648 HydrophobicContact CE1-CB 3.86Å; F639-K648 HydrophobicContact CE1-CD 4.26Å; F639-K648 HydrophobicContact CZ-CB 4.1Å; E643-K648 IonicContact OE1-NZ 2.88Å; E643-K648 PolarHBondContact OE1-NZ 3.26Å; V645-K648 PolarHBondContact O-N 3.48Å; K646-K648 PolarHBondContact O-N 3.15Å; K648-A670 VanDerWaalsContact O-CA 3.3Å; K648-A670 WeakPolarHBondContact O-CA 3.38Å; K648-R671 PolarHBondContact O-N 3.45Å; K648-C672 PolarHBondContact O-N 3Å
649	A	94.1	Very high	89.7	Confident	2 Å²	2	62.9 Å²	62.9	2%	0.017	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128	175.9	0	0	0	0	0	111.3	K626 V630 V645 C672	K626-A649 WeakPolarHBondContact CE-O 3.32Å; K626-A649 PolarHBondContact NZ-O 2.72Å; V630-A649 HydrophobicContact CG2-CB 3.78Å; V645-A649 HydrophobicContact CB-CB 4.43Å; V645-A649 PolarHBondContact O-N 3.25Å; A649-C672 VanDerWaalsContact CA-O 3.28Å; A649-C672 WeakPolarHBondContact CA-O 3.18Å; A649-C672 HydrophobicContact CB-CB 3.95Å
650	Y	93.9	Very high	89.6	Confident	19 Å²	19	67 Å²	67	8%	0.075	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.4	-178.2	-60.6	-94	0	0	0	110.9	G647 E654 L658 A666 R669 A670 C672 F673 A674	G647-Y650 VanDerWaalsContact C-OH 3.29Å; G647-Y650 VanDerWaalsContact CA-OH 3.27Å; G647-Y650 WeakPolarHBondContact CA-OH 3.31Å; G647-Y650 VanDerWaalsContact O-CE2 3.24Å; G647-Y650 WeakPolarHBondContact O-CE2 3.35Å; G647-Y650 PolarHBondContact O-OH 2.99Å; Y650-E654 WeakPolarHBondContact CA-OE2 3.36Å; Y650-E654 HydrophobicContact CD1-CB 4.48Å; Y650-L658 HydrophobicContact CD1-CD1 4.29Å; Y650-L658 HydrophobicContact CE1-CD1 3.97Å; Y650-A666 HydrophobicContact CE1-CB 4.35Å; Y650-A666 HydrophobicContact CE2-CB 3.93Å; Y650-R669 PolarHBondContact OH-NE 3.18Å; Y650-R669 PolarHBondContact OH-NH2 3.37Å; Y650-A670 HydrophobicContact CD2-CB 4.05Å; Y650-A670 HydrophobicContact CE2-CB 4.05Å; Y650-C672 PolarHBondContact N-O 2.84Å; Y650-F673 HydrophobicContact CD2-CE1 4.18Å; Y650-F673 HydrophobicContact CG-CE1 4.49Å; Y650-F673 CarbonylContact O-C 3.47Å; Y650-F673 VanDerWaalsContact O-CA 3.31Å; Y650-F673 WeakPolarHBondContact O-CA 3.07Å; Y650-A674 PolarHBondContact O-N 3.33Å
651	T	88.3	Confident	89.7	Confident	26 Å²	26	72.1 Å²	72.1	16%	0.16	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	160.4	159	61.8	0	0	0	0	110.5	K626 R653 E654 F655 A674	K626-T651 HydrophobicContact CB-CG2 3.87Å; K626-T651 HydrophobicContact CD-CG2 3.94Å; K626-T651 HydrophobicContact CG-CG2 4.42Å; T651-R653 PolarHBondContact O-N 3.43Å; T651-E654 PolarHBondContact N-OE2 3.27Å; T651-E654 PolarHBondContact O-N 3.42Å; T651-E654 WeakPolarHBondContact OG1-CB 3.23Å; T651-E654 VanDerWaalsContact OG1-CG 3.22Å; T651-E654 WeakPolarHBondContact OG1-CG 3Å; T651-E654 PolarHBondContact OG1-N 3.08Å; T651-E654 PolarHBondContact OG1-OE2 3.23Å; T651-F655 WeakPolarHBondContact O-CB 3.35Å; T651-F655 PolarHBondContact O-N 3.12Å; T651-A674 CarbonylContact C-O 3.57Å; T651-A674 WeakPolarHBondContact CA-O 3.44Å
652	G	85.9	Confident	90.2	Very high	2 Å²	2	71 Å²	71	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-53.1	-40.3	171.7	0	0	0	0	0	112.7	F655 D656 A674 R675	G652-F655 PolarHBondContact O-N 2.78Å; G652-D656 WeakPolarHBondContact O-CB 3.5Å; G652-D656 PolarHBondContact O-N 3.49Å; G652-A674 PolarHBondContact N-O 2.82Å; G652-R675 WeakPolarHBondContact CA-O 3.11Å; G652-R675 PolarHBondContact N-O 3.36Å
653	R	82.4	Confident	90.5	Very high	168 Å²	168	64.3 Å²	64.3	63%	0.634	32%	0.318	S	S	*	.	H	α-helix	trans	-68.3	-48.4	177.2	-174.2	175.5	-179.9	155	2.9	113	T651 F655 D656 D657	T651-R653 PolarHBondContact O-N 3.43Å; R653-F655 PolarHBondContact O-N 3.18Å; R653-D656 PolarHBondContact O-N 2.92Å; R653-D656 VanDerWaalsContact O-N 3.17Å; R653-D657 VanDerWaalsContact O-CG 3.26Å; R653-D657 PolarHBondContact O-N 2.73Å
654	E	89.4	Confident	90.8	Very high	79 Å²	79	67 Å²	67	37%	0.369	33%	0.327	S	S	.	.	H	α-helix	trans	-57.9	-35.6	175.1	-74.7	168.5	156.8	0	0	111.1	K626 Y650 T651 L658	K626-E654 IonicContact NZ-OE1 2.77Å; K626-E654 PolarHBondContact NZ-OE1 3.17Å; K626-E654 IonicContact NZ-OE2 3.3Å; K626-E654 PolarHBondContact NZ-OE2 3.34Å; Y650-E654 WeakPolarHBondContact CA-OE2 3.36Å; Y650-E654 HydrophobicContact CD1-CB 4.48Å; T651-E654 PolarHBondContact N-OE2 3.27Å; T651-E654 PolarHBondContact O-N 3.42Å; T651-E654 WeakPolarHBondContact OG1-CB 3.23Å; T651-E654 VanDerWaalsContact OG1-CG 3.22Å; T651-E654 WeakPolarHBondContact OG1-CG 3Å; T651-E654 PolarHBondContact OG1-N 3.08Å; T651-E654 PolarHBondContact OG1-OE2 3.23Å; E654-L658 WeakPolarHBondContact O-CG 3.47Å
655	F	93.2	Very high	91	Very high	1 Å²	1	66.2 Å²	66.2	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-70.6	-43.1	176.7	-174.2	-113.9	0	0	0	112	T651 G652 R653 D657 L658 Q663 A666 V667 F673 K683 I684 Y687	T651-F655 WeakPolarHBondContact O-CB 3.35Å; T651-F655 PolarHBondContact O-N 3.12Å; G652-F655 PolarHBondContact O-N 2.78Å; R653-F655 PolarHBondContact O-N 3.18Å; F655-D657 VanDerWaalsContact C-N 3.3Å; F655-D657 PolarHBondContact O-N 2.98Å; F655-L658 HydrophobicContact CD2-CD1 4.32Å; F655-L658 WeakPolarHBondContact O-CB 3.02Å; F655-L658 PolarHBondContact O-N 3.45Å; F655-Q663 HydrophobicContact CD2-CB 4.44Å; F655-Q663 HydrophobicContact CD2-CG 4.09Å; F655-Q663 HydrophobicContact CE1-CB 4.43Å; F655-Q663 HydrophobicContact CE1-CG 4.26Å; F655-Q663 HydrophobicContact CE2-CB 3.66Å; F655-Q663 HydrophobicContact CE2-CG 3.78Å; F655-Q663 HydrophobicContact CG-CG 4.46Å; F655-Q663 HydrophobicContact CZ-CB 3.67Å; F655-Q663 HydrophobicContact CZ-CG 3.88Å; F655-Q663 VanDerWaalsContact O-CG 3.3Å; F655-Q663 WeakPolarHBondContact O-CG 3.17Å; F655-Q663 PolarHBondContact O-NE2 2.74Å; F655-A666 HydrophobicContact CE2-CB 4.3Å; F655-V667 HydrophobicContact CE2-CG2 3.8Å; F655-V667 HydrophobicContact CZ-CG2 3.72Å; F655-F673 AromaticContact CD2-CE1 3.86Å; F655-F673 HydrophobicContact CD2-CE1 3.86Å; F655-F673 HydrophobicContact CE2-CE1 4.11Å; F655-F673 HydrophobicContact CG-CE1 4.24Å; F655-K683 HydrophobicContact CE1-CD 4.35Å; F655-I684 HydrophobicContact CE1-CG1 4.47Å; F655-Y687 HydrophobicContact CE1-CE2 4.4Å; F655-Y687 HydrophobicContact CZ-CD2 4.06Å; F655-Y687 AromaticContact CZ-CE2 3.9Å; F655-Y687 HydrophobicContact CZ-CE2 3.9Å
656	D	88.6	Confident	91.2	Very high	53 Å²	53	65 Å²	65	28%	0.283	31%	0.312	S	S	.	.	H	α-helix	trans	-63.8	-31.4	176.6	-96.8	-1	0	0	0	114.1	R198 G652 R653 L658 H680	R198-D656 IonicContact NH2-OD2 3.33Å; R198-D656 PolarHBondContact NH2-OD2 3.42Å; R198-D656 VanDerWaalsContact NH2-OD2 3.12Å; G652-D656 WeakPolarHBondContact O-CB 3.5Å; G652-D656 PolarHBondContact O-N 3.49Å; R653-D656 PolarHBondContact O-N 2.92Å; R653-D656 VanDerWaalsContact O-N 3.17Å; D656-L658 VanDerWaalsContact C-N 3.25Å; D656-L658 PolarHBondContact O-N 2.81Å; D656-H680 IonicContact OD1-CD2 2.66Å; D656-H680 IonicContact OD1-NE2 2.96Å; D656-H680 PolarHBondContact OD1-NE2 3.03Å; D656-H680 VanDerWaalsContact OD1-NE2 3.1Å; D656-H680 IonicContact OD2-CE1 2.87Å; D656-H680 IonicContact OD2-NE2 3.18Å; D656-H680 PolarHBondContact OD2-NE2 2.72Å
657	D	91.6	Very high	91.5	Very high	105 Å²	105	56.5 Å²	56.5	56%	0.561	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-14.4	179.6	-68.8	-23	0	0	0	112.6	R653 F655	R653-D657 VanDerWaalsContact O-CG 3.26Å; R653-D657 PolarHBondContact O-N 2.73Å; F655-D657 VanDerWaalsContact C-N 3.3Å; F655-D657 PolarHBondContact O-N 2.98Å
658	L	93.3	Very high	91.7	Very high	45 Å²	45	61.3 Å²	61.3	24%	0.236	29%	0.292	C	S	.	.	S	Bend	trans	-75.6	152.4	172.8	-63.4	175.6	0	0	0	111.6	Y650 E654 F655 D656 E662 Q663 A666	Y650-L658 HydrophobicContact CD1-CD1 4.29Å; Y650-L658 HydrophobicContact CE1-CD1 3.97Å; E654-L658 WeakPolarHBondContact O-CG 3.47Å; F655-L658 HydrophobicContact CD2-CD1 4.32Å; F655-L658 WeakPolarHBondContact O-CB 3.02Å; F655-L658 PolarHBondContact O-N 3.45Å; D656-L658 VanDerWaalsContact C-N 3.25Å; D656-L658 PolarHBondContact O-N 2.81Å; L658-E662 HydrophobicContact CB-CB 3.9Å; L658-E662 HydrophobicContact CD2-CB 4.29Å; L658-E662 HydrophobicContact CG-CB 4.46Å; L658-Q663 HydrophobicContact CB-CG 3.77Å; L658-Q663 PolarHBondContact O-NE2 3.03Å; L658-A666 HydrophobicContact CD1-CB 4Å
659	T	94.7	Very high	91.6	Very high	70 Å²	70	64.9 Å²	64.9	43%	0.429	30%	0.303	S	S	.	.			trans	-67.4	162.6	170.5	71.9	0	0	0	0	111.4	E661 E662 Q663	T659-E661 VanDerWaalsContact C-N 3.28Å; T659-E661 PolarHBondContact O-N 2.82Å; T659-E662 PolarHBondContact N-OE2 3.09Å; T659-E662 PolarHBondContact O-N 2.84Å; T659-E662 VanDerWaalsContact O-N 3.1Å; T659-E662 WeakPolarHBondContact OG1-CG 3.23Å; T659-E662 PolarHBondContact OG1-N 3.33Å; T659-Q663 WeakPolarHBondContact O-CB 3.02Å; T659-Q663 VanDerWaalsContact O-CG 3.3Å; T659-Q663 WeakPolarHBondContact O-CG 3.41Å; T659-Q663 PolarHBondContact O-N 3.12Å
660	T	91.7	Very high	91.6	Very high	90 Å²	90	64.8 Å²	64.8	55%	0.552	30%	0.303	S	S	*	.	H	α-helix	trans	-57.7	-39.1	179.8	-50.2	0	0	0	0	112.5	R664 Y687	T660-R664 PolarHBondContact O-N 3.28Å; T660-R664 VanDerWaalsContact O-N 3.13Å; T660-Y687 HydrophobicContact CG2-CE1 4.43Å; T660-Y687 WeakPolarHBondContact CG2-OH 3.49Å
661	E	91.8	Very high	91.6	Very high	143 Å²	143	67.7 Å²	67.7	67%	0.668	31%	0.313	S	S	*	.	H	α-helix	trans	-68	-41.7	174.6	-64.6	86.7	-175.6	0	0	112.2	T659 Q663 R664 E665	T659-E661 VanDerWaalsContact C-N 3.28Å; T659-E661 PolarHBondContact O-N 2.82Å; E661-Q663 VanDerWaalsContact C-N 3.34Å; E661-Q663 PolarHBondContact O-N 3.25Å; E661-R664 WeakPolarHBondContact O-CB 3.48Å; E661-R664 PolarHBondContact O-N 3.43Å; E661-E665 PolarHBondContact O-N 3.17Å
662	E	93.9	Very high	92	Very high	100 Å²	100	66.4 Å²	66.4	47%	0.467	31%	0.306	S	S	.	.	H	α-helix	trans	-66.8	-35.4	178	-72.6	177.4	156.5	0	0	112.2	L658 T659 E665 A666	L658-E662 HydrophobicContact CB-CB 3.9Å; L658-E662 HydrophobicContact CD2-CB 4.29Å; L658-E662 HydrophobicContact CG-CB 4.46Å; T659-E662 PolarHBondContact N-OE2 3.09Å; T659-E662 PolarHBondContact O-N 2.84Å; T659-E662 VanDerWaalsContact O-N 3.1Å; T659-E662 WeakPolarHBondContact OG1-CG 3.23Å; T659-E662 PolarHBondContact OG1-N 3.33Å; E662-E665 PolarHBondContact O-N 3.2Å; E662-A666 WeakPolarHBondContact O-CB 3.44Å; E662-A666 PolarHBondContact O-N 2.93Å
663	Q	93.6	Very high	92.3	Very high	5 Å²	5	66.4 Å²	66.4	2%	0.023	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-47.1	172.1	-75.3	172.5	-10.1	0	0	110.7	F655 L658 T659 E661 E665 A666 V667 Y687	F655-Q663 HydrophobicContact CD2-CB 4.44Å; F655-Q663 HydrophobicContact CD2-CG 4.09Å; F655-Q663 HydrophobicContact CE1-CB 4.43Å; F655-Q663 HydrophobicContact CE1-CG 4.26Å; F655-Q663 HydrophobicContact CE2-CB 3.66Å; F655-Q663 HydrophobicContact CE2-CG 3.78Å; F655-Q663 HydrophobicContact CG-CG 4.46Å; F655-Q663 HydrophobicContact CZ-CB 3.67Å; F655-Q663 HydrophobicContact CZ-CG 3.88Å; F655-Q663 VanDerWaalsContact O-CG 3.3Å; F655-Q663 WeakPolarHBondContact O-CG 3.17Å; F655-Q663 PolarHBondContact O-NE2 2.74Å; L658-Q663 HydrophobicContact CB-CG 3.77Å; L658-Q663 PolarHBondContact O-NE2 3.03Å; T659-Q663 WeakPolarHBondContact O-CB 3.02Å; T659-Q663 VanDerWaalsContact O-CG 3.3Å; T659-Q663 WeakPolarHBondContact O-CG 3.41Å; T659-Q663 PolarHBondContact O-N 3.12Å; E661-Q663 VanDerWaalsContact C-N 3.34Å; E661-Q663 PolarHBondContact O-N 3.25Å; Q663-E665 PolarHBondContact O-N 2.87Å; Q663-A666 PolarHBondContact O-N 2.82Å; Q663-V667 VanDerWaalsContact O-CG2 3.29Å; Q663-V667 WeakPolarHBondContact O-CG2 3.48Å; Q663-V667 PolarHBondContact O-N 3.07Å; Q663-Y687 HydrophobicContact CB-CE2 3.8Å; Q663-Y687 PolarHBondContact OE1-OH 2.95Å; Q663-Y687 VanDerWaalsContact OE1-OH 3.07Å
664	R	93.6	Very high	92.5	Very high	103 Å²	103	58.5 Å²	58.5	39%	0.389	28%	0.275	S	S	.	.	H	α-helix	trans	-59.3	-45.9	178.1	-171.5	-178.9	179.3	-148.7	-0.2	111.2	T660 E661 V667 Y687 S690 F691	T660-R664 PolarHBondContact O-N 3.28Å; T660-R664 VanDerWaalsContact O-N 3.13Å; E661-R664 WeakPolarHBondContact O-CB 3.48Å; E661-R664 PolarHBondContact O-N 3.43Å; R664-V667 PolarHBondContact O-N 2.96Å; R664-Y687 HydrophobicContact CB-CD1 3.8Å; R664-Y687 HydrophobicContact CB-CE1 3.98Å; R664-Y687 HydrophobicContact CB-CG 4.46Å; R664-Y687 HydrophobicContact CG-CD1 3.88Å; R664-Y687 HydrophobicContact CG-CE1 4.45Å; R664-S690 PolarHBondContact NE-OG 2.92Å; R664-S690 PolarHBondContact NH2-O 3.48Å; R664-F691 HydrophobicContact CG-CE1 4.43Å; R664-F691 HydrophobicContact CG-CE2 3.78Å; R664-F691 HydrophobicContact CG-CZ 3.54Å; R664-F691 WeakPolarHBondContact O-CE2 3.47Å
665	E	93	Very high	92.1	Very high	96 Å²	96	60.6 Å²	60.6	45%	0.449	28%	0.28	S	S	.	.	H	α-helix	trans	-72.2	-32.6	176.7	-72.7	-56.4	163	0	0	113.8	E661 E662 Q663 V667 K668	E661-E665 PolarHBondContact O-N 3.17Å; E662-E665 PolarHBondContact O-N 3.2Å; Q663-E665 PolarHBondContact O-N 2.87Å; E665-V667 VanDerWaalsContact C-N 3.3Å; E665-V667 PolarHBondContact O-N 2.95Å; E665-K668 WeakPolarHBondContact O-CB 3.38Å; E665-K668 PolarHBondContact O-N 3.46Å
666	A	93.6	Very high	91.6	Very high	0 Å²	0	61 Å²	61	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-42.4	174.7	0	0	0	0	0	111.2	Y650 F655 L658 E662 Q663 K668 R669 A670	Y650-A666 HydrophobicContact CE1-CB 4.35Å; Y650-A666 HydrophobicContact CE2-CB 3.93Å; F655-A666 HydrophobicContact CE2-CB 4.3Å; L658-A666 HydrophobicContact CD1-CB 4Å; E662-A666 WeakPolarHBondContact O-CB 3.44Å; E662-A666 PolarHBondContact O-N 2.93Å; Q663-A666 PolarHBondContact O-N 2.82Å; A666-K668 VanDerWaalsContact C-N 3.26Å; A666-K668 PolarHBondContact O-N 3.33Å; A666-R669 VanDerWaalsContact O-CG 3.3Å; A666-R669 WeakPolarHBondContact O-CG 3.29Å; A666-R669 PolarHBondContact O-N 3.09Å; A666-A670 WeakPolarHBondContact O-CB 3.36Å; A666-A670 PolarHBondContact O-N 3.41Å
667	V	94.4	Very high	91.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-30	179.7	172	0	0	0	0	112.5	R617 F655 Q663 R664 E665 R669 F673 I684 Y687 L688	R617-V667 PolarHBondContact NH1-O 3.02Å; R617-V667 PolarHBondContact NH2-O 3Å; F655-V667 HydrophobicContact CE2-CG2 3.8Å; F655-V667 HydrophobicContact CZ-CG2 3.72Å; Q663-V667 VanDerWaalsContact O-CG2 3.29Å; Q663-V667 WeakPolarHBondContact O-CG2 3.48Å; Q663-V667 PolarHBondContact O-N 3.07Å; R664-V667 PolarHBondContact O-N 2.96Å; E665-V667 VanDerWaalsContact C-N 3.3Å; E665-V667 PolarHBondContact O-N 2.95Å; V667-R669 VanDerWaalsContact C-N 3.31Å; V667-R669 PolarHBondContact O-N 3.03Å; V667-F673 HydrophobicContact CG2-CZ 4.12Å; V667-I684 HydrophobicContact CG1-CG2 4.22Å; V667-I684 HydrophobicContact CG2-CG1 4.45Å; V667-Y687 HydrophobicContact CG2-CD2 3.96Å; V667-Y687 HydrophobicContact CG2-CG 4.41Å; V667-L688 HydrophobicContact CG1-CD1 4.48Å; V667-L688 HydrophobicContact CG1-CD2 3.49Å; V667-L688 VanDerWaalsContact CG1-CD2 3.49Å; V667-L688 HydrophobicContact CG1-CG 3.59Å
668	K	90.7	Very high	90.4	Very high	116 Å²	116	55.3 Å²	55.3	50%	0.504	25%	0.252	S	S	.	.	H	α-helix	trans	-64.5	-33.4	176.9	-168.4	176.6	-179.6	-180	0	113.2	R617 E665 A666 F691	R617-K668 PolarHBondContact NH1-O 3.24Å; E665-K668 WeakPolarHBondContact O-CB 3.38Å; E665-K668 PolarHBondContact O-N 3.46Å; A666-K668 VanDerWaalsContact C-N 3.26Å; A666-K668 PolarHBondContact O-N 3.33Å; K668-F691 HydrophobicContact CB-CE2 4.31Å; K668-F691 HydrophobicContact CB-CZ 4.38Å; K668-F691 HydrophobicContact CD-CE1 4.5Å; K668-F691 HydrophobicContact CD-CZ 4.42Å
669	R	91.2	Very high	89.9	Confident	140 Å²	140	55.2 Å²	55.2	53%	0.528	26%	0.258	S	S	.	.	H	α-helix	trans	-106.1	-23.4	-176.9	60.9	179.7	178.1	177.5	1.8	114.5	G647 Y650 A666 V667	G647-R669 VanDerWaalsContact O-CD 3.27Å; G647-R669 WeakPolarHBondContact O-CD 3.06Å; G647-R669 WeakPolarHBondContact O-CG 3.33Å; G647-R669 PolarHBondContact O-NE 3.25Å; Y650-R669 PolarHBondContact OH-NE 3.18Å; Y650-R669 PolarHBondContact OH-NH2 3.37Å; A666-R669 VanDerWaalsContact O-CG 3.3Å; A666-R669 WeakPolarHBondContact O-CG 3.29Å; A666-R669 PolarHBondContact O-N 3.09Å; V667-R669 VanDerWaalsContact C-N 3.31Å; V667-R669 PolarHBondContact O-N 3.03Å
670	A	94.2	Very high	89.6	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.241	C	C	.	.			trans	-65.4	146	-175.7	0	0	0	0	0	111.6	R617 K648 Y650 A666 F673	R617-A670 PolarHBondContact NH1-O 3.32Å; K648-A670 VanDerWaalsContact O-CA 3.3Å; K648-A670 WeakPolarHBondContact O-CA 3.38Å; Y650-A670 HydrophobicContact CD2-CB 4.05Å; Y650-A670 HydrophobicContact CE2-CB 4.05Å; A666-A670 WeakPolarHBondContact O-CB 3.36Å; A666-A670 PolarHBondContact O-N 3.41Å; A670-F673 HydrophobicContact CB-CD2 4.48Å; A670-F673 HydrophobicContact CB-CE1 4.25Å; A670-F673 HydrophobicContact CB-CE2 3.55Å; A670-F673 HydrophobicContact CB-CZ 3.42Å; A670-F673 VanDerWaalsContact CB-CZ 3.42Å
671	R	95.3	Very high	89.5	Confident	79 Å²	79	48.7 Å²	48.7	30%	0.298	22%	0.216	S	C	.	.			trans	-130	-2.8	172.4	-57.1	-176.1	-178.8	177.4	-2.4	113	I619 M620 I638 F639 K648	I619-R671 CarbonylContact C-O 3.59Å; I619-R671 WeakPolarHBondContact CA-O 3.39Å; M620-R671 PolarHBondContact N-O 3.08Å; I638-R671 HydrophobicContact CG2-CB 3.64Å; I638-R671 HydrophobicContact CG2-CG 4.47Å; I638-R671 PolarHBondContact O-NH1 3.15Å; F639-R671 HydrophobicContact CE1-CB 3.74Å; F639-R671 HydrophobicContact CE1-CG 4.22Å; F639-R671 HydrophobicContact CZ-CB 3.84Å; K648-R671 PolarHBondContact O-N 3.45Å
672	C	95.3	Very high	89.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	123.7	179.8	-177.7	0	0	0	0	110.6	M620 F639 K648 A649 Y650	M620-C672 CarbonylContact O-C 3.6Å; M620-C672 WeakPolarHBondContact O-CA 3.38Å; F639-C672 HydrophobicContact CE2-CB 3.75Å; F639-C672 HydrophobicContact CZ-CB 3.94Å; K648-C672 PolarHBondContact O-N 3Å; A649-C672 VanDerWaalsContact CA-O 3.28Å; A649-C672 WeakPolarHBondContact CA-O 3.18Å; A649-C672 HydrophobicContact CB-CB 3.95Å; Y650-C672 PolarHBondContact N-O 2.84Å
673	F	93.7	Very high	89.3	Confident	2 Å²	2	41 Å²	41	1%	0.009	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.1	169.1	-66.1	-88.5	0	0	0	109.5	I619 M620 I621 T622 Y650 F655 V667 A670 V676 I684	I619-F673 HydrophobicContact CG2-CD2 3.76Å; I619-F673 HydrophobicContact CG2-CE2 3.94Å; M620-F673 PolarHBondContact O-N 3.22Å; I621-F673 CarbonylContact C-O 3.59Å; I621-F673 WeakPolarHBondContact CA-O 3.28Å; T622-F673 PolarHBondContact N-O 2.78Å; Y650-F673 HydrophobicContact CD2-CE1 4.18Å; Y650-F673 HydrophobicContact CG-CE1 4.49Å; Y650-F673 CarbonylContact O-C 3.47Å; Y650-F673 VanDerWaalsContact O-CA 3.31Å; Y650-F673 WeakPolarHBondContact O-CA 3.07Å; F655-F673 AromaticContact CD2-CE1 3.86Å; F655-F673 HydrophobicContact CD2-CE1 3.86Å; F655-F673 HydrophobicContact CE2-CE1 4.11Å; F655-F673 HydrophobicContact CG-CE1 4.24Å; V667-F673 HydrophobicContact CG2-CZ 4.12Å; A670-F673 HydrophobicContact CB-CD2 4.48Å; A670-F673 HydrophobicContact CB-CE1 4.25Å; A670-F673 HydrophobicContact CB-CE2 3.55Å; A670-F673 HydrophobicContact CB-CZ 3.42Å; A670-F673 VanDerWaalsContact CB-CZ 3.42Å; F673-V676 VanDerWaalsContact C-CG2 3.41Å; F673-V676 HydrophobicContact CB-CG2 3.53Å; F673-V676 WeakPolarHBondContact O-CG2 2.74Å; F673-I684 HydrophobicContact CB-CD1 4.27Å; F673-I684 HydrophobicContact CD1-CD1 3.99Å; F673-I684 HydrophobicContact CD2-CD1 3.75Å; F673-I684 HydrophobicContact CE1-CD1 4.2Å; F673-I684 HydrophobicContact CE1-CG1 4.45Å; F673-I684 HydrophobicContact CE2-CD1 3.98Å; F673-I684 HydrophobicContact CE2-CG1 4.3Å; F673-I684 HydrophobicContact CE2-CG2 4.32Å; F673-I684 HydrophobicContact CG-CD1 3.75Å; F673-I684 HydrophobicContact CZ-CD1 4.19Å; F673-I684 HydrophobicContact CZ-CG1 4.23Å
674	A	86.3	Confident	89.4	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.008	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	156.9	-177.5	0	0	0	0	0	111	T622 D624 K626 A629 Y650 T651 G652 V676	T622-A674 HydrophobicContact CG2-CB 4.35Å; T622-A674 CarbonylContact O-C 3.45Å; T622-A674 WeakPolarHBondContact O-CA 3.35Å; D624-A674 WeakPolarHBondContact O-CB 3.23Å; K626-A674 HydrophobicContact CB-CB 4.14Å; A629-A674 HydrophobicContact CB-CB 3.94Å; Y650-A674 PolarHBondContact O-N 3.33Å; T651-A674 CarbonylContact C-O 3.57Å; T651-A674 WeakPolarHBondContact CA-O 3.44Å; G652-A674 PolarHBondContact N-O 2.82Å; A674-V676 VanDerWaalsContact C-N 3.31Å; A674-V676 WeakPolarHBondContact O-CG2 3.37Å; A674-V676 PolarHBondContact O-N 3.47Å
675	R	81	Confident	89.4	Confident	124 Å²	124	36 Å²	36	47%	0.468	16%	0.162	S	C	.	.	S	Bend	trans	48.2	52.3	-177.8	-63.7	-70	179.5	175	-1.3	112.4	T622 G623 D624 G652	T622-R675 PolarHBondContact O-N 3.37Å; G623-R675 WeakPolarHBondContact O-CD 3.39Å; D624-R675 WeakPolarHBondContact O-CG 3.4Å; D624-R675 PolarHBondContact O-N 2.95Å; D624-R675 VanDerWaalsContact O-N 3.11Å; G652-R675 WeakPolarHBondContact CA-O 3.11Å; G652-R675 PolarHBondContact N-O 3.36Å
676	V	83.2	Confident	89.4	Confident	8 Å²	8	32.2 Å²	32.2	5%	0.048	15%	0.149	C	C	.	.			trans	-98.1	136.9	-170.6	-172.9	0	0	0	0	110.8	I621 T622 F673 A674 H680 K681	I621-V676 HydrophobicContact CG2-CB 3.92Å; I621-V676 HydrophobicContact CG2-CG1 3.84Å; I621-V676 HydrophobicContact CG2-CG2 3.91Å; T622-V676 PolarHBondContact O-N 2.88Å; F673-V676 VanDerWaalsContact C-CG2 3.41Å; F673-V676 HydrophobicContact CB-CG2 3.53Å; F673-V676 WeakPolarHBondContact O-CG2 2.74Å; A674-V676 VanDerWaalsContact C-N 3.31Å; A674-V676 WeakPolarHBondContact O-CG2 3.37Å; A674-V676 PolarHBondContact O-N 3.47Å; V676-H680 HydrophobicContact CG1-CB 3.35Å; V676-K681 HydrophobicContact CG1-CG 4.09Å
677	E	76.5	Confident	89.5	Confident	24 Å²	24	33.7 Å²	33.7	11%	0.112	16%	0.155	C	C	.	.			trans	-87.1	159.2	174	-71.3	-58.6	95.4	0	0	111.7	V200 N201 Q202 A679 H680 K681	V200-E677 VanDerWaalsContact CB-CD 3.46Å; V200-E677 HydrophobicContact CB-CG 4.21Å; V200-E677 VanDerWaalsContact CB-OE1 3.25Å; V200-E677 WeakPolarHBondContact CB-OE1 3.42Å; V200-E677 VanDerWaalsContact CG1-CD 3.43Å; V200-E677 HydrophobicContact CG1-CG 3.57Å; V200-E677 WeakPolarHBondContact CG1-OE1 3.43Å; N201-E677 PolarHBondContact N-OE2 3.4Å; Q202-E677 PolarHBondContact NE2-OE1 3.28Å; Q202-E677 PolarHBondContact OE1-OE1 3.13Å; E677-A679 PolarHBondContact O-N 3.36Å; E677-A679 VanDerWaalsContact O-N 3.17Å; E677-H680 PolarHBondContact N-ND1 2.81Å; E677-H680 WeakPolarHBondContact O-CB 3.14Å; E677-H680 PolarHBondContact O-N 3Å; E677-K681 PolarHBondContact O-N 3.19Å
678	P	77.4	Confident	89.5	Confident	15 Å²	15	33.7 Å²	33.7	10%	0.097	16%	0.155	C	C	.	.	H	α-helix	trans	-47.6	-44.4	173.2	-25.1	29.2	0	0	0	113.2	H680 K681 S682 N703	P678-H680 VanDerWaalsContact C-N 3.31Å; P678-H680 PolarHBondContact O-N 2.78Å; P678-K681 WeakPolarHBondContact O-CB 3.4Å; P678-K681 PolarHBondContact O-N 2.86Å; P678-S682 PolarHBondContact O-N 3.38Å; P678-N703 HydrophobicContact CB-CB 4.29Å; P678-N703 WeakPolarHBondContact CB-O 3.29Å; P678-N703 HydrophobicContact CG-CB 3.81Å
679	A	82.1	Confident	89.5	Confident	44 Å²	44	30 Å²	30	36%	0.364	14%	0.14	S	C	.	.	H	α-helix	trans	-66.5	-29.3	-179.7	0	0	0	0	0	113.4	E677 S682 K683	E677-A679 PolarHBondContact O-N 3.36Å; E677-A679 VanDerWaalsContact O-N 3.17Å; A679-S682 PolarHBondContact O-OG 3.01Å; A679-S682 VanDerWaalsContact O-OG 3.1Å; A679-K683 VanDerWaalsContact O-CB 3.24Å; A679-K683 WeakPolarHBondContact O-CB 3.4Å; A679-K683 PolarHBondContact O-N 2.67Å
680	H	88.4	Confident	89.5	Confident	16 Å²	16	25.8 Å²	25.8	7%	0.074	13%	0.132	C	C	.	.	H	α-helix	trans	-70.1	-36.8	175.3	-63.8	153.6	0	0	0	111.2	D656 V676 E677 P678 S682 K683 I684	D656-H680 IonicContact OD1-CD2 2.66Å; D656-H680 IonicContact OD1-NE2 2.96Å; D656-H680 PolarHBondContact OD1-NE2 3.03Å; D656-H680 VanDerWaalsContact OD1-NE2 3.1Å; D656-H680 IonicContact OD2-CE1 2.87Å; D656-H680 IonicContact OD2-NE2 3.18Å; D656-H680 PolarHBondContact OD2-NE2 2.72Å; V676-H680 HydrophobicContact CG1-CB 3.35Å; E677-H680 PolarHBondContact N-ND1 2.81Å; E677-H680 WeakPolarHBondContact O-CB 3.14Å; E677-H680 PolarHBondContact O-N 3Å; P678-H680 VanDerWaalsContact C-N 3.31Å; P678-H680 PolarHBondContact O-N 2.78Å; H680-S682 PolarHBondContact O-N 3.04Å; H680-K683 PolarHBondContact O-N 2.71Å; H680-I684 WeakPolarHBondContact O-CB 3.42Å; H680-I684 WeakPolarHBondContact O-CD1 3.28Å; H680-I684 WeakPolarHBondContact O-CG1 3.28Å; H680-I684 PolarHBondContact O-N 2.83Å
681	K	90.5	Very high	89.4	Confident	6 Å²	6	28.1 Å²	28.1	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-58	-50.4	178	-65.3	-173.8	168.2	-157	0	110.6	D351 I621 V676 E677 P678 K683 I684 V685 M697 D704 A707	D351-K681 IonicContact OD1-NZ 2.68Å; D351-K681 PolarHBondContact OD1-NZ 3.11Å; I621-K681 HydrophobicContact CG2-CD 4.39Å; I621-K681 HydrophobicContact CG2-CG 4.05Å; V676-K681 HydrophobicContact CG1-CG 4.09Å; E677-K681 PolarHBondContact O-N 3.19Å; P678-K681 WeakPolarHBondContact O-CB 3.4Å; P678-K681 PolarHBondContact O-N 2.86Å; K681-K683 VanDerWaalsContact C-N 3.34Å; K681-K683 PolarHBondContact O-N 2.87Å; K681-I684 PolarHBondContact O-N 3.19Å; K681-V685 WeakPolarHBondContact O-CG2 3.4Å; K681-V685 PolarHBondContact O-N 3.13Å; K681-V685 VanDerWaalsContact O-N 3.11Å; K681-M697 HydrophobicContact CB-CE 3.99Å; K681-M697 HydrophobicContact CD-CE 3.61Å; K681-M697 HydrophobicContact CG-CE 4.01Å; K681-D704 WeakPolarHBondContact CD-OD1 3.38Å; K681-D704 VanDerWaalsContact CE-OD1 3.26Å; K681-D704 WeakPolarHBondContact CE-OD1 3.41Å; K681-D704 IonicContact NZ-OD1 2.63Å; K681-D704 PolarHBondContact NZ-OD1 3.04Å; K681-D704 IonicContact NZ-OD2 2.8Å; K681-A707 HydrophobicContact CB-CB 3.5Å
682	S	89.9	Confident	89.1	Confident	18 Å²	18	28.7 Å²	28.7	13%	0.126	15%	0.151	C	C	.	.	H	α-helix	trans	-69.5	-28.6	177.6	64.4	0	0	0	0	113.7	P678 A679 H680 G686 K710	P678-S682 PolarHBondContact O-N 3.38Å; A679-S682 PolarHBondContact O-OG 3.01Å; A679-S682 VanDerWaalsContact O-OG 3.1Å; H680-S682 PolarHBondContact O-N 3.04Å; S682-G686 PolarHBondContact O-N 2.89Å; S682-K710 WeakPolarHBondContact O-CD 3.47Å; S682-K710 PolarHBondContact O-NZ 2.91Å
683	K	91.9	Very high	89	Confident	65 Å²	65	31.8 Å²	31.8	28%	0.283	17%	0.165	S	C	.	.	H	α-helix	trans	-70.7	-41.6	173.9	-168.8	175.8	-179.5	-172.5	0	112	F655 A679 H680 K681 G686 Y687	F655-K683 HydrophobicContact CE1-CD 4.35Å; A679-K683 VanDerWaalsContact O-CB 3.24Å; A679-K683 WeakPolarHBondContact O-CB 3.4Å; A679-K683 PolarHBondContact O-N 2.67Å; H680-K683 PolarHBondContact O-N 2.71Å; K681-K683 VanDerWaalsContact C-N 3.34Å; K681-K683 PolarHBondContact O-N 2.87Å; K683-G686 PolarHBondContact O-N 2.99Å; K683-Y687 HydrophobicContact CD-CE2 4.12Å; K683-Y687 WeakPolarHBondContact CE-OH 3.49Å; K683-Y687 HydrophobicContact CG-CD2 4.09Å; K683-Y687 HydrophobicContact CG-CE2 3.56Å; K683-Y687 WeakPolarHBondContact O-CD2 3.48Å; K683-Y687 PolarHBondContact O-N 2.89Å
684	I	94.8	Very high	89	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-49.6	174.1	-69.7	160.8	0	0	0	109.8	I621 F655 V667 F673 H680 K681 G686 Y687 L688	I621-I684 HydrophobicContact CD1-CD1 4.23Å; F655-I684 HydrophobicContact CE1-CG1 4.47Å; V667-I684 HydrophobicContact CG1-CG2 4.22Å; V667-I684 HydrophobicContact CG2-CG1 4.45Å; F673-I684 HydrophobicContact CB-CD1 4.27Å; F673-I684 HydrophobicContact CD1-CD1 3.99Å; F673-I684 HydrophobicContact CD2-CD1 3.75Å; F673-I684 HydrophobicContact CE1-CD1 4.2Å; F673-I684 HydrophobicContact CE1-CG1 4.45Å; F673-I684 HydrophobicContact CE2-CD1 3.98Å; F673-I684 HydrophobicContact CE2-CG1 4.3Å; F673-I684 HydrophobicContact CE2-CG2 4.32Å; F673-I684 HydrophobicContact CG-CD1 3.75Å; F673-I684 HydrophobicContact CZ-CD1 4.19Å; F673-I684 HydrophobicContact CZ-CG1 4.23Å; H680-I684 WeakPolarHBondContact O-CB 3.42Å; H680-I684 WeakPolarHBondContact O-CD1 3.28Å; H680-I684 WeakPolarHBondContact O-CG1 3.28Å; H680-I684 PolarHBondContact O-N 2.83Å; K681-I684 PolarHBondContact O-N 3.19Å; I684-G686 VanDerWaalsContact C-N 3.34Å; I684-G686 PolarHBondContact O-N 3.32Å; I684-Y687 PolarHBondContact O-N 3.46Å; I684-L688 HydrophobicContact CG2-CD1 4.09Å; I684-L688 WeakPolarHBondContact O-CG 3.32Å; I684-L688 PolarHBondContact O-N 2.83Å
685	V	94.1	Very high	89.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-56	-49	175.2	173.5	0	0	0	0	110.6	K681 Y687 L688 Q689 T695 M697 K710 A711	K681-V685 WeakPolarHBondContact O-CG2 3.4Å; K681-V685 PolarHBondContact O-N 3.13Å; K681-V685 VanDerWaalsContact O-N 3.11Å; V685-Y687 VanDerWaalsContact C-N 3.29Å; V685-Y687 PolarHBondContact O-N 3.35Å; V685-L688 WeakPolarHBondContact O-CB 3.37Å; V685-L688 PolarHBondContact O-N 3.21Å; V685-Q689 HydrophobicContact CG1-CG 4.33Å; V685-Q689 VanDerWaalsContact O-CG 3.3Å; V685-Q689 WeakPolarHBondContact O-CG 3.46Å; V685-Q689 PolarHBondContact O-N 3.06Å; V685-T695 HydrophobicContact CG2-CG2 4.29Å; V685-M697 HydrophobicContact CG2-CB 4.42Å; V685-K710 HydrophobicContact CG1-CB 4.39Å; V685-K710 HydrophobicContact CG1-CG 4.1Å; V685-A711 HydrophobicContact CG1-CB 4.05Å; V685-A711 HydrophobicContact CG2-CB 4.49Å
686	G	92.3	Very high	90.2	Very high	18 Å²	18	26.3 Å²	26.3	19%	0.186	15%	0.145	C	C	.	.	H	α-helix	trans	-58.8	-35	177.9	0	0	0	0	0	114.6	S682 K683 I684 S690	S682-G686 PolarHBondContact O-N 2.89Å; K683-G686 PolarHBondContact O-N 2.99Å; I684-G686 VanDerWaalsContact C-N 3.34Å; I684-G686 PolarHBondContact O-N 3.32Å; G686-S690 PolarHBondContact O-N 3.31Å; G686-S690 VanDerWaalsContact O-N 3.16Å
687	Y	95.3	Very high	90.7	Very high	30 Å²	30	25.9 Å²	25.9	12%	0.118	14%	0.143	C	C	.	.	H	α-helix	trans	-72.2	-38.1	174.1	-72.9	-52.6	0	0	0	112.7	F655 T660 Q663 R664 V667 K683 I684 V685 Q689 S690 F691	F655-Y687 HydrophobicContact CE1-CE2 4.4Å; F655-Y687 HydrophobicContact CZ-CD2 4.06Å; F655-Y687 AromaticContact CZ-CE2 3.9Å; F655-Y687 HydrophobicContact CZ-CE2 3.9Å; T660-Y687 HydrophobicContact CG2-CE1 4.43Å; T660-Y687 WeakPolarHBondContact CG2-OH 3.49Å; Q663-Y687 HydrophobicContact CB-CE2 3.8Å; Q663-Y687 PolarHBondContact OE1-OH 2.95Å; Q663-Y687 VanDerWaalsContact OE1-OH 3.07Å; R664-Y687 HydrophobicContact CB-CD1 3.8Å; R664-Y687 HydrophobicContact CB-CE1 3.98Å; R664-Y687 HydrophobicContact CB-CG 4.46Å; R664-Y687 HydrophobicContact CG-CD1 3.88Å; R664-Y687 HydrophobicContact CG-CE1 4.45Å; V667-Y687 HydrophobicContact CG2-CD2 3.96Å; V667-Y687 HydrophobicContact CG2-CG 4.41Å; K683-Y687 HydrophobicContact CD-CE2 4.12Å; K683-Y687 WeakPolarHBondContact CE-OH 3.49Å; K683-Y687 HydrophobicContact CG-CD2 4.09Å; K683-Y687 HydrophobicContact CG-CE2 3.56Å; K683-Y687 WeakPolarHBondContact O-CD2 3.48Å; K683-Y687 PolarHBondContact O-N 2.89Å; I684-Y687 PolarHBondContact O-N 3.46Å; V685-Y687 VanDerWaalsContact C-N 3.29Å; V685-Y687 PolarHBondContact O-N 3.35Å; Y687-Q689 VanDerWaalsContact C-N 3.34Å; Y687-S690 WeakPolarHBondContact O-CB 3.36Å; Y687-S690 PolarHBondContact O-N 3.41Å; Y687-S690 PolarHBondContact O-OG 2.94Å; Y687-F691 WeakPolarHBondContact O-CD2 3.27Å
688	L	94.8	Very high	91.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.7	-44.8	174.5	-67.2	168.5	0	0	0	110.9	V347 C349 I619 V667 I684 V685 S690 F691 E693 T695	V347-L688 HydrophobicContact CB-CD1 4.48Å; V347-L688 HydrophobicContact CG1-CD1 3.92Å; V347-L688 HydrophobicContact CG1-CD2 4.34Å; V347-L688 HydrophobicContact CG2-CD2 4.29Å; C349-L688 VanDerWaalsContact SG-CD1 3.59Å; I619-L688 HydrophobicContact CD1-CD1 4.34Å; I619-L688 HydrophobicContact CD1-CD2 4.45Å; V667-L688 HydrophobicContact CG1-CD1 4.48Å; V667-L688 HydrophobicContact CG1-CD2 3.49Å; V667-L688 VanDerWaalsContact CG1-CD2 3.49Å; V667-L688 HydrophobicContact CG1-CG 3.59Å; I684-L688 HydrophobicContact CG2-CD1 4.09Å; I684-L688 WeakPolarHBondContact O-CG 3.32Å; I684-L688 PolarHBondContact O-N 2.83Å; V685-L688 WeakPolarHBondContact O-CB 3.37Å; V685-L688 PolarHBondContact O-N 3.21Å; L688-S690 PolarHBondContact O-N 2.89Å; L688-F691 WeakPolarHBondContact O-CB 3.32Å; L688-F691 PolarHBondContact O-N 3.27Å; L688-E693 HydrophobicContact CB-CB 4.39Å; L688-E693 WeakPolarHBondContact O-CB 3.23Å; L688-E693 PolarHBondContact O-N 2.87Å; L688-T695 VanDerWaalsContact CB-OG1 3.27Å; L688-T695 WeakPolarHBondContact CB-OG1 3.48Å; L688-T695 HydrophobicContact CD1-CG2 3.64Å
689	Q	91.1	Very high	92	Very high	40 Å²	40	24 Å²	24	19%	0.187	13%	0.133	C	C	.	.	H	α-helix	trans	-56.9	-38	174	-69.3	177.5	-45.7	0	0	112.4	V685 Y687 F691 D692 K710 E712	V685-Q689 HydrophobicContact CG1-CG 4.33Å; V685-Q689 VanDerWaalsContact O-CG 3.3Å; V685-Q689 WeakPolarHBondContact O-CG 3.46Å; V685-Q689 PolarHBondContact O-N 3.06Å; Y687-Q689 VanDerWaalsContact C-N 3.34Å; Q689-F691 PolarHBondContact O-N 3.26Å; Q689-D692 PolarHBondContact O-N 2.83Å; Q689-K710 PolarHBondContact NE2-O 3.23Å; Q689-E712 VanDerWaalsContact CG-OE1 3.24Å; Q689-E712 WeakPolarHBondContact CG-OE1 3.2Å; Q689-E712 PolarHBondContact NE2-OE1 3.47Å
690	S	91.8	Very high	92	Very high	51 Å²	51	23 Å²	23	36%	0.357	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-7.8	176.4	85.5	0	0	0	0	114.9	R664 G686 Y687 L688	R664-S690 PolarHBondContact NE-OG 2.92Å; R664-S690 PolarHBondContact NH2-O 3.48Å; G686-S690 PolarHBondContact O-N 3.31Å; G686-S690 VanDerWaalsContact O-N 3.16Å; Y687-S690 WeakPolarHBondContact O-CB 3.36Å; Y687-S690 PolarHBondContact O-N 3.41Å; Y687-S690 PolarHBondContact O-OG 2.94Å; L688-S690 PolarHBondContact O-N 2.89Å
691	F	91.5	Very high	91.5	Very high	49 Å²	49	22.4 Å²	22.4	22%	0.215	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	11	173.2	-64.1	-67.3	0	0	0	113	R664 K668 Y687 L688 Q689 E693	R664-F691 HydrophobicContact CG-CE1 4.43Å; R664-F691 HydrophobicContact CG-CE2 3.78Å; R664-F691 HydrophobicContact CG-CZ 3.54Å; R664-F691 WeakPolarHBondContact O-CE2 3.47Å; K668-F691 HydrophobicContact CB-CE2 4.31Å; K668-F691 HydrophobicContact CB-CZ 4.38Å; K668-F691 HydrophobicContact CD-CE1 4.5Å; K668-F691 HydrophobicContact CD-CZ 4.42Å; Y687-F691 WeakPolarHBondContact O-CD2 3.27Å; L688-F691 WeakPolarHBondContact O-CB 3.32Å; L688-F691 PolarHBondContact O-N 3.27Å; Q689-F691 PolarHBondContact O-N 3.26Å; F691-E693 HydrophobicContact CB-CG 3.94Å; F691-E693 PolarHBondContact O-N 3.09Å
692	D	89.8	Confident	91.1	Very high	91 Å²	91	22.1 Å²	22.1	49%	0.487	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	25.4	-172.3	-49.9	-72	0	0	0	113.4	Q689 K822	Q689-D692 PolarHBondContact O-N 2.83Å; D692-K822 WeakPolarHBondContact OD1-CE 3.48Å; D692-K822 IonicContact OD1-NZ 2.65Å; D692-K822 PolarHBondContact OD1-NZ 3.33Å; D692-K822 IonicContact OD2-NZ 2.62Å; D692-K822 PolarHBondContact OD2-NZ 2.92Å
693	E	92.9	Very high	90.6	Very high	64 Å²	64	21.6 Å²	21.6	30%	0.299	11%	0.114	S	C	.	.			trans	-83.8	123	177.2	-63.5	-78.6	-167.2	0	0	110.3	S346 V347 L688 F691 T695	S346-E693 WeakPolarHBondContact CB-OE2 3.45Å; S346-E693 PolarHBondContact OG-OE2 3.4Å; V347-E693 HydrophobicContact CG2-CB 4.19Å; V347-E693 HydrophobicContact CG2-CG 4.43Å; L688-E693 HydrophobicContact CB-CB 4.39Å; L688-E693 WeakPolarHBondContact O-CB 3.23Å; L688-E693 PolarHBondContact O-N 2.87Å; F691-E693 HydrophobicContact CB-CG 3.94Å; F691-E693 PolarHBondContact O-N 3.09Å; E693-T695 PolarHBondContact O-N 3.28Å; E693-T695 PolarHBondContact O-OG1 2.9Å
694	I	94.1	Very high	90.3	Very high	12 Å²	12	18.5 Å²	18.5	6%	0.062	10%	0.1	C	C	.	.			trans	-75.7	110.1	175	-55.7	-60.5	0	0	0	108.4	P248 T341 C344 S346 V347 E712 P821	P248-I694 HydrophobicContact CG-CD1 3.93Å; T341-I694 HydrophobicContact CG2-CG2 3.93Å; C344-I694 HydrophobicContact CB-CG1 4.15Å; C344-I694 HydrophobicContact CB-CG2 4.45Å; C344-I694 WeakPolarHBondContact O-CB 3.36Å; S346-I694 PolarHBondContact N-O 2.98Å; S346-I694 PolarHBondContact OG-N 3.21Å; S346-I694 VanDerWaalsContact OG-N 3.15Å; S346-I694 PolarHBondContact OG-O 3.35Å; V347-I694 PolarHBondContact N-O 3.49Å; I694-E712 HydrophobicContact CD1-CG 4.06Å; I694-E712 HydrophobicContact CG2-CB 3.97Å; I694-E712 HydrophobicContact CG2-CG 4.18Å; I694-P821 HydrophobicContact CD1-CB 4.25Å; I694-P821 HydrophobicContact CD1-CG 3.64Å; I694-P821 HydrophobicContact CG1-CG 3.53Å
695	T	95	Very high	89.9	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.5	-170.3	-55.8	0	0	0	0	110.3	V347 V685 L688 E693 E712 I713	V347-T695 WeakPolarHBondContact O-CA 3.47Å; V685-T695 HydrophobicContact CG2-CG2 4.29Å; L688-T695 VanDerWaalsContact CB-OG1 3.27Å; L688-T695 WeakPolarHBondContact CB-OG1 3.48Å; L688-T695 HydrophobicContact CD1-CG2 3.64Å; E693-T695 PolarHBondContact O-N 3.28Å; E693-T695 PolarHBondContact O-OG1 2.9Å; T695-E712 WeakPolarHBondContact CA-OE2 3.26Å; T695-E712 WeakPolarHBondContact CB-OE2 3.49Å; T695-E712 PolarHBondContact N-OE2 3.19Å; T695-E712 PolarHBondContact O-N 2.9Å; T695-I713 PolarHBondContact O-N 3.38Å
696	A	96	Very high	89.5	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.4	163.6	0	0	0	0	0	109.5	T345 V347 I348 C349 I713 I715	T345-A696 HydrophobicContact CG2-CB 3.69Å; V347-A696 PolarHBondContact O-N 3.41Å; I348-A696 CarbonylContact C-O 3.54Å; I348-A696 WeakPolarHBondContact CA-O 3.1Å; I348-A696 HydrophobicContact CG1-CB 4.26Å; C349-A696 PolarHBondContact N-O 3.25Å; A696-I713 CarbonylContact C-O 3.09Å; A696-I713 VanDerWaalsContact CA-O 3.22Å; A696-I713 WeakPolarHBondContact CA-O 3.21Å; A696-I713 HydrophobicContact CB-CB 4.21Å; A696-I715 HydrophobicContact CB-CD1 3.99Å
697	M	95.3	Very high	89.4	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.1	177.1	179.1	64.8	-172	0	0	109.4	C349 I621 K681 V685 A707 L708 A711 I713 I715	C349-M697 HydrophobicContact CB-SD 3.47Å; C349-M697 WeakPolarHBondContact CB-SD 3.39Å; C349-M697 CarbonylContact O-C 3.6Å; C349-M697 WeakPolarHBondContact O-CA 3.14Å; I621-M697 HydrophobicContact CD1-CE 4.15Å; I621-M697 HydrophobicContact CD1-SD 4.1Å; K681-M697 HydrophobicContact CB-CE 3.99Å; K681-M697 HydrophobicContact CD-CE 3.61Å; K681-M697 HydrophobicContact CG-CE 4.01Å; V685-M697 HydrophobicContact CG2-CB 4.42Å; M697-A707 HydrophobicContact CE-CB 4.16Å; M697-A707 HydrophobicContact CG-CB 4.02Å; M697-L708 HydrophobicContact CB-CD2 4.45Å; M697-L708 HydrophobicContact CG-CD2 4.22Å; M697-L708 WeakPolarHBondContact O-CD2 3.48Å; M697-A711 HydrophobicContact CB-CB 3.63Å; M697-I713 PolarHBondContact N-O 3.07Å; M697-I715 PolarHBondContact O-N 3.2Å
698	T	93	Very high	89.2	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	144.2	173.3	87.9	0	0	0	0	111.7	I348 C349 S350 D351 T355 I715 I740	I348-T698 HydrophobicContact CG2-CG2 4.43Å; C349-T698 PolarHBondContact O-N 3.37Å; S350-T698 VanDerWaalsContact CA-OG1 3.23Å; S350-T698 WeakPolarHBondContact CA-OG1 3.45Å; S350-T698 PolarHBondContact OG-OG1 3.04Å; D351-T698 PolarHBondContact N-OG1 3.33Å; T355-T698 HydrophobicContact CG2-CG2 4.49Å; T698-I715 CarbonylContact C-O 3.37Å; T698-I715 VanDerWaalsContact CA-O 3.23Å; T698-I715 WeakPolarHBondContact CA-O 3.36Å; T698-I715 HydrophobicContact CG2-CB 4.13Å; T698-I715 HydrophobicContact CG2-CD1 4.38Å; T698-I715 HydrophobicContact CG2-CG2 4.41Å; T698-I740 HydrophobicContact CG2-CD1 3.53Å
699	G	87.5	Confident	88.9	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.9	160	177.8	0	0	0	0	0	112.9	D704 I715 A716 M717	G699-D704 VanDerWaalsContact CA-OD2 3.24Å; G699-D704 WeakPolarHBondContact CA-OD2 3.1Å; G699-I715 PolarHBondContact N-O 3.28Å; G699-A716 VanDerWaalsContact O-CA 3.29Å; G699-A716 WeakPolarHBondContact O-CA 3.22Å; G699-M717 PolarHBondContact O-N 2.98Å
700	D	82.3	Confident	88.8	Confident	22 Å²	22	19.1 Å²	19.1	12%	0.118	10%	0.098	C	C	.	.			trans	-128	-22.6	-179	69.1	-29.8	0	0	0	112.4	D704 M717 G720 T721 A724	D700-D704 PolarHBondContact N-OD2 2.99Å; D700-M717 HydrophobicContact CB-CB 3.85Å; D700-M717 HydrophobicContact CB-CG 3.66Å; D700-G720 WeakPolarHBondContact O-CA 3.38Å; D700-T721 WeakPolarHBondContact O-CB 3.4Å; D700-T721 WeakPolarHBondContact O-CG2 3.33Å; D700-T721 PolarHBondContact O-N 3.3Å; D700-T721 PolarHBondContact O-OG1 3.42Å; D700-A724 WeakPolarHBondContact O-CB 3.16Å
701	G	78.6	Confident	88.8	Confident	3 Å²	3	16.9 Å²	16.9	3%	0.031	8%	0.082	C	C	.	.	S	Bend	trans	-100.1	170	-176.9	0	0	0	0	0	115.2	N703 D704	G701-N703 WeakPolarHBondContact CA-OD1 2.85Å; G701-N703 PolarHBondContact O-N 2.93Å; G701-D704 PolarHBondContact N-OD2 2.89Å; G701-D704 PolarHBondContact O-N 3.47Å; G701-D704 VanDerWaalsContact O-N 3.13Å
702	V	80.3	Confident	88.8	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-65.9	-29.9	175	179.8	0	0	0	0	110.7	L119 I179 I232 I235 D704 A705 V723	L119-V702 HydrophobicContact CD2-CG1 4.27Å; I179-V702 HydrophobicContact CB-CB 4.43Å; I179-V702 HydrophobicContact CB-CG2 4.04Å; I179-V702 HydrophobicContact CG2-CG2 4.37Å; I179-V702 VanDerWaalsContact O-CB 3.26Å; I179-V702 WeakPolarHBondContact O-CB 3.2Å; I179-V702 PolarHBondContact O-N 3.02Å; I179-V702 VanDerWaalsContact O-N 3.15Å; I232-V702 HydrophobicContact CD1-CG1 4.46Å; I232-V702 HydrophobicContact CG1-CG1 4.29Å; I235-V702 HydrophobicContact CD1-CG1 4.44Å; I235-V702 HydrophobicContact CG2-CG1 4.11Å; V702-D704 PolarHBondContact O-N 3.49Å; V702-A705 WeakPolarHBondContact O-CB 3.5Å; V702-A705 PolarHBondContact O-N 3.28Å; V702-V723 HydrophobicContact CG1-CG1 4.19Å; V702-V723 HydrophobicContact CG2-CB 3.99Å; V702-V723 HydrophobicContact CG2-CG1 4.34Å; V702-V723 HydrophobicContact CG2-CG2 3.95Å
703	N	79.7	Confident	89	Confident	8 Å²	8	12 Å²	12	4%	0.043	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-59.3	-22.4	172.4	54	-72.1	0	0	0	114.5	I179 L180 P678 G701	I179-N703 PolarHBondContact O-N 2.78Å; I179-N703 VanDerWaalsContact O-N 3.1Å; I179-N703 PolarHBondContact O-OD1 3.44Å; I179-N703 VanDerWaalsContact O-OD1 3.13Å; L180-N703 WeakPolarHBondContact O-CB 3.38Å; P678-N703 HydrophobicContact CB-CB 4.29Å; P678-N703 WeakPolarHBondContact CB-O 3.29Å; P678-N703 HydrophobicContact CG-CB 3.81Å; G701-N703 WeakPolarHBondContact CA-OD1 2.85Å; G701-N703 PolarHBondContact O-N 2.93Å
704	D	86.8	Confident	89.1	Confident	0 Å²	0	9 Å²	9	0%	0	4%	0.043	C	C	.	.	G	3₁₀ helix	trans	-92.3	-18.6	-178.3	-58.6	-33.7	0	0	0	112.1	K681 G699 D700 G701 V702 P706 A707 L708	K681-D704 WeakPolarHBondContact CD-OD1 3.38Å; K681-D704 VanDerWaalsContact CE-OD1 3.26Å; K681-D704 WeakPolarHBondContact CE-OD1 3.41Å; K681-D704 IonicContact NZ-OD1 2.63Å; K681-D704 PolarHBondContact NZ-OD1 3.04Å; K681-D704 IonicContact NZ-OD2 2.8Å; G699-D704 VanDerWaalsContact CA-OD2 3.24Å; G699-D704 WeakPolarHBondContact CA-OD2 3.1Å; D700-D704 PolarHBondContact N-OD2 2.99Å; G701-D704 PolarHBondContact N-OD2 2.89Å; G701-D704 PolarHBondContact O-N 3.47Å; G701-D704 VanDerWaalsContact O-N 3.13Å; V702-D704 PolarHBondContact O-N 3.49Å; D704-P706 VanDerWaalsContact C-CD 3.48Å; D704-A707 CarbonylContact O-C 3.57Å; D704-A707 WeakPolarHBondContact O-CA 3.32Å; D704-A707 PolarHBondContact O-N 2.87Å; D704-L708 HydrophobicContact CB-CD1 3.98Å; D704-L708 HydrophobicContact CB-CG 4.14Å; D704-L708 WeakPolarHBondContact O-CG 3Å; D704-L708 PolarHBondContact O-N 3.09Å
705	A	85.6	Confident	89.1	Confident	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-53.8	-41	-173.7	0	0	0	0	0	114.4	M239 V702 A707 L708 K709 V723 A727	M239-A705 HydrophobicContact CE-CB 3.86Å; M239-A705 HydrophobicContact CG-CB 4.39Å; M239-A705 HydrophobicContact SD-CB 3.44Å; M239-A705 WeakPolarHBondContact SD-CB 3.2Å; V702-A705 WeakPolarHBondContact O-CB 3.5Å; V702-A705 PolarHBondContact O-N 3.28Å; A705-A707 VanDerWaalsContact C-N 3.33Å; A705-A707 PolarHBondContact O-N 3.26Å; A705-L708 PolarHBondContact O-N 2.97Å; A705-K709 WeakPolarHBondContact O-CB 3.37Å; A705-K709 PolarHBondContact O-N 2.89Å; A705-V723 HydrophobicContact CB-CG1 3.8Å; A705-A727 HydrophobicContact CB-CB 3.8Å
706	P	86.4	Confident	88.9	Confident	1 Å²	1	8.4 Å²	8.4	1%	0.006	4%	0.04	C	C	.	.	H	α-helix	trans	-64.7	-35.5	174.7	-22.1	34.5	0	0	0	113.3	I235 Q238 M239 D704 K710	I235-P706 HydrophobicContact CB-CG 4.39Å; I235-P706 HydrophobicContact CG2-CG 3.72Å; Q238-P706 HydrophobicContact CB-CB 4.17Å; Q238-P706 HydrophobicContact CB-CG 4.37Å; M239-P706 HydrophobicContact CG-CB 4.44Å; M239-P706 HydrophobicContact CG-CG 4.14Å; D704-P706 VanDerWaalsContact C-CD 3.48Å; P706-K710 WeakPolarHBondContact O-CB 3.47Å; P706-K710 PolarHBondContact O-N 3.02Å
707	A	90.6	Very high	88.6	Confident	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-78.8	-36.4	179.6	0	0	0	0	0	111.8	K681 M697 D704 A705 K710 A711	K681-A707 HydrophobicContact CB-CB 3.5Å; M697-A707 HydrophobicContact CE-CB 4.16Å; M697-A707 HydrophobicContact CG-CB 4.02Å; D704-A707 CarbonylContact O-C 3.57Å; D704-A707 WeakPolarHBondContact O-CA 3.32Å; D704-A707 PolarHBondContact O-N 2.87Å; A705-A707 VanDerWaalsContact C-N 3.33Å; A705-A707 PolarHBondContact O-N 3.26Å; A707-K710 PolarHBondContact O-N 3.37Å; A707-A711 WeakPolarHBondContact O-CB 3.39Å; A707-A711 PolarHBondContact O-N 3.48Å
708	L	90.9	Very high	88	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.8	-52.2	173.2	-69.6	172.5	0	0	0	110.6	M697 D704 A705 K710 A711 G714 I715 A724 A727	M697-L708 HydrophobicContact CB-CD2 4.45Å; M697-L708 HydrophobicContact CG-CD2 4.22Å; M697-L708 WeakPolarHBondContact O-CD2 3.48Å; D704-L708 HydrophobicContact CB-CD1 3.98Å; D704-L708 HydrophobicContact CB-CG 4.14Å; D704-L708 WeakPolarHBondContact O-CG 3Å; D704-L708 PolarHBondContact O-N 3.09Å; A705-L708 PolarHBondContact O-N 2.97Å; L708-K710 VanDerWaalsContact C-N 3.27Å; L708-K710 PolarHBondContact O-N 2.84Å; L708-A711 PolarHBondContact O-N 3.37Å; L708-G714 WeakPolarHBondContact O-CA 3.45Å; L708-I715 WeakPolarHBondContact CD2-O 3.44Å; L708-A724 HydrophobicContact CD1-CB 3.95Å; L708-A727 CarbonylContact C-O 3.47Å; L708-A727 HydrophobicContact CB-CB 4.24Å; L708-A727 WeakPolarHBondContact CB-O 3.45Å
709	K	87.3	Confident	87.3	Confident	36 Å²	36	13.7 Å²	13.7	16%	0.157	8%	0.081	C	C	.	.	H	α-helix	trans	-65.2	-30.6	179.5	-173	173.9	179.9	-172.9	0	113.1	M239 T242 A705 A727	M239-K709 HydrophobicContact CB-CD 4.33Å; M239-K709 WeakPolarHBondContact O-CD 3.28Å; M239-K709 WeakPolarHBondContact O-CE 3.19Å; M239-K709 PolarHBondContact O-NZ 2.97Å; T242-K709 HydrophobicContact CG2-CG 4.44Å; T242-K709 WeakPolarHBondContact O-CE 3.17Å; A705-K709 WeakPolarHBondContact O-CB 3.37Å; A705-K709 PolarHBondContact O-N 2.89Å; K709-A727 PolarHBondContact N-O 3.38Å
710	K	89.6	Confident	86.7	Confident	65 Å²	65	14.1 Å²	14.1	28%	0.283	9%	0.085	S	C	.	.	H	α-helix	trans	-79.7	-31.5	-179.4	-172.2	169.7	-179.4	-178.1	0	113	T242 S682 V685 Q689 P706 A707 L708	T242-K710 HydrophobicContact CG2-CB 3.8Å; T242-K710 HydrophobicContact CG2-CG 4.09Å; S682-K710 WeakPolarHBondContact O-CD 3.47Å; S682-K710 PolarHBondContact O-NZ 2.91Å; V685-K710 HydrophobicContact CG1-CB 4.39Å; V685-K710 HydrophobicContact CG1-CG 4.1Å; Q689-K710 PolarHBondContact NE2-O 3.23Å; P706-K710 WeakPolarHBondContact O-CB 3.47Å; P706-K710 PolarHBondContact O-N 3.02Å; A707-K710 PolarHBondContact O-N 3.37Å; L708-K710 VanDerWaalsContact C-N 3.27Å; L708-K710 PolarHBondContact O-N 2.84Å
711	A	92.4	Very high	86.5	Confident	4 Å²	4	14.4 Å²	14.4	3%	0.033	9%	0.088	C	C	.	.	S	Bend	trans	-66	152.1	177.8	0	0	0	0	0	110.4	V685 M697 A707 L708 I713	V685-A711 HydrophobicContact CG1-CB 4.05Å; V685-A711 HydrophobicContact CG2-CB 4.49Å; M697-A711 HydrophobicContact CB-CB 3.63Å; A707-A711 WeakPolarHBondContact O-CB 3.39Å; A707-A711 PolarHBondContact O-N 3.48Å; L708-A711 PolarHBondContact O-N 3.37Å; A711-I713 PolarHBondContact O-N 3.32Å
712	E	91.4	Very high	86.4	Confident	38 Å²	38	15.8 Å²	15.8	18%	0.178	10%	0.099	C	C	.	.	S	Bend	trans	-59.9	-33.7	172.3	-69.8	70.3	-148.3	0	0	110.9	T341 Q689 I694 T695	T341-E712 HydrophobicContact CG2-CB 3.94Å; Q689-E712 VanDerWaalsContact CG-OE1 3.24Å; Q689-E712 WeakPolarHBondContact CG-OE1 3.2Å; Q689-E712 PolarHBondContact NE2-OE1 3.47Å; I694-E712 HydrophobicContact CD1-CG 4.06Å; I694-E712 HydrophobicContact CG2-CB 3.97Å; I694-E712 HydrophobicContact CG2-CG 4.18Å; T695-E712 WeakPolarHBondContact CA-OE2 3.26Å; T695-E712 WeakPolarHBondContact CB-OE2 3.49Å; T695-E712 PolarHBondContact N-OE2 3.19Å; T695-E712 PolarHBondContact O-N 2.9Å
713	I	93.3	Very high	86.3	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	98.6	174.5	-52	-63.9	0	0	0	110.5	T341 L342 T695 A696 M697 A711 I715	T341-I713 HydrophobicContact CG2-CD1 3.67Å; T341-I713 HydrophobicContact CG2-CG1 3.92Å; L342-I713 HydrophobicContact CD2-CG2 3.81Å; L342-I713 HydrophobicContact CG-CD1 4.32Å; L342-I713 HydrophobicContact CG-CG1 4.27Å; L342-I713 HydrophobicContact CG-CG2 3.97Å; T695-I713 PolarHBondContact O-N 3.38Å; A696-I713 CarbonylContact C-O 3.09Å; A696-I713 VanDerWaalsContact CA-O 3.22Å; A696-I713 WeakPolarHBondContact CA-O 3.21Å; A696-I713 HydrophobicContact CB-CB 4.21Å; M697-I713 PolarHBondContact N-O 3.07Å; A711-I713 PolarHBondContact O-N 3.32Å; I713-I715 HydrophobicContact CG2-CD1 4.27Å; I713-I715 HydrophobicContact CG2-CG1 3.83Å
714	G	93.9	Very high	86.4	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.9	162	0	0	0	0	0	111	L708 S728 E729 M730	L708-G714 WeakPolarHBondContact O-CA 3.45Å; G714-S728 VanDerWaalsContact O-CB 3.31Å; G714-S728 WeakPolarHBondContact O-CB 3.31Å; G714-E729 VanDerWaalsContact CA-OE2 3.3Å; G714-E729 WeakPolarHBondContact CA-OE2 3.49Å; G714-E729 PolarHBondContact N-OE2 2.88Å; G714-E729 PolarHBondContact O-N 3.38Å; G714-M730 PolarHBondContact O-N 3.33Å; G714-M730 VanDerWaalsContact O-N 3.07Å
715	I	94.8	Very high	86.3	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	113	179.6	-54.5	-180	0	0	0	109.2	A696 M697 T698 G699 L708 I713 M730 L732 I740	A696-I715 HydrophobicContact CB-CD1 3.99Å; M697-I715 PolarHBondContact O-N 3.2Å; T698-I715 CarbonylContact C-O 3.37Å; T698-I715 VanDerWaalsContact CA-O 3.23Å; T698-I715 WeakPolarHBondContact CA-O 3.36Å; T698-I715 HydrophobicContact CG2-CB 4.13Å; T698-I715 HydrophobicContact CG2-CD1 4.38Å; T698-I715 HydrophobicContact CG2-CG2 4.41Å; G699-I715 PolarHBondContact N-O 3.28Å; L708-I715 WeakPolarHBondContact CD2-O 3.44Å; I713-I715 HydrophobicContact CG2-CD1 4.27Å; I713-I715 HydrophobicContact CG2-CG1 3.83Å; I715-M730 CarbonylContact C-O 3.55Å; I715-M730 VanDerWaalsContact CA-O 3.31Å; I715-M730 WeakPolarHBondContact CA-O 3.43Å; I715-M730 HydrophobicContact CB-CE 4.37Å; I715-M730 HydrophobicContact CD1-CE 3.47Å; I715-M730 VanDerWaalsContact CD1-CE 3.47Å; I715-M730 HydrophobicContact CG1-CE 3.67Å; I715-M730 HydrophobicContact CG2-CE 3.87Å; I715-L732 HydrophobicContact CG2-CD1 3.74Å; I715-L732 HydrophobicContact CG2-CD2 4.04Å; I715-L732 HydrophobicContact CG2-CG 3.64Å; I715-I740 HydrophobicContact CD1-CD1 4Å; I715-I740 HydrophobicContact CD1-CG1 4.07Å; I715-I740 HydrophobicContact CD1-CG2 3.69Å; I715-I740 HydrophobicContact CG2-CD1 4.24Å; I715-I740 HydrophobicContact CG2-CG1 4.31Å
716	A	91.7	Very high	86	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	151.7	176.1	0	0	0	0	0	113.1	G699 A724 K725 S728 M730 V731 L732	G699-A716 VanDerWaalsContact O-CA 3.29Å; G699-A716 WeakPolarHBondContact O-CA 3.22Å; A716-A724 HydrophobicContact CB-CB 4.27Å; A716-A724 WeakPolarHBondContact CB-O 3.21Å; A716-K725 VanDerWaalsContact CB-CA 3.43Å; A716-K725 HydrophobicContact CB-CB 4.28Å; A716-K725 HydrophobicContact CB-CG 3.94Å; A716-S728 WeakPolarHBondContact CB-OG 3.44Å; A716-M730 PolarHBondContact N-O 2.85Å; A716-V731 HydrophobicContact CB-CG2 4.33Å; A716-V731 CarbonylContact O-C 3.58Å; A716-V731 WeakPolarHBondContact O-CA 3.42Å; A716-L732 PolarHBondContact O-N 3.12Å
717	M	88.1	Confident	85.9	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	142.3	171.7	-53.4	-51.3	-75.5	0	0	110.7	G354 T355 G699 D700 S719 G720 K725 L732 D735	G354-M717 WeakPolarHBondContact O-CE 3.37Å; T355-M717 HydrophobicContact CG2-CE 3.97Å; T355-M717 HydrophobicContact CG2-SD 3.87Å; T355-M717 PolarHBondContact OG1-SD 3.31Å; G699-M717 PolarHBondContact O-N 2.98Å; D700-M717 HydrophobicContact CB-CB 3.85Å; D700-M717 HydrophobicContact CB-CG 3.66Å; M717-S719 VanDerWaalsContact C-N 3.31Å; M717-S719 PolarHBondContact O-N 3.41Å; M717-G720 WeakPolarHBondContact O-CA 3.3Å; M717-G720 PolarHBondContact O-N 3.02Å; M717-K725 WeakPolarHBondContact O-CE 3.5Å; M717-L732 HydrophobicContact SD-CD1 4.03Å; M717-D735 WeakPolarHBondContact CB-OD1 3.48Å; M717-D735 VanDerWaalsContact CE-C 3.46Å; M717-D735 HydrophobicContact CE-CB 3.43Å; M717-D735 VanDerWaalsContact CE-CB 3.43Å; M717-D735 VanDerWaalsContact CE-O 3.26Å; M717-D735 WeakPolarHBondContact CE-O 3.49Å
718	G	84.1	Confident	85.8	Confident	23 Å²	23	19 Å²	19	24%	0.237	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-30.9	175.8	0	0	0	0	0	112.7	G720 K725 L732 D735	G718-G720 VanDerWaalsContact C-N 3.32Å; G718-K725 WeakPolarHBondContact O-CE 3.42Å; G718-K725 PolarHBondContact O-NZ 3.48Å; G718-L732 WeakPolarHBondContact CA-O 3.37Å; G718-L732 PolarHBondContact N-O 3.35Å; G718-D735 WeakPolarHBondContact CA-OD1 3.45Å; G718-D735 PolarHBondContact N-OD1 3.3Å
719	S	78.2	Confident	85.7	Confident	86 Å²	86	19.7 Å²	19.7	60%	0.601	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-8	166	60.9	0	0	0	0	114	M717 D735	M717-S719 VanDerWaalsContact C-N 3.31Å; M717-S719 PolarHBondContact O-N 3.41Å; S719-D735 WeakPolarHBondContact CB-OD2 3.37Å; S719-D735 PolarHBondContact N-OD1 3.49Å; S719-D735 PolarHBondContact N-OD2 3.38Å; S719-D735 VanDerWaalsContact OG-CG 3.23Å; S719-D735 PolarHBondContact OG-OD1 2.95Å; S719-D735 PolarHBondContact OG-OD2 3Å
720	G	75.2	Confident	85.9	Confident	9 Å²	9	18 Å²	18	9%	0.093	11%	0.111	C	C	.	.	S	Bend	trans	-65.5	167.1	179.8	0	0	0	0	0	113.8	D700 M717 G718 K725	D700-G720 WeakPolarHBondContact O-CA 3.38Å; M717-G720 WeakPolarHBondContact O-CA 3.3Å; M717-G720 PolarHBondContact O-N 3.02Å; G718-G720 VanDerWaalsContact C-N 3.32Å; G720-K725 WeakPolarHBondContact O-CE 3.43Å; G720-K725 PolarHBondContact O-NZ 3.25Å
721	T	77.4	Confident	86	Confident	28 Å²	28	15.5 Å²	15.5	17%	0.172	10%	0.101	C	C	.	.			trans	-58.7	151.9	178.1	60.4	0	0	0	0	111.7	D700 V723 A724 K725	D700-T721 WeakPolarHBondContact O-CB 3.4Å; D700-T721 WeakPolarHBondContact O-CG2 3.33Å; D700-T721 PolarHBondContact O-N 3.3Å; D700-T721 PolarHBondContact O-OG1 3.42Å; T721-V723 PolarHBondContact O-N 3.19Å; T721-A724 PolarHBondContact O-N 3.47Å; T721-A724 WeakPolarHBondContact OG1-CB 3.49Å; T721-A724 PolarHBondContact OG1-N 3.44Å; T721-K725 WeakPolarHBondContact O-CG 3.32Å; T721-K725 PolarHBondContact O-N 3.04Å; T721-K725 VanDerWaalsContact O-N 3.14Å
722	A	75.5	Confident	86	Confident	32 Å²	32	15.3 Å²	15.3	26%	0.264	10%	0.1	S	C	.	.	H	α-helix	trans	-59.4	-33	176.7	0	0	0	0	0	111.4	A118 Y122 K725 S726	A118-A722 HydrophobicContact CB-CB 4.24Å; Y122-A722 HydrophobicContact CE2-CB 4.45Å; Y122-A722 PolarHBondContact OH-N 2.76Å; A722-K725 PolarHBondContact O-N 3.29Å; A722-S726 VanDerWaalsContact O-CB 3.23Å; A722-S726 WeakPolarHBondContact O-CB 3.33Å; A722-S726 PolarHBondContact O-N 3.4Å; A722-S726 PolarHBondContact O-OG 2.98Å
723	V	78.2	Confident	85.8	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-65.7	-46.6	176	-177.6	0	0	0	0	112.4	L119 Y122 V702 A705 T721 K725 S726 A727	L119-V723 HydrophobicContact CD1-CG1 4.46Å; L119-V723 HydrophobicContact CD2-CB 4.2Å; L119-V723 HydrophobicContact CD2-CG1 3.5Å; L119-V723 HydrophobicContact CD2-CG2 3.56Å; L119-V723 HydrophobicContact CG-CB 4.49Å; L119-V723 HydrophobicContact CG-CG1 3.82Å; L119-V723 HydrophobicContact CG-CG2 3.89Å; Y122-V723 HydrophobicContact CD2-CG2 3.75Å; Y122-V723 HydrophobicContact CE2-CG2 3.46Å; Y122-V723 VanDerWaalsContact CE2-CG2 3.46Å; V702-V723 HydrophobicContact CG1-CG1 4.19Å; V702-V723 HydrophobicContact CG2-CB 3.99Å; V702-V723 HydrophobicContact CG2-CG1 4.34Å; V702-V723 HydrophobicContact CG2-CG2 3.95Å; A705-V723 HydrophobicContact CB-CG1 3.8Å; T721-V723 PolarHBondContact O-N 3.19Å; V723-K725 VanDerWaalsContact C-N 3.31Å; V723-K725 PolarHBondContact O-N 3.2Å; V723-S726 WeakPolarHBondContact CA-OG 3.48Å; V723-S726 PolarHBondContact O-N 2.85Å; V723-S726 PolarHBondContact O-OG 2.97Å; V723-A727 WeakPolarHBondContact O-CB 3.47Å; V723-A727 PolarHBondContact O-N 2.88Å
724	A	83.7	Confident	85.4	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.7	-46.2	177.5	0	0	0	0	0	110.3	D700 L708 A716 T721 S726 A727 S728	D700-A724 WeakPolarHBondContact O-CB 3.16Å; L708-A724 HydrophobicContact CD1-CB 3.95Å; A716-A724 HydrophobicContact CB-CB 4.27Å; A716-A724 WeakPolarHBondContact CB-O 3.21Å; T721-A724 PolarHBondContact O-N 3.47Å; T721-A724 WeakPolarHBondContact OG1-CB 3.49Å; T721-A724 PolarHBondContact OG1-N 3.44Å; A724-S726 PolarHBondContact O-N 2.7Å; A724-A727 PolarHBondContact O-N 2.78Å; A724-S728 WeakPolarHBondContact O-CB 3.38Å; A724-S728 PolarHBondContact O-N 3.4Å; A724-S728 PolarHBondContact O-OG 2.84Å
725	K	84.2	Confident	85	Confident	57 Å²	57	20 Å²	20	25%	0.248	13%	0.131	C	C	.	.	H	α-helix	trans	-60.5	-31	176.4	-67.7	170.9	-179.1	155.7	0	113.4	R334 A716 M717 G718 G720 T721 A722 V723 S728 V731	R334-K725 WeakPolarHBondContact CD-O 3.43Å; R334-K725 PolarHBondContact NE-O 3.1Å; R334-K725 PolarHBondContact NH1-O 3.46Å; A716-K725 VanDerWaalsContact CB-CA 3.43Å; A716-K725 HydrophobicContact CB-CB 4.28Å; A716-K725 HydrophobicContact CB-CG 3.94Å; M717-K725 WeakPolarHBondContact O-CE 3.5Å; G718-K725 WeakPolarHBondContact O-CE 3.42Å; G718-K725 PolarHBondContact O-NZ 3.48Å; G720-K725 WeakPolarHBondContact O-CE 3.43Å; G720-K725 PolarHBondContact O-NZ 3.25Å; T721-K725 WeakPolarHBondContact O-CG 3.32Å; T721-K725 PolarHBondContact O-N 3.04Å; T721-K725 VanDerWaalsContact O-N 3.14Å; A722-K725 PolarHBondContact O-N 3.29Å; V723-K725 VanDerWaalsContact C-N 3.31Å; V723-K725 PolarHBondContact O-N 3.2Å; K725-S728 VanDerWaalsContact C-OG 3.31Å; K725-S728 WeakPolarHBondContact CA-OG 3.4Å; K725-S728 PolarHBondContact O-OG 3.44Å; K725-V731 HydrophobicContact CB-CG2 4.06Å; K725-V731 HydrophobicContact CD-CG1 4.34Å; K725-V731 HydrophobicContact CG-CG1 3.97Å; K725-V731 HydrophobicContact CG-CG2 4.12Å
726	S	78.9	Confident	84.5	Confident	11 Å²	11	20.9 Å²	20.9	8%	0.077	14%	0.136	C	C	.	.	H	α-helix	trans	-81	-37.2	-179.2	80.3	0	0	0	0	112.7	A115 R334 A722 V723 A724 S728	A115-S726 WeakPolarHBondContact CB-O 3.29Å; A115-S726 WeakPolarHBondContact O-CB 3.2Å; A115-S726 PolarHBondContact O-OG 3.48Å; R334-S726 VanDerWaalsContact NH1-CA 3.29Å; A722-S726 VanDerWaalsContact O-CB 3.23Å; A722-S726 WeakPolarHBondContact O-CB 3.33Å; A722-S726 PolarHBondContact O-N 3.4Å; A722-S726 PolarHBondContact O-OG 2.98Å; V723-S726 WeakPolarHBondContact CA-OG 3.48Å; V723-S726 PolarHBondContact O-N 2.85Å; V723-S726 PolarHBondContact O-OG 2.97Å; A724-S726 PolarHBondContact O-N 2.7Å; S726-S728 PolarHBondContact O-N 3.21Å
727	A	83.5	Confident	84.4	Confident	7 Å²	7	20.9 Å²	20.9	6%	0.058	14%	0.136	C	C	.	.	S	Bend	trans	-76.9	1	174.2	0	0	0	0	0	114.4	M239 A705 L708 K709 V723 A724	M239-A727 HydrophobicContact CE-CB 3.72Å; A705-A727 HydrophobicContact CB-CB 3.8Å; L708-A727 CarbonylContact C-O 3.47Å; L708-A727 HydrophobicContact CB-CB 4.24Å; L708-A727 WeakPolarHBondContact CB-O 3.45Å; K709-A727 PolarHBondContact N-O 3.38Å; V723-A727 WeakPolarHBondContact O-CB 3.47Å; V723-A727 PolarHBondContact O-N 2.88Å; A724-A727 PolarHBondContact O-N 2.78Å
728	S	89.1	Confident	84.4	Confident	3 Å²	3	22.4 Å²	22.4	2%	0.021	15%	0.146	C	C	.	.			trans	-112.7	144.8	-175.4	65.7	0	0	0	0	112.6	R334 G714 A716 A724 K725 S726 M730	R334-S728 WeakPolarHBondContact CD-O 3.3Å; G714-S728 VanDerWaalsContact O-CB 3.31Å; G714-S728 WeakPolarHBondContact O-CB 3.31Å; A716-S728 WeakPolarHBondContact CB-OG 3.44Å; A724-S728 WeakPolarHBondContact O-CB 3.38Å; A724-S728 PolarHBondContact O-N 3.4Å; A724-S728 PolarHBondContact O-OG 2.84Å; K725-S728 VanDerWaalsContact C-OG 3.31Å; K725-S728 WeakPolarHBondContact CA-OG 3.4Å; K725-S728 PolarHBondContact O-OG 3.44Å; S726-S728 PolarHBondContact O-N 3.21Å; S728-M730 PolarHBondContact OG-O 3.37Å
729	E	89.1	Confident	84.9	Confident	14 Å²	14	21.7 Å²	21.7	7%	0.065	14%	0.137	C	C	.	.	S	Bend	trans	-76.8	-25.4	172.3	-72.1	61.5	-129.9	0	0	112.5	Q244 R334 S338 G714	Q244-E729 PolarHBondContact NE2-OE1 3.44Å; R334-E729 PolarHBondContact N-O 3.48Å; S338-E729 VanDerWaalsContact OG-CB 3.31Å; S338-E729 WeakPolarHBondContact OG-CB 3.22Å; S338-E729 WeakPolarHBondContact OG-CG 3.36Å; G714-E729 VanDerWaalsContact CA-OE2 3.3Å; G714-E729 WeakPolarHBondContact CA-OE2 3.49Å; G714-E729 PolarHBondContact N-OE2 2.88Å; G714-E729 PolarHBondContact O-N 3.38Å
730	M	91.8	Very high	85.6	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	142.1	179.9	-177.1	174.8	62.6	0	0	111.7	A331 I332 V333 L342 G714 I715 A716 S728 L732 A743	A331-M730 HydrophobicContact CB-CG 4.49Å; A331-M730 HydrophobicContact CB-SD 3.83Å; I332-M730 CarbonylContact O-C 3.48Å; I332-M730 WeakPolarHBondContact O-CA 3.39Å; V333-M730 HydrophobicContact CG2-CG 4.31Å; V333-M730 HydrophobicContact CG2-SD 4.44Å; L342-M730 HydrophobicContact CD1-CE 4.22Å; L342-M730 HydrophobicContact CD1-SD 3.76Å; L342-M730 HydrophobicContact CD2-CE 3.9Å; G714-M730 PolarHBondContact O-N 3.33Å; G714-M730 VanDerWaalsContact O-N 3.07Å; I715-M730 CarbonylContact C-O 3.55Å; I715-M730 VanDerWaalsContact CA-O 3.31Å; I715-M730 WeakPolarHBondContact CA-O 3.43Å; I715-M730 HydrophobicContact CB-CE 4.37Å; I715-M730 HydrophobicContact CD1-CE 3.47Å; I715-M730 VanDerWaalsContact CD1-CE 3.47Å; I715-M730 HydrophobicContact CG1-CE 3.67Å; I715-M730 HydrophobicContact CG2-CE 3.87Å; A716-M730 PolarHBondContact N-O 2.85Å; S728-M730 PolarHBondContact OG-O 3.37Å; M730-L732 HydrophobicContact CE-CD2 4.04Å; M730-L732 HydrophobicContact SD-CD2 4.46Å; M730-A743 HydrophobicContact CE-CB 4.32Å; M730-A743 HydrophobicContact SD-CB 3.87Å
731	V	91.9	Very high	86.5	Confident	12 Å²	12	17.5 Å²	17.5	7%	0.073	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.8	175.1	-175.1	0	0	0	0	110	I332 R334 A716 K725	I332-V731 HydrophobicContact CB-CB 4.3Å; I332-V731 PolarHBondContact N-O 3.04Å; I332-V731 PolarHBondContact O-N 2.99Å; R334-V731 HydrophobicContact CG-CG2 4.44Å; A716-V731 HydrophobicContact CB-CG2 4.33Å; A716-V731 CarbonylContact O-C 3.58Å; A716-V731 WeakPolarHBondContact O-CA 3.42Å; K725-V731 HydrophobicContact CB-CG2 4.06Å; K725-V731 HydrophobicContact CD-CG1 4.34Å; K725-V731 HydrophobicContact CG-CG1 3.97Å; K725-V731 HydrophobicContact CG-CG2 4.12Å
732	L	91.5	Very high	87.2	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	105.4	177.1	-54.6	178.1	0	0	0	109.9	I715 A716 M717 G718 M730 D734 D735 T739 I740	I715-L732 HydrophobicContact CG2-CD1 3.74Å; I715-L732 HydrophobicContact CG2-CD2 4.04Å; I715-L732 HydrophobicContact CG2-CG 3.64Å; A716-L732 PolarHBondContact O-N 3.12Å; M717-L732 HydrophobicContact SD-CD1 4.03Å; G718-L732 WeakPolarHBondContact CA-O 3.37Å; G718-L732 PolarHBondContact N-O 3.35Å; M730-L732 HydrophobicContact CE-CD2 4.04Å; M730-L732 HydrophobicContact SD-CD2 4.46Å; L732-D734 PolarHBondContact O-N 2.89Å; L732-D735 PolarHBondContact O-N 3.37Å; L732-T739 HydrophobicContact CD2-CG2 3.77Å; L732-I740 HydrophobicContact CD1-CD1 3.93Å; L732-I740 HydrophobicContact CD1-CG1 3.66Å; L732-I740 HydrophobicContact CD2-CG1 4.01Å; L732-I740 HydrophobicContact CG-CG1 4.43Å
733	S	87.4	Confident	88	Confident	60 Å²	60	16 Å²	16	42%	0.42	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-16.9	-175.3	64.1	0	0	0	0	114.1	N330	N330-S733 VanDerWaalsContact CA-OG 3.28Å; N330-S733 WeakPolarHBondContact CA-OG 3.37Å; N330-S733 VanDerWaalsContact CB-OG 3.24Å; N330-S733 WeakPolarHBondContact CB-OG 3.2Å; N330-S733 PolarHBondContact O-N 3.05Å; N330-S733 PolarHBondContact O-OG 3.2Å
734	D	86	Confident	88.8	Confident	52 Å²	52	16 Å²	16	28%	0.278	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	4.3	-179.8	65.1	-6.3	0	0	0	114.1	N330 L732 N736 T739	N330-D734 HydrophobicContact CB-CB 3.98Å; N330-D734 VanDerWaalsContact CB-CG 3.48Å; N330-D734 WeakPolarHBondContact CB-OD2 3.4Å; N330-D734 PolarHBondContact ND2-OD2 2.99Å; L732-D734 PolarHBondContact O-N 2.89Å; D734-N736 PolarHBondContact O-N 3.06Å; D734-N736 PolarHBondContact OD1-N 3.21Å; D734-T739 PolarHBondContact OD1-OG1 3.36Å; D734-T739 VanDerWaalsContact OD1-OG1 3.07Å; D734-T739 PolarHBondContact OD2-OG1 3.01Å
735	D	84.2	Confident	89.3	Confident	25 Å²	25	19.6 Å²	19.6	13%	0.134	11%	0.113	C	C	.	.			trans	55.4	28.5	-178	-60.1	-27.8	0	0	0	114.2	R601 M717 G718 S719 L732	R601-D735 PolarHBondContact NE-O 2.84Å; R601-D735 PolarHBondContact NH2-O 3.47Å; M717-D735 WeakPolarHBondContact CB-OD1 3.48Å; M717-D735 VanDerWaalsContact CE-C 3.46Å; M717-D735 HydrophobicContact CE-CB 3.43Å; M717-D735 VanDerWaalsContact CE-CB 3.43Å; M717-D735 VanDerWaalsContact CE-O 3.26Å; M717-D735 WeakPolarHBondContact CE-O 3.49Å; G718-D735 WeakPolarHBondContact CA-OD1 3.45Å; G718-D735 PolarHBondContact N-OD1 3.3Å; S719-D735 WeakPolarHBondContact CB-OD2 3.37Å; S719-D735 PolarHBondContact N-OD1 3.49Å; S719-D735 PolarHBondContact N-OD2 3.38Å; S719-D735 VanDerWaalsContact OG-CG 3.23Å; S719-D735 PolarHBondContact OG-OD1 2.95Å; S719-D735 PolarHBondContact OG-OD2 3Å; L732-D735 PolarHBondContact O-N 3.37Å
736	N	84	Confident	89.6	Confident	19 Å²	19	17.7 Å²	17.7	10%	0.102	11%	0.105	C	C	.	.			trans	-105.7	127.2	-174.4	-155.8	-25.2	0	0	0	113.4	E603 D734 S738 T739	E603-N736 PolarHBondContact OE2-ND2 3.09Å; D734-N736 PolarHBondContact O-N 3.06Å; D734-N736 PolarHBondContact OD1-N 3.21Å; N736-S738 PolarHBondContact ND2-OG 2.7Å; N736-S738 PolarHBondContact O-N 3.13Å; N736-S738 PolarHBondContact OD1-N 3.26Å; N736-S738 VanDerWaalsContact OD1-N 3.08Å; N736-S738 PolarHBondContact OD1-OG 3.49Å; N736-S738 VanDerWaalsContact OD1-OG 3.1Å; N736-T739 VanDerWaalsContact O-CB 3.25Å; N736-T739 WeakPolarHBondContact O-CB 3.41Å; N736-T739 PolarHBondContact O-N 3.04Å; N736-T739 VanDerWaalsContact O-N 3.13Å
737	F	89.5	Confident	90.3	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-32.1	172.3	-174.9	-91.7	0	0	0	112.9	I348 T355 L356 V604 V608 V618 T739 I740 V741	I348-F737 HydrophobicContact CD1-CZ 4.41Å; I348-F737 HydrophobicContact CG2-CE2 3.82Å; I348-F737 HydrophobicContact CG2-CZ 4.24Å; T355-F737 HydrophobicContact CG2-CD2 4.46Å; L356-F737 HydrophobicContact CD2-CB 4.35Å; L356-F737 HydrophobicContact CD2-CD2 3.67Å; L356-F737 HydrophobicContact CD2-CE2 4.1Å; L356-F737 HydrophobicContact CD2-CG 3.94Å; V604-F737 HydrophobicContact CG2-CB 3.88Å; V608-F737 HydrophobicContact CG2-CE1 4.27Å; V618-F737 HydrophobicContact CG1-CE2 4.49Å; V618-F737 HydrophobicContact CG1-CZ 4.15Å; V618-F737 HydrophobicContact CG2-CZ 4.18Å; F737-T739 PolarHBondContact O-N 2.85Å; F737-I740 HydrophobicContact CD2-CD1 3.83Å; F737-I740 HydrophobicContact CE2-CD1 4.21Å; F737-I740 HydrophobicContact CG-CD1 4.49Å; F737-I740 VanDerWaalsContact O-CB 3.3Å; F737-I740 WeakPolarHBondContact O-CB 3.21Å; F737-I740 PolarHBondContact O-N 3.01Å; F737-V741 HydrophobicContact CE1-CG2 4.15Å
738	S	89.2	Confident	90.7	Very high	33 Å²	33	17.7 Å²	17.7	23%	0.231	10%	0.102	C	C	.	.	H	α-helix	trans	-61.8	-29.9	177.4	62.3	0	0	0	0	112.9	S607 N736 I740 V741 A742	S607-S738 VanDerWaalsContact OG-CA 3.29Å; S607-S738 WeakPolarHBondContact OG-CA 3.32Å; S607-S738 VanDerWaalsContact OG-CB 3.23Å; S607-S738 WeakPolarHBondContact OG-CB 3.44Å; N736-S738 PolarHBondContact ND2-OG 2.7Å; N736-S738 PolarHBondContact O-N 3.13Å; N736-S738 PolarHBondContact OD1-N 3.26Å; N736-S738 VanDerWaalsContact OD1-N 3.08Å; N736-S738 PolarHBondContact OD1-OG 3.49Å; N736-S738 VanDerWaalsContact OD1-OG 3.1Å; S738-I740 VanDerWaalsContact C-N 3.26Å; S738-I740 PolarHBondContact O-N 3.39Å; S738-V741 PolarHBondContact O-N 3.22Å; S738-A742 PolarHBondContact O-N 3.4Å
739	T	93.4	Very high	90.7	Very high	7 Å²	7	17.7 Å²	17.7	4%	0.043	10%	0.103	C	C	.	.	H	α-helix	trans	-63.7	-33.2	175.7	-58	0	0	0	0	111.5	K329 N330 A331 L732 D734 N736 F737 A742 A743	K329-T739 WeakPolarHBondContact O-CG2 3.33Å; N330-T739 HydrophobicContact CB-CG2 4.28Å; A331-T739 HydrophobicContact CB-CG2 3.82Å; L732-T739 HydrophobicContact CD2-CG2 3.77Å; D734-T739 PolarHBondContact OD1-OG1 3.36Å; D734-T739 VanDerWaalsContact OD1-OG1 3.07Å; D734-T739 PolarHBondContact OD2-OG1 3.01Å; N736-T739 VanDerWaalsContact O-CB 3.25Å; N736-T739 WeakPolarHBondContact O-CB 3.41Å; N736-T739 PolarHBondContact O-N 3.04Å; N736-T739 VanDerWaalsContact O-N 3.13Å; F737-T739 PolarHBondContact O-N 2.85Å; T739-A742 PolarHBondContact O-N 2.93Å; T739-A743 WeakPolarHBondContact O-CB 3.32Å; T739-A743 PolarHBondContact O-N 3.21Å
740	I	94.1	Very high	90.7	Very high	1 Å²	1	17 Å²	17	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-62.3	-46.7	173.6	-54.9	175.2	0	0	0	110	I348 T698 I715 L732 F737 S738 A742 A743 V744	I348-I740 HydrophobicContact CD1-CG2 4.04Å; T698-I740 HydrophobicContact CG2-CD1 3.53Å; I715-I740 HydrophobicContact CD1-CD1 4Å; I715-I740 HydrophobicContact CD1-CG1 4.07Å; I715-I740 HydrophobicContact CD1-CG2 3.69Å; I715-I740 HydrophobicContact CG2-CD1 4.24Å; I715-I740 HydrophobicContact CG2-CG1 4.31Å; L732-I740 HydrophobicContact CD1-CD1 3.93Å; L732-I740 HydrophobicContact CD1-CG1 3.66Å; L732-I740 HydrophobicContact CD2-CG1 4.01Å; L732-I740 HydrophobicContact CG-CG1 4.43Å; F737-I740 HydrophobicContact CD2-CD1 3.83Å; F737-I740 HydrophobicContact CE2-CD1 4.21Å; F737-I740 HydrophobicContact CG-CD1 4.49Å; F737-I740 VanDerWaalsContact O-CB 3.3Å; F737-I740 WeakPolarHBondContact O-CB 3.21Å; F737-I740 PolarHBondContact O-N 3.01Å; S738-I740 VanDerWaalsContact C-N 3.26Å; S738-I740 PolarHBondContact O-N 3.39Å; I740-A742 VanDerWaalsContact C-N 3.34Å; I740-A742 PolarHBondContact O-N 3.3Å; I740-A743 WeakPolarHBondContact O-CB 3.42Å; I740-A743 PolarHBondContact O-N 2.83Å; I740-A743 VanDerWaalsContact O-N 3.13Å; I740-V744 HydrophobicContact CG2-CG2 4.47Å; I740-V744 WeakPolarHBondContact O-CG2 3.29Å; I740-V744 PolarHBondContact O-N 3.09Å
741	V	92.9	Very high	90.5	Very high	7 Å²	7	17.6 Å²	17.6	4%	0.042	10%	0.102	C	C	.	.	H	α-helix	trans	-62.4	-43.3	179.9	-176.3	0	0	0	0	111	L610 F737 S738 A743 V744 E745 M814	L610-V741 HydrophobicContact CB-CG1 4.13Å; L610-V741 HydrophobicContact CD1-CG1 4.34Å; F737-V741 HydrophobicContact CE1-CG2 4.15Å; S738-V741 PolarHBondContact O-N 3.22Å; V741-A743 VanDerWaalsContact C-N 3.29Å; V741-A743 PolarHBondContact O-N 3.36Å; V741-V744 PolarHBondContact O-N 3.03Å; V741-E745 PolarHBondContact O-N 3.05Å; V741-M814 HydrophobicContact CG1-CE 3.78Å
742	A	92.3	Very high	90.3	Very high	25 Å²	25	19.5 Å²	19.5	21%	0.207	11%	0.111	C	C	.	.	H	α-helix	trans	-64	-33.2	175.5	0	0	0	0	0	112.8	K329 S738 T739 I740 E746	K329-A742 HydrophobicContact CD-CB 4.39Å; S738-A742 PolarHBondContact O-N 3.4Å; T739-A742 PolarHBondContact O-N 2.93Å; I740-A742 VanDerWaalsContact C-N 3.34Å; I740-A742 PolarHBondContact O-N 3.3Å; A742-E746 WeakPolarHBondContact O-CB 3.5Å; A742-E746 PolarHBondContact O-N 3.14Å; A742-E746 VanDerWaalsContact O-N 3.11Å
743	A	93.9	Very high	90.1	Very high	3 Å²	3	19.8 Å²	19.8	3%	0.025	11%	0.113	C	C	.	.	H	α-helix	trans	-72.3	-37.8	174.4	0	0	0	0	0	111.9	M326 A331 L342 M730 T739 I740 V741 E746 G747	M326-A743 VanDerWaalsContact CE-O 3.31Å; M326-A743 WeakPolarHBondContact CE-O 3.33Å; A331-A743 HydrophobicContact CB-CB 4.21Å; L342-A743 HydrophobicContact CD1-CB 4.35Å; M730-A743 HydrophobicContact CE-CB 4.32Å; M730-A743 HydrophobicContact SD-CB 3.87Å; T739-A743 WeakPolarHBondContact O-CB 3.32Å; T739-A743 PolarHBondContact O-N 3.21Å; I740-A743 WeakPolarHBondContact O-CB 3.42Å; I740-A743 PolarHBondContact O-N 2.83Å; I740-A743 VanDerWaalsContact O-N 3.13Å; V741-A743 VanDerWaalsContact C-N 3.29Å; V741-A743 PolarHBondContact O-N 3.36Å; A743-E746 PolarHBondContact O-N 3.31Å; A743-G747 PolarHBondContact O-N 2.87Å
744	V	94.9	Very high	90.1	Very high	1 Å²	1	17 Å²	17	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-63.1	-45.5	173.5	172.5	0	0	0	0	110.9	L342 I616 I740 V741 E746 G747 R748	L342-V744 HydrophobicContact CD2-CG2 4.27Å; I616-V744 HydrophobicContact CD1-CG1 3.74Å; I740-V744 HydrophobicContact CG2-CG2 4.47Å; I740-V744 WeakPolarHBondContact O-CG2 3.29Å; I740-V744 PolarHBondContact O-N 3.09Å; V741-V744 PolarHBondContact O-N 3.03Å; V744-E746 VanDerWaalsContact C-N 3.34Å; V744-E746 PolarHBondContact O-N 3.2Å; V744-G747 PolarHBondContact O-N 2.94Å; V744-R748 WeakPolarHBondContact O-CG 3.46Å; V744-R748 PolarHBondContact O-N 3.28Å
745	E	92.7	Very high	90	Very high	74 Å²	74	15.4 Å²	15.4	35%	0.346	8%	0.084	S	C	.	.	H	α-helix	trans	-57	-47.6	175.2	-175.9	-174.4	174	0	0	111.4	V741 G747 R748 A749 I813 M814	V741-E745 PolarHBondContact O-N 3.05Å; E745-G747 PolarHBondContact O-N 3.43Å; E745-R748 PolarHBondContact O-N 3.05Å; E745-A749 PolarHBondContact O-N 3.1Å; E745-I813 HydrophobicContact CG-CG2 3.98Å; E745-M814 HydrophobicContact CB-CG 4.16Å; E745-M814 HydrophobicContact CB-SD 3.7Å; E745-M814 HydrophobicContact CG-CG 3.86Å; E745-M814 HydrophobicContact CG-SD 4.02Å
746	E	91.7	Very high	90.1	Very high	17 Å²	17	15 Å²	15	8%	0.079	8%	0.081	C	C	.	.	H	α-helix	trans	-65.3	-38.4	177.7	-165.9	77.2	-147.7	0	0	111.8	R325 M326 K329 A742 A743 V744 A749 I750	R325-E746 WeakPolarHBondContact CD-OE1 3.47Å; R325-E746 IonicContact CZ-OE1 3.71Å; R325-E746 IonicContact NE-OE1 3.82Å; R325-E746 PolarHBondContact NE-OE1 3.17Å; R325-E746 IonicContact NH1-OE1 2.69Å; R325-E746 PolarHBondContact NH1-OE1 3.4Å; R325-E746 IonicContact NH2-OE1 2.72Å; M326-E746 HydrophobicContact CE-CB 3.75Å; M326-E746 HydrophobicContact CE-CG 3.92Å; M326-E746 HydrophobicContact CG-CB 4.27Å; M326-E746 HydrophobicContact CG-CG 3.95Å; K329-E746 IonicContact NZ-OE2 3.61Å; K329-E746 PolarHBondContact NZ-OE2 3.23Å; A742-E746 WeakPolarHBondContact O-CB 3.5Å; A742-E746 PolarHBondContact O-N 3.14Å; A742-E746 VanDerWaalsContact O-N 3.11Å; A743-E746 PolarHBondContact O-N 3.31Å; V744-E746 VanDerWaalsContact C-N 3.34Å; V744-E746 PolarHBondContact O-N 3.2Å; E746-A749 WeakPolarHBondContact O-CB 3.45Å; E746-A749 PolarHBondContact O-N 3.27Å; E746-I750 HydrophobicContact CG-CD1 3.95Å; E746-I750 WeakPolarHBondContact O-CB 3.41Å; E746-I750 VanDerWaalsContact O-CG1 3.25Å; E746-I750 WeakPolarHBondContact O-CG1 3.17Å; E746-I750 PolarHBondContact O-N 3Å
747	G	92.8	Very high	90.4	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-63.1	-42.2	175.6	0	0	0	0	0	112.4	V339 A743 V744 E745 A749 I750 Y751	V339-G747 WeakPolarHBondContact O-CA 3.34Å; A743-G747 PolarHBondContact O-N 2.87Å; V744-G747 PolarHBondContact O-N 2.94Å; E745-G747 PolarHBondContact O-N 3.43Å; G747-A749 VanDerWaalsContact C-N 3.34Å; G747-A749 PolarHBondContact O-N 3.42Å; G747-I750 PolarHBondContact O-N 2.86Å; G747-Y751 WeakPolarHBondContact O-CB 3.39Å; G747-Y751 PolarHBondContact O-N 2.77Å
748	R	91.7	Very high	90.3	Very high	18 Å²	18	14.3 Å²	14.3	7%	0.068	8%	0.078	C	C	.	.	H	α-helix	trans	-60.6	-43.7	172.6	-70.6	178.9	179.5	-161.3	-0	111.2	G343 A614 V744 E745 Y751 N752 I813 K816	G343-R748 VanDerWaalsContact O-CG 3.24Å; G343-R748 WeakPolarHBondContact O-CG 3.45Å; A614-R748 PolarHBondContact O-NH2 2.88Å; V744-R748 WeakPolarHBondContact O-CG 3.46Å; V744-R748 PolarHBondContact O-N 3.28Å; E745-R748 PolarHBondContact O-N 3.05Å; R748-Y751 PolarHBondContact O-N 2.95Å; R748-N752 PolarHBondContact O-N 3.4Å; R748-I813 HydrophobicContact CB-CD1 3.74Å; R748-I813 HydrophobicContact CB-CG1 3.69Å; R748-I813 PolarHBondContact NH1-O 2.68Å; R748-K816 PolarHBondContact NH1-O 3.25Å
749	A	89.3	Confident	90	Very high	4 Å²	4	13 Å²	13	3%	0.033	7%	0.067	C	C	.	.	H	α-helix	trans	-63.7	-45.3	178.6	0	0	0	0	0	112.1	E745 E746 G747 Y751 N752 N753 P809 I813	E745-A749 PolarHBondContact O-N 3.1Å; E746-A749 WeakPolarHBondContact O-CB 3.45Å; E746-A749 PolarHBondContact O-N 3.27Å; G747-A749 VanDerWaalsContact C-N 3.34Å; G747-A749 PolarHBondContact O-N 3.42Å; A749-Y751 VanDerWaalsContact C-N 3.33Å; A749-Y751 PolarHBondContact O-N 3.01Å; A749-N752 PolarHBondContact O-N 3.44Å; A749-N753 VanDerWaalsContact O-CG 3.28Å; A749-N753 PolarHBondContact O-N 3.33Å; A749-N753 PolarHBondContact O-OD1 2.78Å; A749-P809 HydrophobicContact CB-CB 3.8Å; A749-I813 HydrophobicContact CB-CD1 4Å
750	I	89.8	Confident	89.8	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63	-41.8	178.1	-70.9	165.3	0	0	0	110.5	L319 G322 M326 V339 E746 G747 N752 N753 M754	L319-I750 HydrophobicContact CD2-CG2 4.15Å; G322-I750 VanDerWaalsContact CA-CD1 3.47Å; M326-I750 HydrophobicContact CE-CD1 4.22Å; V339-I750 HydrophobicContact CG1-CB 4.38Å; V339-I750 HydrophobicContact CG1-CD1 3.27Å; V339-I750 HydrophobicContact CG1-CG1 4.4Å; V339-I750 HydrophobicContact CG1-CG2 4.12Å; E746-I750 HydrophobicContact CG-CD1 3.95Å; E746-I750 WeakPolarHBondContact O-CB 3.41Å; E746-I750 VanDerWaalsContact O-CG1 3.25Å; E746-I750 WeakPolarHBondContact O-CG1 3.17Å; E746-I750 PolarHBondContact O-N 3Å; G747-I750 PolarHBondContact O-N 2.86Å; I750-N752 PolarHBondContact O-N 2.83Å; I750-N753 PolarHBondContact O-N 3.46Å; I750-M754 HydrophobicContact CG2-CG 4.23Å; I750-M754 HydrophobicContact CG2-SD 3.75Å; I750-M754 WeakPolarHBondContact O-CB 3.35Å; I750-M754 VanDerWaalsContact O-CG 3.23Å; I750-M754 WeakPolarHBondContact O-CG 3.46Å; I750-M754 PolarHBondContact O-N 3.27Å
751	Y	88.3	Confident	89.7	Confident	11 Å²	11	12.8 Å²	12.8	4%	0.043	7%	0.066	C	C	.	.	H	α-helix	trans	-60.1	-46.1	175.2	179.4	-98	0	0	0	112.3	E340 G747 R748 A749 N753 M754 K755 R819 L825	E340-Y751 HydrophobicContact CG-CD2 3.64Å; E340-Y751 HydrophobicContact CG-CE2 4.46Å; E340-Y751 HydrophobicContact CG-CG 4.46Å; E340-Y751 WeakPolarHBondContact OE1-CD2 3.16Å; G747-Y751 WeakPolarHBondContact O-CB 3.39Å; G747-Y751 PolarHBondContact O-N 2.77Å; R748-Y751 PolarHBondContact O-N 2.95Å; A749-Y751 VanDerWaalsContact C-N 3.33Å; A749-Y751 PolarHBondContact O-N 3.01Å; Y751-N753 VanDerWaalsContact C-N 3.33Å; Y751-N753 PolarHBondContact O-N 3.42Å; Y751-M754 WeakPolarHBondContact O-CB 3.29Å; Y751-M754 PolarHBondContact O-N 3.17Å; Y751-K755 HydrophobicContact CE1-CD 4.11Å; Y751-K755 WeakPolarHBondContact O-CB 3.48Å; Y751-K755 PolarHBondContact O-N 2.96Å; Y751-R819 VanDerWaalsContact CZ-NE 3.33Å; Y751-R819 PolarHBondContact OH-NE 2.94Å; Y751-R819 PolarHBondContact OH-NH1 2.95Å; Y751-L825 HydrophobicContact CE2-CD2 4.47Å
752	N	86.2	Confident	89.3	Confident	52 Å²	52	13.3 Å²	13.3	28%	0.278	7%	0.069	S	C	.	.	H	α-helix	trans	-58.9	-46.1	177.6	-76.1	-0.7	0	0	0	111.4	R748 A749 I750 M754 K755 Q756 D810	R748-N752 PolarHBondContact O-N 3.4Å; A749-N752 PolarHBondContact O-N 3.44Å; I750-N752 PolarHBondContact O-N 2.83Å; N752-M754 VanDerWaalsContact C-N 3.32Å; N752-M754 PolarHBondContact O-N 2.96Å; N752-K755 WeakPolarHBondContact O-CB 3.27Å; N752-K755 PolarHBondContact O-N 3.22Å; N752-Q756 WeakPolarHBondContact O-CB 3.2Å; N752-Q756 PolarHBondContact O-N 3.35Å; N752-D810 PolarHBondContact ND2-OD2 3.28Å
753	N	89.1	Confident	89.1	Confident	6 Å²	6	12.2 Å²	12.2	3%	0.032	6%	0.059	C	C	.	.	H	α-helix	trans	-63.6	-38.9	177.2	-66.1	0.7	0	0	0	111.8	A749 I750 Y751 Q756 F757 G805 N807	A749-N753 VanDerWaalsContact O-CG 3.28Å; A749-N753 PolarHBondContact O-N 3.33Å; A749-N753 PolarHBondContact O-OD1 2.78Å; I750-N753 PolarHBondContact O-N 3.46Å; Y751-N753 VanDerWaalsContact C-N 3.33Å; Y751-N753 PolarHBondContact O-N 3.42Å; N753-Q756 VanDerWaalsContact O-CB 3.29Å; N753-Q756 WeakPolarHBondContact O-CB 3.31Å; N753-Q756 PolarHBondContact O-N 3.41Å; N753-F757 WeakPolarHBondContact O-CD1 3.35Å; N753-F757 PolarHBondContact O-N 3.02Å; N753-G805 PolarHBondContact ND2-O 3.25Å; N753-N807 PolarHBondContact ND2-N 3Å; N753-N807 PolarHBondContact ND2-O 3.34Å; N753-N807 WeakPolarHBondContact OD1-CB 3.37Å
754	M	86.4	Confident	89	Confident	1 Å²	1	12 Å²	12	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-63.7	-49	175.1	-76.8	173	28.6	0	0	112.8	L249 L319 E340 I750 Y751 N752 Q756 F757 I758	L249-M754 HydrophobicContact CD1-CE 3.44Å; L249-M754 VanDerWaalsContact CD1-CE 3.44Å; L249-M754 HydrophobicContact CD2-CE 3.32Å; L249-M754 HydrophobicContact CG-CE 3.96Å; L319-M754 HydrophobicContact CD2-SD 3.75Å; L319-M754 HydrophobicContact CG-SD 4.41Å; E340-M754 HydrophobicContact CB-CE 4.37Å; E340-M754 HydrophobicContact CG-CE 4.06Å; I750-M754 HydrophobicContact CG2-CG 4.23Å; I750-M754 HydrophobicContact CG2-SD 3.75Å; I750-M754 WeakPolarHBondContact O-CB 3.35Å; I750-M754 VanDerWaalsContact O-CG 3.23Å; I750-M754 WeakPolarHBondContact O-CG 3.46Å; I750-M754 PolarHBondContact O-N 3.27Å; Y751-M754 WeakPolarHBondContact O-CB 3.29Å; Y751-M754 PolarHBondContact O-N 3.17Å; N752-M754 VanDerWaalsContact C-N 3.32Å; N752-M754 PolarHBondContact O-N 2.96Å; M754-Q756 PolarHBondContact O-N 2.95Å; M754-F757 HydrophobicContact CB-CE1 3.92Å; M754-F757 HydrophobicContact CB-CZ 3.92Å; M754-F757 HydrophobicContact CG-CE1 3.57Å; M754-F757 HydrophobicContact CG-CZ 3.57Å; M754-F757 PolarHBondContact O-N 2.57Å; M754-I758 HydrophobicContact CB-CD1 4.44Å; M754-I758 VanDerWaalsContact O-CB 3.32Å; M754-I758 WeakPolarHBondContact O-CB 3.24Å; M754-I758 WeakPolarHBondContact O-CD1 3.24Å; M754-I758 WeakPolarHBondContact O-CG1 3.46Å; M754-I758 PolarHBondContact O-N 2.86Å
755	K	84.3	Confident	88.8	Confident	19 Å²	19	12.3 Å²	12.3	8%	0.083	6%	0.059	C	C	.	.	H	α-helix	trans	-51.1	-49	174.6	-148.6	-174.4	-176.3	-177.8	0	108.5	Y751 N752 I758 R759 E823 L825	Y751-K755 HydrophobicContact CE1-CD 4.11Å; Y751-K755 WeakPolarHBondContact O-CB 3.48Å; Y751-K755 PolarHBondContact O-N 2.96Å; N752-K755 WeakPolarHBondContact O-CB 3.27Å; N752-K755 PolarHBondContact O-N 3.22Å; K755-I758 PolarHBondContact O-N 3.09Å; K755-R759 VanDerWaalsContact CG-CZ 3.48Å; K755-R759 WeakPolarHBondContact O-CB 3.38Å; K755-R759 WeakPolarHBondContact O-CD 3.31Å; K755-R759 WeakPolarHBondContact O-CG 3.47Å; K755-R759 PolarHBondContact O-N 3.24Å; K755-E823 IonicContact NZ-OE1 2.99Å; K755-E823 PolarHBondContact NZ-OE1 3.46Å; K755-L825 WeakPolarHBondContact CE-O 3.48Å; K755-L825 HydrophobicContact CG-CD2 4.43Å
756	Q	85.9	Confident	88.6	Confident	18 Å²	18	11.1 Å²	11.1	8%	0.084	6%	0.057	C	C	.	.	H	α-helix	trans	-57.6	-50.4	-179.2	-163.3	91.7	55.4	0	0	113.8	N752 N753 M754 R759 Y760 S912 S914	N752-Q756 WeakPolarHBondContact O-CB 3.2Å; N752-Q756 PolarHBondContact O-N 3.35Å; N753-Q756 VanDerWaalsContact O-CB 3.29Å; N753-Q756 WeakPolarHBondContact O-CB 3.31Å; N753-Q756 PolarHBondContact O-N 3.41Å; M754-Q756 PolarHBondContact O-N 2.95Å; Q756-R759 WeakPolarHBondContact O-CB 3.48Å; Q756-R759 PolarHBondContact O-N 2.72Å; Q756-Y760 PolarHBondContact O-N 3.31Å; Q756-Y760 VanDerWaalsContact O-N 3.09Å; Q756-S912 WeakPolarHBondContact CG-O 3.43Å; Q756-S912 PolarHBondContact NE2-O 3.42Å; Q756-S914 VanDerWaalsContact NE2-C 3.25Å
757	F	90	Very high	88.6	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-76.5	-30.9	179.9	71.5	-118.2	0	0	0	113.2	L311 V314 I315 C318 N753 M754 R759 Y760 L761 A801 L804	L311-F757 HydrophobicContact CD1-CD2 4.32Å; L311-F757 HydrophobicContact CD1-CE2 3.98Å; V314-F757 HydrophobicContact CB-CE2 4.4Å; V314-F757 HydrophobicContact CG1-CD1 4.27Å; V314-F757 HydrophobicContact CG1-CD2 3.63Å; V314-F757 HydrophobicContact CG1-CE1 4.2Å; V314-F757 HydrophobicContact CG1-CE2 3.64Å; V314-F757 HydrophobicContact CG1-CG 4.01Å; V314-F757 HydrophobicContact CG1-CZ 3.94Å; I315-F757 HydrophobicContact CG1-CE2 3.72Å; I315-F757 HydrophobicContact CG1-CZ 3.86Å; C318-F757 HydrophobicContact CB-CE1 3.86Å; C318-F757 HydrophobicContact CB-CZ 4.25Å; N753-F757 WeakPolarHBondContact O-CD1 3.35Å; N753-F757 PolarHBondContact O-N 3.02Å; M754-F757 HydrophobicContact CB-CE1 3.92Å; M754-F757 HydrophobicContact CB-CZ 3.92Å; M754-F757 HydrophobicContact CG-CE1 3.57Å; M754-F757 HydrophobicContact CG-CZ 3.57Å; M754-F757 PolarHBondContact O-N 2.57Å; F757-R759 PolarHBondContact O-N 2.92Å; F757-Y760 WeakPolarHBondContact O-CB 3.4Å; F757-Y760 PolarHBondContact O-N 2.76Å; F757-L761 WeakPolarHBondContact O-CG 3.32Å; F757-L761 PolarHBondContact O-N 3.28Å; F757-A801 HydrophobicContact CB-CB 4.12Å; F757-A801 VanDerWaalsContact CB-O 3.31Å; F757-A801 WeakPolarHBondContact CB-O 3.31Å; F757-L804 HydrophobicContact CB-CB 3.92Å; F757-L804 HydrophobicContact CB-CD1 4.11Å
758	I	87.4	Confident	88.6	Confident	4 Å²	4	10.4 Å²	10.4	2%	0.021	5%	0.054	C	C	.	.	H	α-helix	trans	-58.9	-44.9	172.7	-74	164.1	0	0	0	108.9	L311 M754 K755 L761 I762	L311-I758 HydrophobicContact CD1-CB 4.48Å; L311-I758 HydrophobicContact CD1-CG1 3.66Å; M754-I758 HydrophobicContact CB-CD1 4.44Å; M754-I758 VanDerWaalsContact O-CB 3.32Å; M754-I758 WeakPolarHBondContact O-CB 3.24Å; M754-I758 WeakPolarHBondContact O-CD1 3.24Å; M754-I758 WeakPolarHBondContact O-CG1 3.46Å; M754-I758 PolarHBondContact O-N 2.86Å; K755-I758 PolarHBondContact O-N 3.09Å; I758-L761 PolarHBondContact O-N 3.02Å; I758-I762 HydrophobicContact CG2-CD1 3.54Å; I758-I762 HydrophobicContact CG2-CG1 4.44Å; I758-I762 WeakPolarHBondContact O-CB 3.32Å; I758-I762 WeakPolarHBondContact O-CD1 3.43Å; I758-I762 WeakPolarHBondContact O-CG1 3.28Å; I758-I762 PolarHBondContact O-N 3.47Å
759	R	82.9	Confident	88.5	Confident	4 Å²	4	10.6 Å²	10.6	2%	0.015	6%	0.057	C	C	.	.	H	α-helix	trans	-63.1	-42.5	177.1	-68.6	155.5	170.1	-175.8	-16.7	112.3	K755 Q756 F757 S763 L830 Y834 E915	K755-R759 VanDerWaalsContact CG-CZ 3.48Å; K755-R759 WeakPolarHBondContact O-CB 3.38Å; K755-R759 WeakPolarHBondContact O-CD 3.31Å; K755-R759 WeakPolarHBondContact O-CG 3.47Å; K755-R759 PolarHBondContact O-N 3.24Å; Q756-R759 WeakPolarHBondContact O-CB 3.48Å; Q756-R759 PolarHBondContact O-N 2.72Å; F757-R759 PolarHBondContact O-N 2.92Å; R759-S763 VanDerWaalsContact O-CB 3.3Å; R759-S763 WeakPolarHBondContact O-CB 3.25Å; R759-S763 PolarHBondContact O-N 3.46Å; R759-L830 VanDerWaalsContact NE-CD2 3.34Å; R759-Y834 HydrophobicContact CB-CE1 4.36Å; R759-Y834 HydrophobicContact CB-CE2 3.77Å; R759-Y834 WeakPolarHBondContact CD-OH 3.46Å; R759-Y834 HydrophobicContact CG-CE2 3.62Å; R759-Y834 WeakPolarHBondContact CG-OH 3.3Å; R759-E915 IonicContact CZ-OE1 3.84Å; R759-E915 IonicContact CZ-OE2 2.81Å; R759-E915 VanDerWaalsContact CZ-OE2 3.3Å; R759-E915 IonicContact NH1-OE1 3.25Å; R759-E915 IonicContact NH1-OE2 2.68Å; R759-E915 PolarHBondContact NH1-OE2 3.32Å; R759-E915 IonicContact NH2-OE1 2.78Å; R759-E915 PolarHBondContact NH2-OE1 3.26Å; R759-E915 IonicContact NH2-OE2 3.02Å; R759-E915 PolarHBondContact NH2-OE2 2.89Å
760	Y	90.3	Very high	88.6	Confident	1 Å²	1	12.1 Å²	12.1	0%	0.004	7%	0.066	C	C	.	.	H	α-helix	trans	-58.4	-54.6	175.9	164.6	-111.9	0	0	0	111.3	Q756 F757 I762 S763 S764 D797 P800 A801 L804 E905 N908	Q756-Y760 PolarHBondContact O-N 3.31Å; Q756-Y760 VanDerWaalsContact O-N 3.09Å; F757-Y760 WeakPolarHBondContact O-CB 3.4Å; F757-Y760 PolarHBondContact O-N 2.76Å; Y760-I762 PolarHBondContact O-N 3.45Å; Y760-S763 WeakPolarHBondContact O-CB 3.27Å; Y760-S763 PolarHBondContact O-N 3.43Å; Y760-S764 PolarHBondContact O-N 2.99Å; Y760-S764 VanDerWaalsContact O-N 3.14Å; Y760-D797 HydrophobicContact CE1-CB 3.99Å; Y760-D797 WeakPolarHBondContact CE1-O 3.11Å; Y760-D797 PolarHBondContact OH-OD1 3.31Å; Y760-P800 HydrophobicContact CE1-CB 4.15Å; Y760-A801 HydrophobicContact CD1-CB 3.91Å; Y760-A801 HydrophobicContact CE1-CB 4.06Å; Y760-L804 HydrophobicContact CD1-CD1 4.15Å; Y760-L804 HydrophobicContact CG-CD1 4.1Å; Y760-E905 HydrophobicContact CE2-CB 4.24Å; Y760-E905 WeakPolarHBondContact CE2-O 3.49Å; Y760-E905 VanDerWaalsContact CE2-OE2 3.24Å; Y760-E905 WeakPolarHBondContact CE2-OE2 3.47Å; Y760-N908 HydrophobicContact CD2-CB 4.47Å; Y760-N908 HydrophobicContact CE2-CB 4.36Å
761	L	90.5	Very high	88.8	Confident	3 Å²	3	12.2 Å²	12.2	2%	0.016	7%	0.066	C	C	.	.	H	α-helix	trans	-58.9	-48.1	179.6	-68.3	176.2	0	0	0	111.6	L311 V314 F757 I758 S763 S764 N765 D797 A801	L311-L761 HydrophobicContact CB-CD1 4.2Å; L311-L761 HydrophobicContact CD1-CD1 3.85Å; V314-L761 HydrophobicContact CG2-CD1 4.46Å; F757-L761 WeakPolarHBondContact O-CG 3.32Å; F757-L761 PolarHBondContact O-N 3.28Å; I758-L761 PolarHBondContact O-N 3.02Å; L761-S763 VanDerWaalsContact C-N 3.29Å; L761-S763 PolarHBondContact O-N 3.17Å; L761-S764 WeakPolarHBondContact O-CB 3.32Å; L761-S764 PolarHBondContact O-N 3.41Å; L761-S764 VanDerWaalsContact O-N 3.1Å; L761-N765 PolarHBondContact O-N 2.98Å; L761-N765 PolarHBondContact O-OD1 3.25Å; L761-D797 HydrophobicContact CD2-CB 3.72Å; L761-A801 HydrophobicContact CD1-CB 4Å; L761-A801 HydrophobicContact CD2-CB 3.82Å; L761-A801 HydrophobicContact CG-CB 3.88Å
762	I	85.9	Confident	88.8	Confident	19 Å²	19	12.2 Å²	12.2	10%	0.097	7%	0.067	C	C	.	.	H	α-helix	trans	-62.6	-37.5	179.5	-67	168.2	0	0	0	111.8	F256 I758 Y760 S764 N765 V766 I826	F256-I762 HydrophobicContact CD2-CD1 4.4Å; F256-I762 HydrophobicContact CE1-CD1 4.08Å; F256-I762 HydrophobicContact CE1-CG1 4.46Å; F256-I762 HydrophobicContact CE2-CD1 3.57Å; F256-I762 HydrophobicContact CE2-CG1 4.31Å; F256-I762 HydrophobicContact CZ-CD1 3.38Å; F256-I762 HydrophobicContact CZ-CG1 3.74Å; I758-I762 HydrophobicContact CG2-CD1 3.54Å; I758-I762 HydrophobicContact CG2-CG1 4.44Å; I758-I762 WeakPolarHBondContact O-CB 3.32Å; I758-I762 WeakPolarHBondContact O-CD1 3.43Å; I758-I762 WeakPolarHBondContact O-CG1 3.28Å; I758-I762 PolarHBondContact O-N 3.47Å; Y760-I762 PolarHBondContact O-N 3.45Å; I762-S764 VanDerWaalsContact C-N 3.28Å; I762-S764 PolarHBondContact O-N 2.7Å; I762-N765 PolarHBondContact O-N 2.99Å; I762-V766 HydrophobicContact CG2-CG2 4.32Å; I762-V766 VanDerWaalsContact O-CG2 3.29Å; I762-V766 WeakPolarHBondContact O-CG2 3.39Å; I762-V766 PolarHBondContact O-N 3.42Å; I762-I826 HydrophobicContact CD1-CD1 3.93Å; I762-I826 HydrophobicContact CG2-CD1 4.2Å
763	S	87.6	Confident	88.8	Confident	1 Å²	1	12.9 Å²	12.9	1%	0.007	7%	0.067	C	C	.	.	H	α-helix	trans	-61.6	-38.5	176.6	-175.1	0	0	0	0	111.8	R759 Y760 L761 G767 I837	R759-S763 VanDerWaalsContact O-CB 3.3Å; R759-S763 WeakPolarHBondContact O-CB 3.25Å; R759-S763 PolarHBondContact O-N 3.46Å; Y760-S763 WeakPolarHBondContact O-CB 3.27Å; Y760-S763 PolarHBondContact O-N 3.43Å; L761-S763 VanDerWaalsContact C-N 3.29Å; L761-S763 PolarHBondContact O-N 3.17Å; S763-G767 PolarHBondContact O-N 3.03Å; S763-I837 WeakPolarHBondContact OG-CG2 3.32Å
764	S	90.8	Very high	88.8	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-63	-55.2	174.6	-173.7	0	0	0	0	110.5	Y760 L761 I762 V766 G767 E768 D797 E905	Y760-S764 PolarHBondContact O-N 2.99Å; Y760-S764 VanDerWaalsContact O-N 3.14Å; L761-S764 WeakPolarHBondContact O-CB 3.32Å; L761-S764 PolarHBondContact O-N 3.41Å; L761-S764 VanDerWaalsContact O-N 3.1Å; I762-S764 VanDerWaalsContact C-N 3.28Å; I762-S764 PolarHBondContact O-N 2.7Å; S764-V766 VanDerWaalsContact C-N 3.29Å; S764-V766 PolarHBondContact O-N 2.95Å; S764-G767 CarbonylContact O-C 3.48Å; S764-G767 VanDerWaalsContact O-CA 3.29Å; S764-G767 WeakPolarHBondContact O-CA 2.91Å; S764-G767 PolarHBondContact O-N 3.42Å; S764-E768 PolarHBondContact O-N 2.98Å; S764-D797 VanDerWaalsContact CB-OD2 3.31Å; S764-D797 WeakPolarHBondContact CB-OD2 3.41Å; S764-D797 PolarHBondContact OG-OD2 2.72Å; S764-E905 VanDerWaalsContact CB-CD 3.47Å; S764-E905 WeakPolarHBondContact OG-CG 3.3Å
765	N	90.6	Very high	88.8	Confident	7 Å²	7	15 Å²	15	4%	0.037	8%	0.079	C	C	.	.	H	α-helix	trans	-56.4	-37.8	178.4	-71.4	96.2	0	0	0	113.3	A305 I307 L761 I762 G767 E768 V769 N793	A305-N765 WeakPolarHBondContact O-CB 3.32Å; A305-N765 PolarHBondContact O-ND2 2.85Å; I307-N765 PolarHBondContact O-ND2 3.38Å; L761-N765 PolarHBondContact O-N 2.98Å; L761-N765 PolarHBondContact O-OD1 3.25Å; I762-N765 PolarHBondContact O-N 2.99Å; N765-G767 VanDerWaalsContact C-N 3.28Å; N765-G767 PolarHBondContact O-N 3.07Å; N765-E768 PolarHBondContact O-N 3.48Å; N765-V769 WeakPolarHBondContact O-CB 3.35Å; N765-V769 VanDerWaalsContact O-CG2 3.32Å; N765-V769 WeakPolarHBondContact O-CG2 3.29Å; N765-V769 PolarHBondContact O-N 2.97Å; N765-N793 PolarHBondContact ND2-ND2 3Å
766	V	90.1	Very high	88.7	Confident	49 Å²	49	14.5 Å²	14.5	30%	0.297	8%	0.079	S	C	.	.	H	α-helix	trans	-61.5	-39.9	173.6	170.8	0	0	0	0	110.8	I762 S764 V770	I762-V766 HydrophobicContact CG2-CG2 4.32Å; I762-V766 VanDerWaalsContact O-CG2 3.29Å; I762-V766 WeakPolarHBondContact O-CG2 3.39Å; I762-V766 PolarHBondContact O-N 3.42Å; S764-V766 VanDerWaalsContact C-N 3.29Å; S764-V766 PolarHBondContact O-N 2.95Å; V766-V770 VanDerWaalsContact O-CG2 3.26Å; V766-V770 WeakPolarHBondContact O-CG2 3.29Å; V766-V770 PolarHBondContact O-N 2.86Å
767	G	91.4	Very high	88.6	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64.9	-42.2	174.6	0	0	0	0	0	113.7	S763 S764 N765 V770 C771 G838 G842	S763-G767 PolarHBondContact O-N 3.03Å; S764-G767 CarbonylContact O-C 3.48Å; S764-G767 VanDerWaalsContact O-CA 3.29Å; S764-G767 WeakPolarHBondContact O-CA 2.91Å; S764-G767 PolarHBondContact O-N 3.42Å; N765-G767 VanDerWaalsContact C-N 3.28Å; N765-G767 PolarHBondContact O-N 3.07Å; G767-V770 PolarHBondContact O-N 2.93Å; G767-C771 WeakPolarHBondContact O-CB 3.46Å; G767-C771 PolarHBondContact O-N 2.79Å; G767-G838 WeakPolarHBondContact CA-O 3.27Å; G767-G842 VanDerWaalsContact O-CA 3.31Å; G767-G842 WeakPolarHBondContact O-CA 3.36Å
768	E	92.4	Very high	88.3	Confident	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-61.2	-45.2	175	-59.7	-174.8	153.3	0	0	111.4	A305 S764 N765 V770 C771 I772 L789 N793 L901	A305-E768 HydrophobicContact CB-CB 3.95Å; S764-E768 PolarHBondContact O-N 2.98Å; N765-E768 PolarHBondContact O-N 3.48Å; E768-V770 PolarHBondContact O-N 2.9Å; E768-C771 WeakPolarHBondContact O-CB 3.27Å; E768-C771 PolarHBondContact O-N 3.27Å; E768-I772 WeakPolarHBondContact O-CG1 3.44Å; E768-I772 PolarHBondContact O-N 3.49Å; E768-L789 HydrophobicContact CB-CD2 4.2Å; E768-L789 HydrophobicContact CG-CD2 3.92Å; E768-N793 PolarHBondContact OE1-OD1 2.93Å; E768-N793 PolarHBondContact OE2-ND2 3.2Å; E768-N793 PolarHBondContact OE2-OD1 2.79Å; E768-L901 HydrophobicContact CG-CD1 4.43Å; E768-L901 HydrophobicContact CG-CD2 4.2Å
769	V	90.1	Very high	88	Confident	22 Å²	22	20.5 Å²	20.5	13%	0.133	12%	0.115	C	C	.	.	H	α-helix	trans	-60.8	-45.4	175.2	167.3	0	0	0	0	111.4	I267 L302 A305 A306 N765 C771 I772 F773	I267-V769 HydrophobicContact CD1-CG1 3.85Å; L302-V769 HydrophobicContact CD1-CB 4.44Å; L302-V769 HydrophobicContact CD1-CG1 4Å; L302-V769 HydrophobicContact CD1-CG2 4.37Å; A305-V769 HydrophobicContact CB-CG2 4.36Å; A306-V769 HydrophobicContact CB-CG2 3.67Å; N765-V769 WeakPolarHBondContact O-CB 3.35Å; N765-V769 VanDerWaalsContact O-CG2 3.32Å; N765-V769 WeakPolarHBondContact O-CG2 3.29Å; N765-V769 PolarHBondContact O-N 2.97Å; V769-C771 VanDerWaalsContact C-N 3.31Å; V769-C771 PolarHBondContact O-N 3.29Å; V769-I772 PolarHBondContact O-N 2.71Å; V769-F773 WeakPolarHBondContact O-CB 3.4Å; V769-F773 PolarHBondContact O-N 3.12Å
770	V	91.6	Very high	88.1	Confident	37 Å²	37	20.6 Å²	20.6	22%	0.224	12%	0.116	C	C	.	.	H	α-helix	trans	-62.8	-40	176.7	171.1	0	0	0	0	110.8	V766 G767 E768 F773 L774	V766-V770 VanDerWaalsContact O-CG2 3.26Å; V766-V770 WeakPolarHBondContact O-CG2 3.29Å; V766-V770 PolarHBondContact O-N 2.86Å; G767-V770 PolarHBondContact O-N 2.93Å; E768-V770 PolarHBondContact O-N 2.9Å; V770-F773 PolarHBondContact O-N 3.43Å; V770-L774 HydrophobicContact CG1-CD1 3.7Å; V770-L774 HydrophobicContact CG1-CG 4.1Å; V770-L774 VanDerWaalsContact O-CB 3.3Å; V770-L774 WeakPolarHBondContact O-CB 3.47Å; V770-L774 WeakPolarHBondContact O-CG 3.37Å; V770-L774 PolarHBondContact O-N 3.32Å
771	C	92.4	Very high	87.9	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.007	12%	0.119	C	C	.	.	H	α-helix	trans	-57.8	-55.7	176.3	-179.8	0	0	0	0	111.3	G767 E768 V769 F773 L774 T775 T845 V846	G767-C771 WeakPolarHBondContact O-CB 3.46Å; G767-C771 PolarHBondContact O-N 2.79Å; E768-C771 WeakPolarHBondContact O-CB 3.27Å; E768-C771 PolarHBondContact O-N 3.27Å; V769-C771 VanDerWaalsContact C-N 3.31Å; V769-C771 PolarHBondContact O-N 3.29Å; C771-F773 VanDerWaalsContact C-N 3.32Å; C771-F773 PolarHBondContact O-N 3.39Å; C771-L774 PolarHBondContact O-N 3.06Å; C771-T775 PolarHBondContact O-N 2.95Å; C771-T775 PolarHBondContact O-OG1 2.89Å; C771-T845 WeakPolarHBondContact CB-OG1 3.35Å; C771-T845 PolarHBondContact SG-OG1 3.45Å; C771-V846 HydrophobicContact CB-CG2 4.35Å
772	I	88.3	Confident	87.6	Confident	11 Å²	11	23.5 Å²	23.5	6%	0.056	13%	0.13	C	C	.	.	H	α-helix	trans	-62.5	-41.3	-179.8	-63.7	178.2	0	0	0	111.1	I298 A301 L302 A305 E768 V769 L774 T775 A776 L789	I298-I772 HydrophobicContact CG2-CG2 4.08Å; A301-I772 HydrophobicContact CB-CD1 4.16Å; A301-I772 WeakPolarHBondContact O-CD1 3.19Å; L302-I772 HydrophobicContact CB-CG2 4.33Å; L302-I772 HydrophobicContact CD1-CB 4.29Å; L302-I772 HydrophobicContact CD1-CG2 4.14Å; A305-I772 HydrophobicContact CB-CD1 3.51Å; E768-I772 WeakPolarHBondContact O-CG1 3.44Å; E768-I772 PolarHBondContact O-N 3.49Å; V769-I772 PolarHBondContact O-N 2.71Å; I772-L774 PolarHBondContact O-N 3.36Å; I772-T775 PolarHBondContact O-OG1 3.3Å; I772-A776 VanDerWaalsContact O-CB 3.26Å; I772-A776 WeakPolarHBondContact O-CB 3.46Å; I772-A776 PolarHBondContact O-N 2.98Å; I772-L789 HydrophobicContact CD1-CD1 3.84Å
773	F	86.6	Confident	87.8	Confident	67 Å²	67	22.7 Å²	22.7	29%	0.294	13%	0.126	S	C	.	.	H	α-helix	trans	-63.8	-41.8	179.3	-177.1	-106.2	0	0	0	112.1	I267 V271 V769 V770 C771 I777	I267-F773 HydrophobicContact CG2-CD2 3.93Å; I267-F773 HydrophobicContact CG2-CE2 4.29Å; V271-F773 HydrophobicContact CG2-CD2 3.95Å; V271-F773 HydrophobicContact CG2-CE2 4.26Å; V769-F773 WeakPolarHBondContact O-CB 3.4Å; V769-F773 PolarHBondContact O-N 3.12Å; V770-F773 PolarHBondContact O-N 3.43Å; C771-F773 VanDerWaalsContact C-N 3.32Å; C771-F773 PolarHBondContact O-N 3.39Å; F773-I777 HydrophobicContact CD1-CD1 3.91Å; F773-I777 HydrophobicContact CD2-CD1 4.05Å; F773-I777 HydrophobicContact CE1-CD1 3.34Å; F773-I777 HydrophobicContact CE2-CD1 3.49Å; F773-I777 VanDerWaalsContact CE2-CD1 3.49Å; F773-I777 HydrophobicContact CE2-CG1 4.35Å; F773-I777 HydrophobicContact CG-CD1 4.26Å; F773-I777 HydrophobicContact CZ-CD1 3.12Å; F773-I777 HydrophobicContact CZ-CG1 4.36Å; F773-I777 WeakPolarHBondContact O-CB 3.28Å; F773-I777 WeakPolarHBondContact O-CG1 3.22Å; F773-I777 PolarHBondContact O-N 3.43Å
774	L	88.5	Confident	87.9	Confident	39 Å²	39	23 Å²	23	20%	0.204	13%	0.128	C	C	.	.	H	α-helix	trans	-69	-43.3	178	-74.7	176.4	0	0	0	112.3	V770 C771 I772 A776 L778 L843 V846	V770-L774 HydrophobicContact CG1-CD1 3.7Å; V770-L774 HydrophobicContact CG1-CG 4.1Å; V770-L774 VanDerWaalsContact O-CB 3.3Å; V770-L774 WeakPolarHBondContact O-CB 3.47Å; V770-L774 WeakPolarHBondContact O-CG 3.37Å; V770-L774 PolarHBondContact O-N 3.32Å; C771-L774 PolarHBondContact O-N 3.06Å; I772-L774 PolarHBondContact O-N 3.36Å; L774-A776 VanDerWaalsContact C-N 3.32Å; L774-A776 PolarHBondContact O-N 3.21Å; L774-L778 WeakPolarHBondContact O-CB 3.38Å; L774-L778 VanDerWaalsContact O-CG 3.24Å; L774-L778 WeakPolarHBondContact O-CG 3.29Å; L774-L778 PolarHBondContact O-N 2.86Å; L774-L843 HydrophobicContact CD1-CD2 3.62Å; L774-L843 HydrophobicContact CD1-CG 4.12Å; L774-V846 HydrophobicContact CB-CG2 4.12Å
775	T	87	Confident	87.7	Confident	12 Å²	12	24.6 Å²	24.6	7%	0.074	14%	0.136	C	C	.	.	H	α-helix	trans	-62	-42.6	176	53.7	0	0	0	0	111.2	C771 I772 G779 L780 A783 V846	C771-T775 PolarHBondContact O-N 2.95Å; C771-T775 PolarHBondContact O-OG1 2.89Å; I772-T775 PolarHBondContact O-OG1 3.3Å; T775-G779 PolarHBondContact O-N 2.97Å; T775-L780 PolarHBondContact O-N 3.32Å; T775-A783 HydrophobicContact CG2-CB 3.69Å; T775-V846 HydrophobicContact CG2-CG1 4.37Å; T775-V846 HydrophobicContact CG2-CG2 3.75Å
776	A	82.4	Confident	87.4	Confident	9 Å²	9	24.4 Å²	24.4	7%	0.074	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-46	179	0	0	0	0	0	113	I298 I772 L774 G779	I298-A776 HydrophobicContact CD1-CB 4.35Å; I298-A776 HydrophobicContact CG2-CB 4.2Å; I772-A776 VanDerWaalsContact O-CB 3.26Å; I772-A776 WeakPolarHBondContact O-CB 3.46Å; I772-A776 PolarHBondContact O-N 2.98Å; L774-A776 VanDerWaalsContact C-N 3.32Å; L774-A776 PolarHBondContact O-N 3.21Å; A776-G779 PolarHBondContact O-N 3.43Å
777	I	83.3	Confident	87.1	Confident	65 Å²	65	22.8 Å²	22.8	33%	0.333	13%	0.125	S	C	.	.	H	α-helix	trans	-71.3	-37.8	-179.3	-74.6	-178.4	0	0	0	112.2	I274 F773 G779	I274-I777 HydrophobicContact CD1-CD1 3.98Å; I274-I777 HydrophobicContact CD1-CG1 4.32Å; F773-I777 HydrophobicContact CD1-CD1 3.91Å; F773-I777 HydrophobicContact CD2-CD1 4.05Å; F773-I777 HydrophobicContact CE1-CD1 3.34Å; F773-I777 HydrophobicContact CE2-CD1 3.49Å; F773-I777 VanDerWaalsContact CE2-CD1 3.49Å; F773-I777 HydrophobicContact CE2-CG1 4.35Å; F773-I777 HydrophobicContact CG-CD1 4.26Å; F773-I777 HydrophobicContact CZ-CD1 3.12Å; F773-I777 HydrophobicContact CZ-CG1 4.36Å; F773-I777 WeakPolarHBondContact O-CB 3.28Å; F773-I777 WeakPolarHBondContact O-CG1 3.22Å; F773-I777 PolarHBondContact O-N 3.43Å; I777-G779 PolarHBondContact O-N 2.83Å
778	L	84.9	Confident	87.1	Confident	64 Å²	64	22.8 Å²	22.8	34%	0.335	13%	0.125	S	C	.	.	H	α-helix	trans	-79.6	-7.6	-179.9	-63.8	175.7	0	0	0	112.5	L774 L780 R868	L774-L778 WeakPolarHBondContact O-CB 3.38Å; L774-L778 VanDerWaalsContact O-CG 3.24Å; L774-L778 WeakPolarHBondContact O-CG 3.29Å; L774-L778 PolarHBondContact O-N 2.86Å; L778-L780 VanDerWaalsContact C-N 3.33Å; L778-L780 HydrophobicContact CB-CD1 3.87Å; L778-L780 HydrophobicContact CB-CG 3.78Å; L778-L780 HydrophobicContact CD1-CD1 3.99Å; L778-R868 VanDerWaalsContact O-CD 3.25Å; L778-R868 WeakPolarHBondContact O-CD 3.42Å; L778-R868 WeakPolarHBondContact O-CG 3.34Å
779	G	79.6	Confident	86.9	Confident	19 Å²	19	22.8 Å²	22.8	20%	0.196	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	35.7	-177.7	0	0	0	0	0	112.5	T775 A776 I777 R868 F870	T775-G779 PolarHBondContact O-N 2.97Å; A776-G779 PolarHBondContact O-N 3.43Å; I777-G779 PolarHBondContact O-N 2.83Å; G779-R868 CarbonylContact O-C 3.34Å; G779-R868 WeakPolarHBondContact O-CA 3.29Å; G779-F870 WeakPolarHBondContact O-CE1 3.12Å
780	L	86.3	Confident	86.7	Confident	6 Å²	6	22 Å²	22	3%	0.031	12%	0.12	C	C	.	.	P	Polyproline II helix	trans	-91.2	156.8	179.4	-60.2	173.2	0	0	0	110.4	T775 L778 V846 F864 L867 F870	T775-L780 PolarHBondContact O-N 3.32Å; L778-L780 VanDerWaalsContact C-N 3.33Å; L778-L780 HydrophobicContact CB-CD1 3.87Å; L778-L780 HydrophobicContact CB-CG 3.78Å; L778-L780 HydrophobicContact CD1-CD1 3.99Å; L780-V846 HydrophobicContact CD1-CG1 3.77Å; L780-F864 HydrophobicContact CD2-CE2 4.11Å; L780-L867 HydrophobicContact CD2-CD2 3.87Å; L780-L867 HydrophobicContact CD2-CG 3.8Å; L780-F870 VanDerWaalsContact C-CE1 3.47Å
781	P	85.8	Confident	86.7	Confident	13 Å²	13	23.3 Å²	23.3	8%	0.084	12%	0.121	C	C	.	.	P	Polyproline II helix	trans	-52.6	150.4	167.3	-24.5	33.6	0	0	0	111.7	A783 Y853 L867 F870 F888	P781-A783 PolarHBondContact O-N 2.88Å; P781-A783 VanDerWaalsContact O-N 3.13Å; P781-Y853 HydrophobicContact CB-CE2 4.48Å; P781-Y853 HydrophobicContact CG-CE2 4.21Å; P781-L867 HydrophobicContact CG-CD1 3.85Å; P781-F870 HydrophobicContact CB-CE2 4.39Å; P781-F870 HydrophobicContact CB-CZ 4.36Å; P781-F870 HydrophobicContact CG-CB 4.33Å; P781-F870 HydrophobicContact CG-CD1 3.83Å; P781-F870 HydrophobicContact CG-CD2 3.97Å; P781-F870 HydrophobicContact CG-CE1 4.07Å; P781-F870 HydrophobicContact CG-CE2 4.2Å; P781-F870 HydrophobicContact CG-CG 3.77Å; P781-F870 HydrophobicContact CG-CZ 4.24Å; P781-F888 HydrophobicContact CG-CD1 4.21Å
782	E	84.2	Confident	86.7	Confident	52 Å²	52	23.3 Å²	23.3	24%	0.243	12%	0.121	C	C	.	.	P	Polyproline II helix	trans	-59.5	117.4	179.9	-66.9	178	-167	0	0	110.1
783	A	89.4	Confident	86.8	Confident	2 Å²	2	22.9 Å²	22.9	2%	0.017	12%	0.119	C	C	.	.	S	Bend	trans	-76.9	-30.5	179.9	0	0	0	0	0	112.3	T775 P781 A849 T894 A897	T775-A783 HydrophobicContact CG2-CB 3.69Å; P781-A783 PolarHBondContact O-N 2.88Å; P781-A783 VanDerWaalsContact O-N 3.13Å; A783-A849 HydrophobicContact CB-CB 4.09Å; A783-T894 WeakPolarHBondContact O-CA 3.47Å; A783-A897 HydrophobicContact CB-CB 4.08Å; A783-A897 WeakPolarHBondContact O-CB 3.29Å
784	L	90.6	Very high	86.8	Confident	8 Å²	8	23 Å²	23	4%	0.042	12%	0.122	C	C	.	.	S	Bend	trans	-142.4	143.5	-178.9	-67.4	171.2	0	0	0	109.5	L789 A897 L898 L901	L784-L789 HydrophobicContact CB-CD2 3.99Å; L784-L789 HydrophobicContact CB-CG 4.4Å; L784-L789 HydrophobicContact CD1-CD2 3.75Å; L784-L789 HydrophobicContact CG-CD2 4.4Å; L784-A897 HydrophobicContact CD2-CB 4.04Å; L784-A897 HydrophobicContact CG-CB 4.23Å; L784-L898 HydrophobicContact CD2-CB 3.93Å; L784-L898 HydrophobicContact CD2-CD1 4.21Å; L784-L901 HydrophobicContact CD1-CD2 3.82Å
785	I	86.1	Confident	86.9	Confident	32 Å²	32	22.6 Å²	22.6	16%	0.164	12%	0.122	C	C	.	.			trans	-108.7	157.2	178.5	60.3	163.7	0	0	0	111.7	V787 Q788 L789 Q955	I785-V787 VanDerWaalsContact C-N 3.3Å; I785-V787 HydrophobicContact CD1-CB 4.45Å; I785-V787 PolarHBondContact O-N 3.23Å; I785-Q788 HydrophobicContact CD1-CG 4.2Å; I785-Q788 HydrophobicContact CG1-CB 4.18Å; I785-Q788 HydrophobicContact CG1-CG 3.57Å; I785-Q788 WeakPolarHBondContact O-CB 3.34Å; I785-Q788 PolarHBondContact O-N 3.44Å; I785-L789 PolarHBondContact O-N 3.26Å; I785-Q955 HydrophobicContact CD1-CB 4.01Å; I785-Q955 HydrophobicContact CD1-CG 4.1Å
786	P	83.5	Confident	87.2	Confident	4 Å²	4	22.1 Å²	22.1	3%	0.026	12%	0.118	C	C	.	.	H	α-helix	trans	-54.1	-40.8	-175.7	-27.9	35.1	0	0	0	114.6	E90 A301 Q788 L789 L790	E90-P786 HydrophobicContact CG-CB 4.22Å; A301-P786 HydrophobicContact CB-CG 3.78Å; P786-Q788 VanDerWaalsContact C-N 3.27Å; P786-Q788 PolarHBondContact O-N 2.83Å; P786-L789 PolarHBondContact O-N 3.33Å; P786-L790 WeakPolarHBondContact O-CG 3.26Å; P786-L790 PolarHBondContact O-N 3.15Å
787	V	84.5	Confident	87.8	Confident	14 Å²	14	21.7 Å²	21.7	9%	0.085	12%	0.115	C	C	.	.	H	α-helix	trans	-62.7	-34.5	-179.5	179.8	0	0	0	0	112	E90 I785 W791 F954	E90-V787 HydrophobicContact CB-CG2 4.07Å; E90-V787 HydrophobicContact CG-CG2 4.32Å; I785-V787 VanDerWaalsContact C-N 3.3Å; I785-V787 HydrophobicContact CD1-CB 4.45Å; I785-V787 PolarHBondContact O-N 3.23Å; V787-W791 PolarHBondContact O-N 3.13Å; V787-F954 HydrophobicContact CG1-CD1 3.85Å; V787-F954 HydrophobicContact CG1-CE1 3.82Å
788	Q	90.8	Very high	88.2	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-70.6	-44.8	176	-67.6	167.4	-8.7	0	0	111.2	I785 P786 L790 W791 V792 L898 F954	I785-Q788 HydrophobicContact CD1-CG 4.2Å; I785-Q788 HydrophobicContact CG1-CB 4.18Å; I785-Q788 HydrophobicContact CG1-CG 3.57Å; I785-Q788 WeakPolarHBondContact O-CB 3.34Å; I785-Q788 PolarHBondContact O-N 3.44Å; P786-Q788 VanDerWaalsContact C-N 3.27Å; P786-Q788 PolarHBondContact O-N 2.83Å; Q788-L790 PolarHBondContact O-N 3.25Å; Q788-W791 WeakPolarHBondContact O-CB 3.33Å; Q788-W791 PolarHBondContact O-N 3.04Å; Q788-V792 WeakPolarHBondContact O-CG2 3.31Å; Q788-V792 PolarHBondContact O-N 3.4Å; Q788-L898 HydrophobicContact CB-CD1 4.14Å; Q788-L898 HydrophobicContact CG-CD2 4.27Å; Q788-F954 WeakPolarHBondContact CG-O 3.47Å; Q788-F954 PolarHBondContact NE2-O 3.04Å
789	L	89.8	Confident	88.6	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62.9	-42.5	179.8	-59.3	175.7	0	0	0	111.5	A305 E768 I772 L784 I785 P786 W791 V792 N793 L901	A305-L789 HydrophobicContact CB-CD1 3.76Å; E768-L789 HydrophobicContact CB-CD2 4.2Å; E768-L789 HydrophobicContact CG-CD2 3.92Å; I772-L789 HydrophobicContact CD1-CD1 3.84Å; L784-L789 HydrophobicContact CB-CD2 3.99Å; L784-L789 HydrophobicContact CB-CG 4.4Å; L784-L789 HydrophobicContact CD1-CD2 3.75Å; L784-L789 HydrophobicContact CG-CD2 4.4Å; I785-L789 PolarHBondContact O-N 3.26Å; P786-L789 PolarHBondContact O-N 3.33Å; L789-W791 VanDerWaalsContact C-N 3.28Å; L789-W791 PolarHBondContact O-N 2.9Å; L789-V792 PolarHBondContact O-N 3.45Å; L789-V792 VanDerWaalsContact O-N 3.14Å; L789-N793 WeakPolarHBondContact O-CB 3.32Å; L789-N793 PolarHBondContact O-N 3.42Å; L789-L901 HydrophobicContact CD2-CD2 4.32Å
790	L	86.3	Confident	89.4	Confident	6 Å²	6	17.4 Å²	17.4	3%	0.031	9%	0.09	C	C	.	.	H	α-helix	trans	-58.8	-40	174.6	-72.3	172.6	0	0	0	112.2	V93 I94 I97 V304 E309 P786 Q788 L794	V93-L790 HydrophobicContact CG1-CD1 3.9Å; I94-L790 HydrophobicContact CG1-CD1 3.89Å; I97-L790 HydrophobicContact CD1-CB 4.49Å; I97-L790 HydrophobicContact CD1-CD1 4.42Å; I97-L790 HydrophobicContact CD1-CD2 3.89Å; V304-L790 HydrophobicContact CG1-CD1 4.44Å; V304-L790 HydrophobicContact CG1-CD2 3.61Å; V304-L790 HydrophobicContact CG1-CG 3.74Å; E309-L790 HydrophobicContact CG-CD2 4.3Å; E309-L790 WeakPolarHBondContact OE1-CD2 3.3Å; P786-L790 WeakPolarHBondContact O-CG 3.26Å; P786-L790 PolarHBondContact O-N 3.15Å; Q788-L790 PolarHBondContact O-N 3.25Å; L790-L794 WeakPolarHBondContact O-CB 3.21Å; L790-L794 PolarHBondContact O-N 2.64Å
791	W	90.8	Very high	89.7	Confident	65 Å²	65	17.1 Å²	17.1	25%	0.246	9%	0.088	C	C	.	.	H	α-helix	trans	-68.1	-40.9	175.9	179.4	-93.9	0	0	0	112.3	V787 Q788 L789 V795 T796 L940 I944 F954	V787-W791 PolarHBondContact O-N 3.13Å; Q788-W791 WeakPolarHBondContact O-CB 3.33Å; Q788-W791 PolarHBondContact O-N 3.04Å; L789-W791 VanDerWaalsContact C-N 3.28Å; L789-W791 PolarHBondContact O-N 2.9Å; W791-V795 HydrophobicContact CD2-CB 4.16Å; W791-V795 HydrophobicContact CD2-CG2 4.14Å; W791-V795 HydrophobicContact CE3-CB 4.37Å; W791-V795 HydrophobicContact CE3-CG2 3.85Å; W791-V795 HydrophobicContact CH2-CG1 4.17Å; W791-V795 HydrophobicContact CH2-CG2 4.24Å; W791-V795 HydrophobicContact CZ2-CB 4.28Å; W791-V795 HydrophobicContact CZ2-CG1 3.89Å; W791-V795 HydrophobicContact CZ2-CG2 4.49Å; W791-V795 HydrophobicContact CZ3-CG2 3.91Å; W791-V795 WeakPolarHBondContact O-CA 3.5Å; W791-V795 WeakPolarHBondContact O-CB 3.42Å; W791-V795 PolarHBondContact O-N 2.94Å; W791-T796 PolarHBondContact O-N 3.06Å; W791-L940 HydrophobicContact CZ2-CB 4.43Å; W791-I944 HydrophobicContact CZ2-CG2 3.91Å; W791-F954 HydrophobicContact CB-CD1 4.43Å; W791-F954 HydrophobicContact CB-CE1 3.6Å; W791-F954 HydrophobicContact CB-CZ 4.12Å; W791-F954 HydrophobicContact CD2-CE1 4.2Å; W791-F954 AromaticContact CD2-CZ 3.81Å; W791-F954 HydrophobicContact CD2-CZ 3.81Å; W791-F954 HydrophobicContact CE3-CE1 4.32Å; W791-F954 AromaticContact CE3-CZ 3.66Å; W791-F954 HydrophobicContact CE3-CZ 3.66Å; W791-F954 AromaticContact CG-CE1 3.92Å; W791-F954 HydrophobicContact CG-CE1 3.92Å; W791-F954 HydrophobicContact CG-CZ 4.02Å; W791-F954 HydrophobicContact CZ3-CZ 4.34Å
792	V	92.3	Very high	90	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	I	π-helix	trans	-62.4	-55.6	176.5	173.4	0	0	0	0	110.3	Q788 L789 L794 T796 D797 L898 L901 V902	Q788-V792 WeakPolarHBondContact O-CG2 3.31Å; Q788-V792 PolarHBondContact O-N 3.4Å; L789-V792 PolarHBondContact O-N 3.45Å; L789-V792 VanDerWaalsContact O-N 3.14Å; V792-L794 VanDerWaalsContact C-N 3.33Å; V792-L794 PolarHBondContact O-N 3.44Å; V792-T796 PolarHBondContact O-N 3.28Å; V792-D797 WeakPolarHBondContact O-CB 3.31Å; V792-D797 PolarHBondContact O-N 3.36Å; V792-L898 HydrophobicContact CG2-CD1 3.57Å; V792-L901 HydrophobicContact CB-CD2 4.5Å; V792-L901 HydrophobicContact CG1-CD2 4.07Å; V792-L901 HydrophobicContact CG1-CG 4.33Å; V792-L901 HydrophobicContact CG2-CD2 4.2Å; V792-V902 HydrophobicContact CG2-CG2 4.28Å
793	N	90.1	Very high	90.4	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.011	8%	0.084	C	C	.	.	I	π-helix	trans	-64.2	-33.7	-176	-71.8	-22.9	0	0	0	113.5	E309 N765 E768 L789	E309-N793 WeakPolarHBondContact OE2-CB 3.42Å; N765-N793 PolarHBondContact ND2-ND2 3Å; E768-N793 PolarHBondContact OE1-OD1 2.93Å; E768-N793 PolarHBondContact OE2-ND2 3.2Å; E768-N793 PolarHBondContact OE2-OD1 2.79Å; L789-N793 WeakPolarHBondContact O-CB 3.32Å; L789-N793 PolarHBondContact O-N 3.42Å
794	L	87	Confident	90.5	Very high	69 Å²	69	15.7 Å²	15.7	36%	0.361	8%	0.083	S	C	.	.	I	π-helix	trans	-88.7	-44.3	-177.9	-172.6	65	0	0	0	113.3	I97 L790 V792	I97-L794 HydrophobicContact CD1-CD2 4.38Å; I97-L794 HydrophobicContact CG1-CD2 4.41Å; L790-L794 WeakPolarHBondContact O-CB 3.21Å; L790-L794 PolarHBondContact O-N 2.64Å; V792-L794 VanDerWaalsContact C-N 3.33Å; V792-L794 PolarHBondContact O-N 3.44Å
795	V	90.8	Very high	90.4	Very high	32 Å²	32	15.4 Å²	15.4	19%	0.194	8%	0.082	C	C	.	.	I	π-helix	trans	-107.4	-58.5	-169.2	-176.6	0	0	0	0	111.1	W791 D797 L799 L940	W791-V795 HydrophobicContact CD2-CB 4.16Å; W791-V795 HydrophobicContact CD2-CG2 4.14Å; W791-V795 HydrophobicContact CE3-CB 4.37Å; W791-V795 HydrophobicContact CE3-CG2 3.85Å; W791-V795 HydrophobicContact CH2-CG1 4.17Å; W791-V795 HydrophobicContact CH2-CG2 4.24Å; W791-V795 HydrophobicContact CZ2-CB 4.28Å; W791-V795 HydrophobicContact CZ2-CG1 3.89Å; W791-V795 HydrophobicContact CZ2-CG2 4.49Å; W791-V795 HydrophobicContact CZ3-CG2 3.91Å; W791-V795 WeakPolarHBondContact O-CA 3.5Å; W791-V795 WeakPolarHBondContact O-CB 3.42Å; W791-V795 PolarHBondContact O-N 2.94Å; V795-D797 PolarHBondContact O-N 3.31Å; V795-L799 WeakPolarHBondContact O-CG 3.34Å; V795-L799 PolarHBondContact O-N 3.18Å; V795-L940 HydrophobicContact CG1-CD1 3.72Å
796	T	93.4	Very high	90.5	Very high	1 Å²	1	17 Å²	17	1%	0.006	9%	0.088	C	C	.	.	I	π-helix	trans	-62.5	-47.2	-174.4	-55.2	0	0	0	0	111.4	W791 V792 P800 V902 M906 S937	W791-T796 PolarHBondContact O-N 3.06Å; V792-T796 PolarHBondContact O-N 3.28Å; T796-P800 WeakPolarHBondContact O-CD 3.49Å; T796-P800 WeakPolarHBondContact O-CG 3.29Å; T796-V902 HydrophobicContact CG2-CB 4.32Å; T796-V902 HydrophobicContact CG2-CG1 3.76Å; T796-V902 HydrophobicContact CG2-CG2 3.98Å; T796-M906 HydrophobicContact CG2-CE 3.89Å; T796-S937 PolarHBondContact O-OG 2.91Å
797	D	94.4	Very high	90.7	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-28.2	179.7	-73	-15.5	0	0	0	112	Y760 L761 S764 V792 V795 L799 P800 A801 E905	Y760-D797 HydrophobicContact CE1-CB 3.99Å; Y760-D797 WeakPolarHBondContact CE1-O 3.11Å; Y760-D797 PolarHBondContact OH-OD1 3.31Å; L761-D797 HydrophobicContact CD2-CB 3.72Å; S764-D797 VanDerWaalsContact CB-OD2 3.31Å; S764-D797 WeakPolarHBondContact CB-OD2 3.41Å; S764-D797 PolarHBondContact OG-OD2 2.72Å; V792-D797 WeakPolarHBondContact O-CB 3.31Å; V792-D797 PolarHBondContact O-N 3.36Å; V795-D797 PolarHBondContact O-N 3.31Å; D797-L799 VanDerWaalsContact C-N 3.28Å; D797-L799 PolarHBondContact O-N 2.94Å; D797-P800 WeakPolarHBondContact O-CD 3.45Å; D797-A801 WeakPolarHBondContact O-CB 3.28Å; D797-A801 PolarHBondContact O-N 2.79Å; D797-E905 VanDerWaalsContact OD1-CB 3.32Å; D797-E905 WeakPolarHBondContact OD1-CB 3.16Å
798	G	91.8	Very high	90.6	Very high	6 Å²	6	18.9 Å²	18.9	6%	0.062	10%	0.1	C	C	.	.	H	α-helix	trans	-59.4	-37.6	177.6	0	0	0	0	0	113.3	T802	G798-T802 WeakPolarHBondContact O-CB 3.14Å; G798-T802 PolarHBondContact O-N 2.67Å; G798-T802 PolarHBondContact O-OG1 3.27Å
799	L	93.7	Very high	90.1	Very high	53 Å²	53	21.9 Å²	21.9	28%	0.277	12%	0.12	S	C	.	.	H	α-helix	trans	-67.4	-56.2	179.1	-72.6	173.9	0	0	0	112.6	V795 D797 A801 T802 A803 A933 L936 L940	V795-L799 WeakPolarHBondContact O-CG 3.34Å; V795-L799 PolarHBondContact O-N 3.18Å; D797-L799 VanDerWaalsContact C-N 3.28Å; D797-L799 PolarHBondContact O-N 2.94Å; L799-A801 VanDerWaalsContact C-N 3.34Å; L799-A801 PolarHBondContact O-N 3.18Å; L799-T802 PolarHBondContact O-N 3.32Å; L799-A803 PolarHBondContact O-N 3.05Å; L799-A933 HydrophobicContact CB-CB 4.37Å; L799-L936 HydrophobicContact CD1-CB 4.43Å; L799-L936 HydrophobicContact CD1-CD2 3.76Å; L799-L936 HydrophobicContact CD1-CG 3.83Å; L799-L936 HydrophobicContact CD2-CD2 4.25Å; L799-L940 HydrophobicContact CD1-CD1 3.75Å
800	P	94.9	Very high	89.6	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60	-39.4	173.2	-22.9	32.3	0	0	0	113.2	Y760 T796 D797 T802 A803 L804 M906 L930	Y760-P800 HydrophobicContact CE1-CB 4.15Å; T796-P800 WeakPolarHBondContact O-CD 3.49Å; T796-P800 WeakPolarHBondContact O-CG 3.29Å; D797-P800 WeakPolarHBondContact O-CD 3.45Å; P800-T802 VanDerWaalsContact C-N 3.31Å; P800-T802 PolarHBondContact O-N 3.32Å; P800-A803 CarbonylContact O-C 3.48Å; P800-A803 WeakPolarHBondContact O-CA 3.31Å; P800-A803 WeakPolarHBondContact O-CB 3.41Å; P800-A803 PolarHBondContact O-N 3.06Å; P800-L804 WeakPolarHBondContact O-CG 3.48Å; P800-L804 PolarHBondContact O-N 2.83Å; P800-M906 HydrophobicContact CG-CE 3.67Å; P800-M906 HydrophobicContact CG-SD 4.02Å; P800-L930 HydrophobicContact CB-CD1 3.94Å
801	A	93.4	Very high	89.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60	-42.8	177.3	0	0	0	0	0	111.6	V314 F757 Y760 L761 D797 L799 A803 L804 G805	V314-A801 HydrophobicContact CG1-CB 3.9Å; V314-A801 HydrophobicContact CG2-CB 4.05Å; F757-A801 HydrophobicContact CB-CB 4.12Å; F757-A801 VanDerWaalsContact CB-O 3.31Å; F757-A801 WeakPolarHBondContact CB-O 3.31Å; Y760-A801 HydrophobicContact CD1-CB 3.91Å; Y760-A801 HydrophobicContact CE1-CB 4.06Å; L761-A801 HydrophobicContact CD1-CB 4Å; L761-A801 HydrophobicContact CD2-CB 3.82Å; L761-A801 HydrophobicContact CG-CB 3.88Å; D797-A801 WeakPolarHBondContact O-CB 3.28Å; D797-A801 PolarHBondContact O-N 2.79Å; L799-A801 VanDerWaalsContact C-N 3.34Å; L799-A801 PolarHBondContact O-N 3.18Å; A801-A803 VanDerWaalsContact C-N 3.32Å; A801-A803 PolarHBondContact O-N 3.43Å; A801-L804 PolarHBondContact O-N 3.04Å; A801-G805 PolarHBondContact O-N 3.24Å
802	T	91.6	Very high	88.6	Confident	32 Å²	32	32.7 Å²	32.7	20%	0.196	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-40.2	172.8	-58.3	0	0	0	0	111.3	T317 G798 L799 P800 L804 G805 F806	T317-T802 HydrophobicContact CG2-CG2 3.84Å; G798-T802 WeakPolarHBondContact O-CB 3.14Å; G798-T802 PolarHBondContact O-N 2.67Å; G798-T802 PolarHBondContact O-OG1 3.27Å; L799-T802 PolarHBondContact O-N 3.32Å; P800-T802 VanDerWaalsContact C-N 3.31Å; P800-T802 PolarHBondContact O-N 3.32Å; T802-L804 PolarHBondContact O-N 2.93Å; T802-G805 WeakPolarHBondContact O-CA 3.46Å; T802-G805 PolarHBondContact O-N 2.93Å; T802-G805 VanDerWaalsContact O-N 3.1Å; T802-F806 WeakPolarHBondContact O-CD2 3.37Å
803	A	93.1	Very high	88.3	Confident	5 Å²	5	33.1 Å²	33.1	4%	0.041	18%	0.184	C	C	.	.	H	α-helix	trans	-66.3	-34.8	179.2	0	0	0	0	0	113.3	L799 P800 A801 G805 F806 N927 W929 L930 A933	L799-A803 PolarHBondContact O-N 3.05Å; P800-A803 CarbonylContact O-C 3.48Å; P800-A803 WeakPolarHBondContact O-CA 3.31Å; P800-A803 WeakPolarHBondContact O-CB 3.41Å; P800-A803 PolarHBondContact O-N 3.06Å; A801-A803 VanDerWaalsContact C-N 3.32Å; A801-A803 PolarHBondContact O-N 3.43Å; A803-G805 PolarHBondContact O-N 3.49Å; A803-F806 WeakPolarHBondContact O-CB 3.49Å; A803-F806 PolarHBondContact O-N 3.18Å; A803-N927 PolarHBondContact O-ND2 3.31Å; A803-W929 HydrophobicContact CB-CB 4.43Å; A803-L930 HydrophobicContact CB-CB 4.22Å; A803-L930 HydrophobicContact CB-CD1 4.09Å; A803-A933 HydrophobicContact CB-CB 3.65Å
804	L	92.1	Very high	88.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.1	-25.3	172.1	-72.2	174.6	0	0	0	112.4	F757 Y760 P800 A801 T802 F806 N807 S912 L930	F757-L804 HydrophobicContact CB-CB 3.92Å; F757-L804 HydrophobicContact CB-CD1 4.11Å; Y760-L804 HydrophobicContact CD1-CD1 4.15Å; Y760-L804 HydrophobicContact CG-CD1 4.1Å; P800-L804 WeakPolarHBondContact O-CG 3.48Å; P800-L804 PolarHBondContact O-N 2.83Å; A801-L804 PolarHBondContact O-N 3.04Å; T802-L804 PolarHBondContact O-N 2.93Å; L804-F806 PolarHBondContact O-N 2.9Å; L804-F806 VanDerWaalsContact O-N 3.07Å; L804-N807 WeakPolarHBondContact O-CB 3.43Å; L804-N807 VanDerWaalsContact O-CG 3.25Å; L804-N807 PolarHBondContact O-N 3.28Å; L804-N807 VanDerWaalsContact O-N 3.09Å; L804-S912 VanDerWaalsContact CD2-O 3.28Å; L804-S912 WeakPolarHBondContact CD2-O 3.38Å; L804-L930 HydrophobicContact CD2-CD1 4.18Å; L804-L930 HydrophobicContact CD2-CD2 3.95Å; L804-L930 HydrophobicContact CG-CD1 4.19Å
805	G	88.9	Confident	88.2	Confident	2 Å²	2	36.5 Å²	36.5	2%	0.021	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-20.3	168	0	0	0	0	0	114.3	N753 A801 T802 A803	N753-G805 PolarHBondContact ND2-O 3.25Å; A801-G805 PolarHBondContact O-N 3.24Å; T802-G805 WeakPolarHBondContact O-CA 3.46Å; T802-G805 PolarHBondContact O-N 2.93Å; T802-G805 VanDerWaalsContact O-N 3.1Å; A803-G805 PolarHBondContact O-N 3.49Å
806	F	87.2	Confident	87.9	Confident	65 Å²	65	39.1 Å²	39.1	29%	0.285	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	13.3	179.3	-60.5	-87.8	0	0	0	114.4	L321 T802 A803 L804 W929	L321-F806 HydrophobicContact CD1-CE1 3.91Å; L321-F806 HydrophobicContact CD1-CE2 3.79Å; L321-F806 HydrophobicContact CD1-CZ 3.23Å; L321-F806 HydrophobicContact CD2-CE1 4.36Å; L321-F806 HydrophobicContact CD2-CZ 4.12Å; L321-F806 HydrophobicContact CG-CZ 4.19Å; T802-F806 WeakPolarHBondContact O-CD2 3.37Å; A803-F806 WeakPolarHBondContact O-CB 3.49Å; A803-F806 PolarHBondContact O-N 3.18Å; L804-F806 PolarHBondContact O-N 2.9Å; L804-F806 VanDerWaalsContact O-N 3.07Å; F806-W929 HydrophobicContact CD2-CB 4.44Å; F806-W929 HydrophobicContact CG-CG 4.46Å
807	N	87.3	Confident	87.7	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.021	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-58.4	142.4	173.2	-72.7	-8.2	0	0	0	110.6	N753 L804 L913 N927	N753-N807 PolarHBondContact ND2-N 3Å; N753-N807 PolarHBondContact ND2-O 3.34Å; N753-N807 WeakPolarHBondContact OD1-CB 3.37Å; L804-N807 WeakPolarHBondContact O-CB 3.43Å; L804-N807 VanDerWaalsContact O-CG 3.25Å; L804-N807 PolarHBondContact O-N 3.28Å; L804-N807 VanDerWaalsContact O-N 3.09Å; N807-L913 PolarHBondContact ND2-O 3.25Å; N807-L913 VanDerWaalsContact ND2-O 3.16Å; N807-N927 PolarHBondContact OD1-ND2 3.05Å
808	P	82.8	Confident	87.6	Confident	54 Å²	54	42.3 Å²	42.3	35%	0.351	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-65.6	148	175.6	29.1	-35	0	0	0	110.6	V926	P808-V926 HydrophobicContact CG-CG1 3.47Å; P808-V926 VanDerWaalsContact CG-CG1 3.47Å
809	P	81.6	Confident	87.4	Confident	64 Å²	64	43.6 Å²	43.6	42%	0.416	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-65.6	153	175.9	28.5	-34.6	0	0	0	111.6	A749 I813	A749-P809 HydrophobicContact CB-CB 3.8Å; P809-I813 HydrophobicContact CB-CD1 4.39Å
810	D	77.8	Confident	87	Confident	48 Å²	48	45.6 Å²	45.6	26%	0.257	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-65.9	145.5	170.1	-66	-37.9	0	0	0	110.9	N752 D812 I813	N752-D810 PolarHBondContact ND2-OD2 3.28Å; D810-D812 WeakPolarHBondContact CB-OD1 3.45Å; D810-D812 PolarHBondContact O-N 3.43Å; D810-I813 WeakPolarHBondContact O-CB 3.45Å; D810-I813 WeakPolarHBondContact O-CG2 3.47Å; D810-I813 PolarHBondContact O-N 2.97Å
811	L	75.6	Confident	86.5	Confident	184 Å²	184	46.9 Å²	46.9	96%	0.963	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-25.1	-178.7	-64.2	174.1	0	0	0	113.4
812	D	80.8	Confident	85.9	Confident	66 Å²	66	52.6 Å²	52.6	35%	0.353	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	15.6	-176.2	67.7	-16.5	0	0	0	112.6	D810 M814 D815 K816	D810-D812 WeakPolarHBondContact CB-OD1 3.45Å; D810-D812 PolarHBondContact O-N 3.43Å; D812-M814 PolarHBondContact O-N 2.92Å; D812-D815 HydrophobicContact CB-CB 4.46Å; D812-D815 PolarHBondContact O-N 3.45Å; D812-K816 VanDerWaalsContact CG-CE 3.48Å; D812-K816 PolarHBondContact O-N 3.31Å; D812-K816 IonicContact OD1-NZ 3.95Å; D812-K816 PolarHBondContact OD1-NZ 3.28Å; D812-K816 WeakPolarHBondContact OD2-CE 3.31Å; D812-K816 IonicContact OD2-NZ 2.72Å; D812-K816 PolarHBondContact OD2-NZ 3.02Å
813	I	85.2	Confident	85.4	Confident	9 Å²	9	54.2 Å²	54.2	5%	0.046	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.3	-170.7	-159.3	157.7	0	0	0	113.6	E745 R748 A749 P809 D810	E745-I813 HydrophobicContact CG-CG2 3.98Å; R748-I813 HydrophobicContact CB-CD1 3.74Å; R748-I813 HydrophobicContact CB-CG1 3.69Å; R748-I813 PolarHBondContact NH1-O 2.68Å; A749-I813 HydrophobicContact CB-CD1 4Å; P809-I813 HydrophobicContact CB-CD1 4.39Å; D810-I813 WeakPolarHBondContact O-CB 3.45Å; D810-I813 WeakPolarHBondContact O-CG2 3.47Å; D810-I813 PolarHBondContact O-N 2.97Å
814	M	88.8	Confident	84.8	Confident	24 Å²	24	56.8 Å²	56.8	12%	0.118	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-3.5	175.6	-67.8	-58.6	-72.6	0	0	113.6	A614 V741 E745 D812	A614-M814 WeakPolarHBondContact CA-O 3.31Å; A614-M814 HydrophobicContact CB-CE 3.85Å; A614-M814 WeakPolarHBondContact CB-O 3.48Å; A614-M814 PolarHBondContact N-O 2.89Å; V741-M814 HydrophobicContact CG1-CE 3.78Å; E745-M814 HydrophobicContact CB-CG 4.16Å; E745-M814 HydrophobicContact CB-SD 3.7Å; E745-M814 HydrophobicContact CG-CG 3.86Å; E745-M814 HydrophobicContact CG-SD 4.02Å; D812-M814 PolarHBondContact O-N 2.92Å
815	D	87.3	Confident	84.1	Confident	117 Å²	117	57.5 Å²	57.5	63%	0.626	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-13.1	174.3	-61.7	-31.9	0	0	0	111.9	D812	D812-D815 HydrophobicContact CB-CB 4.46Å; D812-D815 PolarHBondContact O-N 3.45Å
816	K	84.3	Confident	83.5	Confident	87 Å²	87	59.3 Å²	59.3	38%	0.378	31%	0.313	S	S	.	.	S	Bend	trans	-85	145.9	178	-69.4	172	-176.1	150.7	0	111	A614 R748 D812	A614-K816 VanDerWaalsContact O-O 3.09Å; R748-K816 PolarHBondContact NH1-O 3.25Å; D812-K816 VanDerWaalsContact CG-CE 3.48Å; D812-K816 PolarHBondContact O-N 3.31Å; D812-K816 IonicContact OD1-NZ 3.95Å; D812-K816 PolarHBondContact OD1-NZ 3.28Å; D812-K816 WeakPolarHBondContact OD2-CE 3.31Å; D812-K816 IonicContact OD2-NZ 2.72Å; D812-K816 PolarHBondContact OD2-NZ 3.02Å
817	P	89.8	Confident	83	Confident	50 Å²	50	59.1 Å²	59.1	33%	0.325	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-67	164.1	172.3	30.7	-35.9	0	0	0	111.3	Y997	P817-Y997 HydrophobicContact CB-CE1 4.19Å; P817-Y997 HydrophobicContact CG-CD1 4.39Å; P817-Y997 HydrophobicContact CG-CE1 3.66Å
818	P	91.9	Very high	82.8	Confident	19 Å²	19	62 Å²	62	12%	0.123	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-57.3	140.5	173.1	-21.2	33.9	0	0	0	111.3	A614 G615 I616	A614-P818 WeakPolarHBondContact O-CD 3.41Å; G615-P818 WeakPolarHBondContact O-CD 3.46Å; I616-P818 HydrophobicContact CG1-CG 4.02Å
819	R	87.1	Confident	82.9	Confident	33 Å²	33	63 Å²	63	13%	0.125	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-62.9	141.4	178.3	-170.9	-177.8	67.6	93.5	-9.6	110.3	E340 C344 Y751 P821 E823	E340-R819 IonicContact OE1-NH2 2.94Å; E340-R819 PolarHBondContact OE1-NH2 2.69Å; C344-R819 PolarHBondContact SG-NE 3.18Å; C344-R819 VanDerWaalsContact SG-NE 3.39Å; C344-R819 PolarHBondContact SG-NH2 2.86Å; Y751-R819 VanDerWaalsContact CZ-NE 3.33Å; Y751-R819 PolarHBondContact OH-NE 2.94Å; Y751-R819 PolarHBondContact OH-NH1 2.95Å; R819-P821 WeakPolarHBondContact O-CD 3.49Å; R819-E823 HydrophobicContact CG-CB 4.4Å; R819-E823 WeakPolarHBondContact CG-OE2 3.27Å; R819-E823 PolarHBondContact NH1-O 3.09Å
820	N	86.2	Confident	83	Confident	94 Å²	94	60.4 Å²	60.4	50%	0.503	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-69.9	124.1	169.2	-171.7	-33.9	0	0	0	109.5	K822 E823	N820-K822 PolarHBondContact O-N 2.93Å; N820-K822 WeakPolarHBondContact OD1-CB 3.4Å; N820-K822 PolarHBondContact OD1-N 2.82Å; N820-E823 VanDerWaalsContact O-CB 3.27Å; N820-E823 WeakPolarHBondContact O-CB 3.45Å; N820-E823 PolarHBondContact O-N 3.44Å
821	P	83.4	Confident	83.3	Confident	27 Å²	27	64.1 Å²	64.1	18%	0.175	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-28.1	178.7	-26.9	36.3	0	0	0	113.6	P248 I694 R819 E823	P248-P821 HydrophobicContact CB-CB 4.45Å; P248-P821 HydrophobicContact CG-CB 4.48Å; I694-P821 HydrophobicContact CD1-CB 4.25Å; I694-P821 HydrophobicContact CD1-CG 3.64Å; I694-P821 HydrophobicContact CG1-CG 3.53Å; R819-P821 WeakPolarHBondContact O-CD 3.49Å; P821-E823 VanDerWaalsContact C-N 3.31Å; P821-E823 PolarHBondContact O-N 2.9Å
822	K	81.7	Confident	84	Confident	121 Å²	121	60.5 Å²	60.5	53%	0.526	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-6	180	-60.9	178.8	178	168.1	0	113.5	D692 N820	D692-K822 WeakPolarHBondContact OD1-CE 3.48Å; D692-K822 IonicContact OD1-NZ 2.65Å; D692-K822 PolarHBondContact OD1-NZ 3.33Å; D692-K822 IonicContact OD2-NZ 2.62Å; D692-K822 PolarHBondContact OD2-NZ 2.92Å; N820-K822 PolarHBondContact O-N 2.93Å; N820-K822 WeakPolarHBondContact OD1-CB 3.4Å; N820-K822 PolarHBondContact OD1-N 2.82Å
823	E	81.2	Confident	84.4	Confident	65 Å²	65	57.7 Å²	57.7	30%	0.304	30%	0.304	S	S	.	.			trans	-60.3	127.5	175.5	-170.6	-169.9	149.8	0	0	110.1	K755 R819 N820 P821	K755-E823 IonicContact NZ-OE1 2.99Å; K755-E823 PolarHBondContact NZ-OE1 3.46Å; R819-E823 HydrophobicContact CG-CB 4.4Å; R819-E823 WeakPolarHBondContact CG-OE2 3.27Å; R819-E823 PolarHBondContact NH1-O 3.09Å; N820-E823 VanDerWaalsContact O-CB 3.27Å; N820-E823 WeakPolarHBondContact O-CB 3.45Å; N820-E823 PolarHBondContact O-N 3.44Å; P821-E823 VanDerWaalsContact C-N 3.31Å; P821-E823 PolarHBondContact O-N 2.9Å
824	P	80.6	Confident	84.3	Confident	59 Å²	59	58.1 Å²	58.1	38%	0.383	31%	0.305	S	S	.	.			trans	-73.7	151.5	176.3	32	-36.1	0	0	0	111.4	I826	P824-I826 VanDerWaalsContact C-N 3.26Å; P824-I826 PolarHBondContact O-N 3.37Å
825	L	75.9	Confident	84.3	Confident	15 Å²	15	61.3 Å²	61.3	8%	0.079	32%	0.323	C	S	.	.	S	Bend	trans	-62.5	-34.5	175.9	-70.8	167.8	0	0	0	112.3	K252 Y751 K755	K252-L825 HydrophobicContact CB-CD1 4.12Å; K252-L825 HydrophobicContact CB-CG 4.33Å; Y751-L825 HydrophobicContact CE2-CD2 4.47Å; K755-L825 WeakPolarHBondContact CE-O 3.48Å; K755-L825 HydrophobicContact CG-CD2 4.43Å
826	I	76.6	Confident	84.6	Confident	41 Å²	41	57.1 Å²	57.1	21%	0.21	30%	0.304	C	S	.	.	S	Bend	trans	-129.5	124	-179.8	-50.3	176.2	0	0	0	108.5	I762 P824 F831 Y834	I762-I826 HydrophobicContact CD1-CD1 3.93Å; I762-I826 HydrophobicContact CG2-CD1 4.2Å; P824-I826 VanDerWaalsContact C-N 3.26Å; P824-I826 PolarHBondContact O-N 3.37Å; I826-F831 HydrophobicContact CG2-CB 3.77Å; I826-F831 HydrophobicContact CG2-CD2 4.09Å; I826-F831 HydrophobicContact CG2-CG 4.45Å; I826-Y834 HydrophobicContact CG2-CD2 4.31Å
827	S	77.1	Confident	85	Confident	61 Å²	61	53 Å²	53	43%	0.427	29%	0.286	S	S	.	.			trans	-131.5	144.7	-178.7	63.8	0	0	0	0	112.4	W829 L830 F831	S827-W829 PolarHBondContact O-N 3.31Å; S827-L830 WeakPolarHBondContact O-CA 3.49Å; S827-L830 VanDerWaalsContact O-CB 3.25Å; S827-L830 WeakPolarHBondContact O-CB 3.03Å; S827-L830 PolarHBondContact O-N 3.18Å; S827-F831 PolarHBondContact O-N 3.19Å
828	G	83.1	Confident	85	Confident	64 Å²	64	50.6 Å²	50.6	66%	0.66	27%	0.271	S	S	*	.	H	α-helix	trans	33.7	-102.6	166.2	0	0	0	0	0	116.7	L830 F831 F832	G828-L830 VanDerWaalsContact C-N 3.32Å; G828-L830 PolarHBondContact O-N 3.04Å; G828-F831 WeakPolarHBondContact O-CB 3.39Å; G828-F831 PolarHBondContact O-N 3.2Å; G828-F832 PolarHBondContact O-N 2.92Å
829	W	85.9	Confident	85.1	Confident	76 Å²	76	50.6 Å²	50.6	29%	0.288	27%	0.274	S	S	.	.	H	α-helix	trans	-60	-40.1	-178.8	174.2	-114.2	0	0	0	113.2	S827 F831 F832 R833 L981 I984 L989	S827-W829 PolarHBondContact O-N 3.31Å; W829-F831 VanDerWaalsContact C-N 3.33Å; W829-F831 PolarHBondContact O-N 3.33Å; W829-F832 HydrophobicContact CE3-CD1 4.05Å; W829-F832 HydrophobicContact CH2-CD1 4.23Å; W829-F832 HydrophobicContact CH2-CE1 4.31Å; W829-F832 AromaticContact CZ3-CD1 3.7Å; W829-F832 HydrophobicContact CZ3-CD1 3.7Å; W829-F832 HydrophobicContact CZ3-CE1 4.02Å; W829-F832 PolarHBondContact O-N 3.29Å; W829-R833 PolarHBondContact O-N 3.4Å; W829-L981 HydrophobicContact CH2-CD2 4.19Å; W829-L981 HydrophobicContact CZ2-CD2 4.22Å; W829-I984 HydrophobicContact CH2-CB 4.38Å; W829-I984 HydrophobicContact CH2-CD1 4.46Å; W829-I984 HydrophobicContact CH2-CG2 3.79Å; W829-I984 HydrophobicContact CZ2-CB 4.02Å; W829-I984 HydrophobicContact CZ2-CG2 3.71Å; W829-L989 HydrophobicContact CB-CD1 4.09Å; W829-L989 HydrophobicContact CD2-CD1 3.42Å; W829-L989 VanDerWaalsContact CD2-CD1 3.42Å; W829-L989 HydrophobicContact CE3-CD1 4.04Å; W829-L989 HydrophobicContact CG-CD1 3.41Å; W829-L989 VanDerWaalsContact CG-CD1 3.41Å; W829-L989 HydrophobicContact CZ2-CD1 4.29Å
830	L	82.1	Confident	85.6	Confident	9 Å²	9	51.9 Å²	51.9	5%	0.047	28%	0.279	C	S	.	.	H	α-helix	trans	-67.1	-38.3	-178.8	-161.4	77	0	0	0	111.4	R759 S827 G828 R833 Y834 E915	R759-L830 VanDerWaalsContact NE-CD2 3.34Å; S827-L830 WeakPolarHBondContact O-CA 3.49Å; S827-L830 VanDerWaalsContact O-CB 3.25Å; S827-L830 WeakPolarHBondContact O-CB 3.03Å; S827-L830 PolarHBondContact O-N 3.18Å; G828-L830 VanDerWaalsContact C-N 3.32Å; G828-L830 PolarHBondContact O-N 3.04Å; L830-R833 PolarHBondContact O-N 3.45Å; L830-Y834 HydrophobicContact CD1-CE2 4.08Å; L830-Y834 WeakPolarHBondContact CD1-OH 3.21Å; L830-Y834 HydrophobicContact CD2-CE2 3.67Å; L830-Y834 HydrophobicContact CG-CD2 4.24Å; L830-Y834 HydrophobicContact CG-CE2 3.4Å; L830-Y834 VanDerWaalsContact CG-CE2 3.4Å; L830-Y834 WeakPolarHBondContact O-CD2 3.43Å; L830-Y834 PolarHBondContact O-N 3.42Å; L830-Y834 VanDerWaalsContact O-N 3.16Å; L830-E915 HydrophobicContact CD1-CG 4.38Å
831	F	85	Confident	86	Confident	125 Å²	125	47.4 Å²	47.4	55%	0.548	26%	0.255	S	S	.	.	H	α-helix	trans	-59	-47.2	172.3	179.7	-101.6	0	0	0	111.4	I826 S827 G828 W829 R833 Y834 L835	I826-F831 HydrophobicContact CG2-CB 3.77Å; I826-F831 HydrophobicContact CG2-CD2 4.09Å; I826-F831 HydrophobicContact CG2-CG 4.45Å; S827-F831 PolarHBondContact O-N 3.19Å; G828-F831 WeakPolarHBondContact O-CB 3.39Å; G828-F831 PolarHBondContact O-N 3.2Å; W829-F831 VanDerWaalsContact C-N 3.33Å; W829-F831 PolarHBondContact O-N 3.33Å; F831-R833 VanDerWaalsContact C-N 3.35Å; F831-R833 PolarHBondContact O-N 2.95Å; F831-Y834 PolarHBondContact O-N 2.85Å; F831-L835 HydrophobicContact CE1-CD1 3.93Å; F831-L835 HydrophobicContact CZ-CD1 4.08Å; F831-L835 WeakPolarHBondContact O-CB 3.43Å; F831-L835 PolarHBondContact O-N 2.96Å
832	F	90	Very high	86.5	Confident	108 Å²	108	46.1 Å²	46.1	47%	0.474	25%	0.247	S	C	.	.	H	α-helix	trans	-60.5	-43.7	177.2	171.5	-99.1	0	0	0	112.3	G828 W829 Y834 L835 A836	G828-F832 PolarHBondContact O-N 2.92Å; W829-F832 HydrophobicContact CE3-CD1 4.05Å; W829-F832 HydrophobicContact CH2-CD1 4.23Å; W829-F832 HydrophobicContact CH2-CE1 4.31Å; W829-F832 AromaticContact CZ3-CD1 3.7Å; W829-F832 HydrophobicContact CZ3-CD1 3.7Å; W829-F832 HydrophobicContact CZ3-CE1 4.02Å; W829-F832 PolarHBondContact O-N 3.29Å; F832-Y834 VanDerWaalsContact C-N 3.33Å; F832-Y834 PolarHBondContact O-N 3.49Å; F832-L835 PolarHBondContact O-N 3.13Å; F832-A836 PolarHBondContact O-N 3.09Å
833	R	89.8	Confident	87.1	Confident	7 Å²	7	45 Å²	45	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-57.2	-45.6	178.5	173.4	169	174	-158.9	-11.1	111.8	W829 L830 F831 A836 I837 E915 D978 L981 K982	W829-R833 PolarHBondContact O-N 3.4Å; L830-R833 PolarHBondContact O-N 3.45Å; F831-R833 VanDerWaalsContact C-N 3.35Å; F831-R833 PolarHBondContact O-N 2.95Å; R833-A836 WeakPolarHBondContact O-CB 3.37Å; R833-A836 PolarHBondContact O-N 3.42Å; R833-I837 HydrophobicContact CG-CD1 4.1Å; R833-I837 WeakPolarHBondContact O-CG1 3.34Å; R833-I837 PolarHBondContact O-N 3.29Å; R833-E915 PolarHBondContact NH1-O 2.81Å; R833-D978 IonicContact CZ-OD1 3.7Å; R833-D978 IonicContact CZ-OD2 3.08Å; R833-D978 IonicContact NE-OD1 2.68Å; R833-D978 PolarHBondContact NE-OD1 3.34Å; R833-D978 IonicContact NH2-OD1 3.67Å; R833-D978 PolarHBondContact NH2-OD1 3.22Å; R833-D978 IonicContact NH2-OD2 2.73Å; R833-D978 PolarHBondContact NH2-OD2 3.34Å; R833-L981 HydrophobicContact CB-CD1 4.45Å; R833-L981 HydrophobicContact CG-CB 4.15Å; R833-L981 HydrophobicContact CG-CD1 3.84Å; R833-K982 VanDerWaalsContact CZ-CG 3.48Å
834	Y	83.4	Confident	87.8	Confident	18 Å²	18	42.1 Å²	42.1	7%	0.071	23%	0.234	C	C	.	.	H	α-helix	trans	-72.6	-32.6	177.9	-57.9	-40.3	0	0	0	113.3	R759 I826 L830 F831 F832 A836 I837 G838	R759-Y834 HydrophobicContact CB-CE1 4.36Å; R759-Y834 HydrophobicContact CB-CE2 3.77Å; R759-Y834 WeakPolarHBondContact CD-OH 3.46Å; R759-Y834 HydrophobicContact CG-CE2 3.62Å; R759-Y834 WeakPolarHBondContact CG-OH 3.3Å; I826-Y834 HydrophobicContact CG2-CD2 4.31Å; L830-Y834 HydrophobicContact CD1-CE2 4.08Å; L830-Y834 WeakPolarHBondContact CD1-OH 3.21Å; L830-Y834 HydrophobicContact CD2-CE2 3.67Å; L830-Y834 HydrophobicContact CG-CD2 4.24Å; L830-Y834 HydrophobicContact CG-CE2 3.4Å; L830-Y834 VanDerWaalsContact CG-CE2 3.4Å; L830-Y834 WeakPolarHBondContact O-CD2 3.43Å; L830-Y834 PolarHBondContact O-N 3.42Å; L830-Y834 VanDerWaalsContact O-N 3.16Å; F831-Y834 PolarHBondContact O-N 2.85Å; F832-Y834 VanDerWaalsContact C-N 3.33Å; F832-Y834 PolarHBondContact O-N 3.49Å; Y834-A836 VanDerWaalsContact C-N 3.26Å; Y834-A836 PolarHBondContact O-N 3.2Å; Y834-I837 HydrophobicContact CD1-CD1 4.32Å; Y834-I837 PolarHBondContact O-N 3.25Å; Y834-G838 PolarHBondContact O-N 3.35Å
835	L	87.7	Confident	88.5	Confident	92 Å²	92	39.3 Å²	39.3	48%	0.482	22%	0.216	S	C	.	.	H	α-helix	trans	-63.7	-35.6	172.1	-166.9	143.3	0	0	0	111.4	F831 F832 G839	F831-L835 HydrophobicContact CE1-CD1 3.93Å; F831-L835 HydrophobicContact CZ-CD1 4.08Å; F831-L835 WeakPolarHBondContact O-CB 3.43Å; F831-L835 PolarHBondContact O-N 2.96Å; F832-L835 PolarHBondContact O-N 3.13Å; L835-G839 WeakPolarHBondContact O-CA 3.5Å; L835-G839 PolarHBondContact O-N 3.06Å
836	A	92.8	Very high	89.4	Confident	29 Å²	29	39 Å²	39	24%	0.24	22%	0.215	C	C	.	.	H	α-helix	trans	-69.1	-43	174.2	0	0	0	0	0	112.6	F832 R833 Y834 Y840 L981	F832-A836 PolarHBondContact O-N 3.09Å; R833-A836 WeakPolarHBondContact O-CB 3.37Å; R833-A836 PolarHBondContact O-N 3.42Å; Y834-A836 VanDerWaalsContact C-N 3.26Å; Y834-A836 PolarHBondContact O-N 3.2Å; A836-Y840 WeakPolarHBondContact O-CB 3.44Å; A836-Y840 PolarHBondContact O-N 2.98Å; A836-L981 HydrophobicContact CB-CD1 4.37Å
837	I	92.7	Very high	90.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-68.4	-50.7	177.9	-64.1	166.9	0	0	0	110.7	S763 R833 Y834 G839 Y840 V841 V974 D978 L981	S763-I837 WeakPolarHBondContact OG-CG2 3.32Å; R833-I837 HydrophobicContact CG-CD1 4.1Å; R833-I837 WeakPolarHBondContact O-CG1 3.34Å; R833-I837 PolarHBondContact O-N 3.29Å; Y834-I837 HydrophobicContact CD1-CD1 4.32Å; Y834-I837 PolarHBondContact O-N 3.25Å; I837-G839 VanDerWaalsContact C-N 3.3Å; I837-G839 PolarHBondContact O-N 3.12Å; I837-Y840 CarbonylContact O-C 3.21Å; I837-Y840 WeakPolarHBondContact O-CA 3.33Å; I837-Y840 VanDerWaalsContact O-CB 3.31Å; I837-Y840 WeakPolarHBondContact O-CB 3.37Å; I837-Y840 PolarHBondContact O-N 3.49Å; I837-V841 HydrophobicContact CG2-CG2 4.47Å; I837-V841 VanDerWaalsContact O-CG2 3.31Å; I837-V841 WeakPolarHBondContact O-CG2 3.49Å; I837-V841 PolarHBondContact O-N 3.49Å; I837-V974 HydrophobicContact CG2-CG2 4.07Å; I837-D978 HydrophobicContact CD1-CB 4.33Å; I837-D978 VanDerWaalsContact CD1-OD1 3.23Å; I837-D978 WeakPolarHBondContact CD1-OD1 3.28Å; I837-L981 HydrophobicContact CG1-CD1 4.48Å
838	G	91.8	Very high	91.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-40	175.6	0	0	0	0	0	111.8	G767 Y834 Y840 V841 G842	G767-G838 WeakPolarHBondContact CA-O 3.27Å; Y834-G838 PolarHBondContact O-N 3.35Å; G838-Y840 VanDerWaalsContact C-N 3.29Å; G838-Y840 PolarHBondContact O-N 3.12Å; G838-V841 WeakPolarHBondContact O-CB 3.45Å; G838-V841 PolarHBondContact O-N 3.44Å; G838-G842 PolarHBondContact O-N 2.99Å
839	G	94	Very high	91.7	Very high	18 Å²	18	34.5 Å²	34.5	19%	0.186	18%	0.177	C	C	.	.	H	α-helix	trans	-57.8	-41.2	171.2	0	0	0	0	0	112.9	L835 I837 L843	L835-G839 WeakPolarHBondContact O-CA 3.5Å; L835-G839 PolarHBondContact O-N 3.06Å; I837-G839 VanDerWaalsContact C-N 3.3Å; I837-G839 PolarHBondContact O-N 3.12Å; G839-L843 WeakPolarHBondContact O-CB 3.47Å; G839-L843 WeakPolarHBondContact O-CD1 3.31Å; G839-L843 VanDerWaalsContact O-CG 3.27Å; G839-L843 WeakPolarHBondContact O-CG 3.36Å; G839-L843 PolarHBondContact O-N 3.01Å
840	Y	96	Very high	92.1	Very high	60 Å²	60	31.7 Å²	31.7	24%	0.235	17%	0.168	C	C	.	.	H	α-helix	trans	-65.8	-43.7	174.4	-178	-96	0	0	0	112.5	A836 I837 G838 L843 G844 I904 I970 P973 V974 L977	A836-Y840 WeakPolarHBondContact O-CB 3.44Å; A836-Y840 PolarHBondContact O-N 2.98Å; I837-Y840 CarbonylContact O-C 3.21Å; I837-Y840 WeakPolarHBondContact O-CA 3.33Å; I837-Y840 VanDerWaalsContact O-CB 3.31Å; I837-Y840 WeakPolarHBondContact O-CB 3.37Å; I837-Y840 PolarHBondContact O-N 3.49Å; G838-Y840 VanDerWaalsContact C-N 3.29Å; G838-Y840 PolarHBondContact O-N 3.12Å; Y840-L843 PolarHBondContact O-N 3.26Å; Y840-G844 PolarHBondContact O-N 3.35Å; Y840-I904 HydrophobicContact CD1-CD1 4.33Å; Y840-I904 HydrophobicContact CE1-CD1 4.08Å; Y840-I970 PolarHBondContact OH-O 2.86Å; Y840-P973 WeakPolarHBondContact OH-CB 3.18Å; Y840-V974 HydrophobicContact CD1-CB 4.13Å; Y840-V974 HydrophobicContact CD1-CG2 4.17Å; Y840-V974 HydrophobicContact CE1-CB 4.01Å; Y840-L977 HydrophobicContact CD2-CD2 4.42Å; Y840-L977 HydrophobicContact CG-CD2 4.11Å
841	V	94.8	Very high	92.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.1	-55.3	175.7	174.3	0	0	0	0	110	I837 G838 L843 G844 T845 L901 I904	I837-V841 HydrophobicContact CG2-CG2 4.47Å; I837-V841 VanDerWaalsContact O-CG2 3.31Å; I837-V841 WeakPolarHBondContact O-CG2 3.49Å; I837-V841 PolarHBondContact O-N 3.49Å; G838-V841 WeakPolarHBondContact O-CB 3.45Å; G838-V841 PolarHBondContact O-N 3.44Å; V841-L843 VanDerWaalsContact C-N 3.34Å; V841-L843 PolarHBondContact O-N 3.09Å; V841-G844 WeakPolarHBondContact O-CA 3.49Å; V841-G844 PolarHBondContact O-N 2.98Å; V841-T845 HydrophobicContact CG1-CG2 4.5Å; V841-T845 WeakPolarHBondContact O-CG2 3.22Å; V841-T845 PolarHBondContact O-N 3.3Å; V841-T845 PolarHBondContact O-OG1 2.91Å; V841-L901 HydrophobicContact CG1-CD1 3.51Å; V841-I904 HydrophobicContact CG2-CG2 3.54Å
842	G	94	Very high	93.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.2	-34.7	-177.1	0	0	0	0	0	113.6	G767 G838 T845 V846	G767-G842 VanDerWaalsContact O-CA 3.31Å; G767-G842 WeakPolarHBondContact O-CA 3.36Å; G838-G842 PolarHBondContact O-N 2.99Å; G842-T845 PolarHBondContact O-OG1 2.85Å; G842-T845 VanDerWaalsContact O-OG1 3.06Å; G842-V846 VanDerWaalsContact O-CG2 3.31Å; G842-V846 WeakPolarHBondContact O-CG2 3.32Å; G842-V846 PolarHBondContact O-N 2.82Å
843	L	95.3	Very high	93.3	Very high	97 Å²	97	23.9 Å²	23.9	51%	0.508	13%	0.131	S	C	.	.	H	α-helix	trans	-68	-40.1	170.9	-74.9	168.2	0	0	0	111.7	L774 G839 Y840 V841 S847	L774-L843 HydrophobicContact CD1-CD2 3.62Å; L774-L843 HydrophobicContact CD1-CG 4.12Å; G839-L843 WeakPolarHBondContact O-CB 3.47Å; G839-L843 WeakPolarHBondContact O-CD1 3.31Å; G839-L843 VanDerWaalsContact O-CG 3.27Å; G839-L843 WeakPolarHBondContact O-CG 3.36Å; G839-L843 PolarHBondContact O-N 3.01Å; Y840-L843 PolarHBondContact O-N 3.26Å; V841-L843 VanDerWaalsContact C-N 3.34Å; V841-L843 PolarHBondContact O-N 3.09Å; L843-S847 WeakPolarHBondContact O-CB 3.16Å; L843-S847 PolarHBondContact O-N 3.09Å; L843-S847 PolarHBondContact O-OG 3.1Å
844	G	95.7	Very high	93.4	Very high	5 Å²	5	25 Å²	25	5%	0.052	14%	0.138	C	C	.	.	H	α-helix	trans	-63.8	-45.9	-179.5	0	0	0	0	0	112.7	Y840 V841 S847 A848	Y840-G844 PolarHBondContact O-N 3.35Å; V841-G844 WeakPolarHBondContact O-CA 3.49Å; V841-G844 PolarHBondContact O-N 2.98Å; G844-S847 PolarHBondContact O-N 3.47Å; G844-A848 WeakPolarHBondContact O-CB 3.24Å; G844-A848 PolarHBondContact O-N 3.49Å
845	T	95.5	Very high	93.9	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-64.2	-48.8	178.9	53.4	0	0	0	0	111.8	C771 V841 G842 S847 A848 A849 V900 L901	C771-T845 WeakPolarHBondContact CB-OG1 3.35Å; C771-T845 PolarHBondContact SG-OG1 3.45Å; V841-T845 HydrophobicContact CG1-CG2 4.5Å; V841-T845 WeakPolarHBondContact O-CG2 3.22Å; V841-T845 PolarHBondContact O-N 3.3Å; V841-T845 PolarHBondContact O-OG1 2.91Å; G842-T845 PolarHBondContact O-OG1 2.85Å; G842-T845 VanDerWaalsContact O-OG1 3.06Å; T845-S847 VanDerWaalsContact C-N 3.34Å; T845-S847 PolarHBondContact O-N 3.47Å; T845-A848 PolarHBondContact O-N 3Å; T845-A849 PolarHBondContact O-N 3.42Å; T845-V900 HydrophobicContact CG2-CG1 4.32Å; T845-L901 HydrophobicContact CG2-CB 3.81Å; T845-L901 HydrophobicContact CG2-CD1 4.45Å
846	V	95.1	Very high	94.1	Very high	9 Å²	9	26.6 Å²	26.6	6%	0.055	14%	0.142	C	C	.	.	H	α-helix	trans	-63.8	-40.7	177.5	176.8	0	0	0	0	111.1	C771 L774 T775 L780 G842 A848 A849 T850	C771-V846 HydrophobicContact CB-CG2 4.35Å; L774-V846 HydrophobicContact CB-CG2 4.12Å; T775-V846 HydrophobicContact CG2-CG1 4.37Å; T775-V846 HydrophobicContact CG2-CG2 3.75Å; L780-V846 HydrophobicContact CD1-CG1 3.77Å; G842-V846 VanDerWaalsContact O-CG2 3.31Å; G842-V846 WeakPolarHBondContact O-CG2 3.32Å; G842-V846 PolarHBondContact O-N 2.82Å; V846-A848 VanDerWaalsContact C-N 3.31Å; V846-A848 PolarHBondContact O-N 3.01Å; V846-A849 PolarHBondContact O-N 2.98Å; V846-T850 VanDerWaalsContact O-CB 3.29Å; V846-T850 WeakPolarHBondContact O-CB 3.26Å; V846-T850 PolarHBondContact O-N 3.46Å; V846-T850 PolarHBondContact O-OG1 3.43Å
847	S	94.7	Very high	93.8	Very high	63 Å²	63	33.7 Å²	33.7	44%	0.441	17%	0.17	S	C	.	.	H	α-helix	trans	-63.4	-37.8	176.7	-62.1	0	0	0	0	111.8	L843 G844 T845 W851	L843-S847 WeakPolarHBondContact O-CB 3.16Å; L843-S847 PolarHBondContact O-N 3.09Å; L843-S847 PolarHBondContact O-OG 3.1Å; G844-S847 PolarHBondContact O-N 3.47Å; T845-S847 VanDerWaalsContact C-N 3.34Å; T845-S847 PolarHBondContact O-N 3.47Å; S847-W851 WeakPolarHBondContact O-CB 3.22Å; S847-W851 PolarHBondContact O-N 3Å
848	A	95.5	Very high	93.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69	-43.7	178.7	0	0	0	0	0	112.6	G844 T845 V846 W851 W852 M896 V900 I970	G844-A848 WeakPolarHBondContact O-CB 3.24Å; G844-A848 PolarHBondContact O-N 3.49Å; T845-A848 PolarHBondContact O-N 3Å; V846-A848 VanDerWaalsContact C-N 3.31Å; V846-A848 PolarHBondContact O-N 3.01Å; A848-W851 PolarHBondContact O-N 3.11Å; A848-W852 PolarHBondContact O-N 3.08Å; A848-M896 HydrophobicContact CB-CB 4.4Å; A848-V900 HydrophobicContact CB-CB 4.23Å; A848-V900 HydrophobicContact CB-CG2 3.59Å; A848-I970 HydrophobicContact CB-CD1 4.02Å
849	A	94.1	Very high	93.1	Very high	7 Å²	7	40.2 Å²	40.2	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-46.6	173	0	0	0	0	0	111.3	A783 T845 V846 W851 W852 Y853 P893 A897	A783-A849 HydrophobicContact CB-CB 4.09Å; T845-A849 PolarHBondContact O-N 3.42Å; V846-A849 PolarHBondContact O-N 2.98Å; A849-W851 VanDerWaalsContact C-N 3.31Å; A849-W851 PolarHBondContact O-N 3.18Å; A849-W852 WeakPolarHBondContact O-CB 3.41Å; A849-W852 PolarHBondContact O-N 3.01Å; A849-Y853 WeakPolarHBondContact O-CD2 3.38Å; A849-P893 HydrophobicContact CB-CB 4.14Å; A849-A897 HydrophobicContact CB-CB 4.21Å
850	T	93.6	Very high	92.8	Very high	17 Å²	17	41.3 Å²	41.3	10%	0.104	21%	0.208	C	C	.	.	H	α-helix	trans	-66.6	-34.1	180	-50.4	0	0	0	0	111.7	V846 W852 Y853 L854 F864 L867	V846-T850 VanDerWaalsContact O-CB 3.29Å; V846-T850 WeakPolarHBondContact O-CB 3.26Å; V846-T850 PolarHBondContact O-N 3.46Å; V846-T850 PolarHBondContact O-OG1 3.43Å; T850-W852 VanDerWaalsContact C-N 3.29Å; T850-W852 PolarHBondContact O-N 3.12Å; T850-Y853 PolarHBondContact O-N 3.31Å; T850-L854 HydrophobicContact CG2-CD1 3.34Å; T850-L854 HydrophobicContact CG2-CG 4.12Å; T850-L854 WeakPolarHBondContact O-CB 3.29Å; T850-L854 WeakPolarHBondContact O-CG 3.28Å; T850-L854 PolarHBondContact O-N 2.97Å; T850-L854 VanDerWaalsContact O-N 3.09Å; T850-F864 HydrophobicContact CG2-CD2 4.13Å; T850-F864 HydrophobicContact CG2-CE2 4.2Å; T850-L867 HydrophobicContact CG2-CD2 3.59Å
851	W	95.4	Very high	92.5	Very high	60 Å²	60	44.2 Å²	44.2	23%	0.227	22%	0.224	C	C	.	.	H	α-helix	trans	-60.4	-39.4	176.3	176.8	87.4	0	0	0	111.7	S847 A848 A849 Y853 L854 F855 D856 M896 Q963 V966	S847-W851 WeakPolarHBondContact O-CB 3.22Å; S847-W851 PolarHBondContact O-N 3Å; A848-W851 PolarHBondContact O-N 3.11Å; A849-W851 VanDerWaalsContact C-N 3.31Å; A849-W851 PolarHBondContact O-N 3.18Å; W851-Y853 VanDerWaalsContact C-N 3.34Å; W851-Y853 PolarHBondContact O-N 2.87Å; W851-L854 PolarHBondContact O-N 3.42Å; W851-F855 AromaticContact CD1-CD2 3.75Å; W851-F855 HydrophobicContact CG-CB 4.41Å; W851-F855 HydrophobicContact CG-CD2 4.45Å; W851-F855 PolarHBondContact O-N 3.25Å; W851-D856 HydrophobicContact CE3-CB 4.24Å; W851-D856 HydrophobicContact CH2-CB 3.81Å; W851-D856 VanDerWaalsContact CH2-OD1 3.23Å; W851-D856 WeakPolarHBondContact CH2-OD1 3.5Å; W851-D856 HydrophobicContact CZ2-CB 4.47Å; W851-D856 HydrophobicContact CZ3-CB 3.69Å; W851-D856 PolarHBondContact O-N 3Å; W851-M896 HydrophobicContact CE3-CE 3.78Å; W851-M896 HydrophobicContact CZ3-CE 3.89Å; W851-Q963 HydrophobicContact CZ3-CG 4.34Å; W851-V966 HydrophobicContact CD2-CG1 3.93Å; W851-V966 HydrophobicContact CD2-CG2 4.38Å; W851-V966 HydrophobicContact CE3-CG1 4.05Å; W851-V966 HydrophobicContact CE3-CG2 4.46Å; W851-V966 HydrophobicContact CG-CG1 4.35Å; W851-V966 HydrophobicContact CH2-CB 4.47Å; W851-V966 HydrophobicContact CH2-CG2 3.7Å; W851-V966 HydrophobicContact CZ2-CG2 3.59Å; W851-V966 HydrophobicContact CZ3-CB 4.43Å; W851-V966 HydrophobicContact CZ3-CG1 4.44Å; W851-V966 HydrophobicContact CZ3-CG2 4.13Å
852	W	94.9	Very high	92.2	Very high	10 Å²	10	44.4 Å²	44.4	4%	0.038	23%	0.225	C	C	.	.	H	α-helix	trans	-60	-44.1	176.4	-175.2	80.7	0	0	0	112.2	A848 A849 T850 D856 P860 V887 S890 Y892 P893	A848-W852 PolarHBondContact O-N 3.08Å; A849-W852 WeakPolarHBondContact O-CB 3.41Å; A849-W852 PolarHBondContact O-N 3.01Å; T850-W852 VanDerWaalsContact C-N 3.29Å; T850-W852 PolarHBondContact O-N 3.12Å; W852-D856 HydrophobicContact CG-CB 4.37Å; W852-D856 PolarHBondContact NE1-OD2 3.38Å; W852-D856 WeakPolarHBondContact O-CB 3.29Å; W852-P860 HydrophobicContact CZ3-CG 4.24Å; W852-V887 HydrophobicContact CH2-CG2 3.79Å; W852-V887 HydrophobicContact CZ3-CG2 4.11Å; W852-S890 WeakPolarHBondContact CH2-OG 3.42Å; W852-Y892 AromaticContact CE2-CG 3.96Å; W852-Y892 AromaticContact CZ2-CD2 3.99Å; W852-Y892 HydrophobicContact CZ2-CD2 3.99Å; W852-Y892 AromaticContact CZ2-CG 3.99Å; W852-Y892 HydrophobicContact CZ2-CG 3.99Å; W852-Y892 AromaticContact NE1-CG 3.83Å; W852-P893 HydrophobicContact CB-CB 4.49Å; W852-P893 HydrophobicContact CE3-CB 4.07Å; W852-P893 HydrophobicContact CE3-CG 3.9Å; W852-P893 HydrophobicContact CZ3-CG 4.19Å
853	Y	92.4	Very high	92	Very high	8 Å²	8	47 Å²	47	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-36.6	178.3	-74.3	-70.6	0	0	0	113.9	P781 A849 T850 W851 P860 Q861 V862 L867 F888 P893	P781-Y853 HydrophobicContact CB-CE2 4.48Å; P781-Y853 HydrophobicContact CG-CE2 4.21Å; A849-Y853 WeakPolarHBondContact O-CD2 3.38Å; T850-Y853 PolarHBondContact O-N 3.31Å; W851-Y853 VanDerWaalsContact C-N 3.34Å; W851-Y853 PolarHBondContact O-N 2.87Å; Y853-P860 HydrophobicContact CD1-CG 3.93Å; Y853-Q861 CarbonylContact O-C 3.52Å; Y853-Q861 VanDerWaalsContact O-CA 3.24Å; Y853-Q861 WeakPolarHBondContact O-CA 3.33Å; Y853-Q861 PolarHBondContact O-N 3.31Å; Y853-Q861 VanDerWaalsContact O-N 3.09Å; Y853-V862 PolarHBondContact O-N 3.46Å; Y853-L867 HydrophobicContact CD1-CD1 3.9Å; Y853-L867 HydrophobicContact CD2-CD1 3.62Å; Y853-L867 HydrophobicContact CD2-CD2 4.1Å; Y853-L867 HydrophobicContact CE1-CD1 4.24Å; Y853-L867 HydrophobicContact CE2-CD1 3.96Å; Y853-L867 HydrophobicContact CG-CD1 3.58Å; Y853-L867 HydrophobicContact CG-CD2 4.22Å; Y853-F888 HydrophobicContact CD1-CD1 4.34Å; Y853-F888 HydrophobicContact CD1-CE1 4.33Å; Y853-F888 AromaticContact CE1-CD1 3.75Å; Y853-F888 HydrophobicContact CE1-CD1 3.75Å; Y853-F888 HydrophobicContact CE1-CE1 4.19Å; Y853-F888 PolarHBondContact OH-O 3.46Å; Y853-P893 HydrophobicContact CD2-CB 4.2Å; Y853-P893 HydrophobicContact CE2-CB 3.57Å; Y853-P893 HydrophobicContact CE2-CG 3.7Å; Y853-P893 WeakPolarHBondContact OH-CG 3.47Å
854	L	92.9	Very high	91.7	Very high	32 Å²	32	47.1 Å²	47.1	17%	0.168	24%	0.24	C	C	.	.	H	α-helix	trans	-93	-39	-170	-70.9	166.2	0	0	0	113.8	T850 W851 V862 F864	T850-L854 HydrophobicContact CG2-CD1 3.34Å; T850-L854 HydrophobicContact CG2-CG 4.12Å; T850-L854 WeakPolarHBondContact O-CB 3.29Å; T850-L854 WeakPolarHBondContact O-CG 3.28Å; T850-L854 PolarHBondContact O-N 2.97Å; T850-L854 VanDerWaalsContact O-N 3.09Å; W851-L854 PolarHBondContact O-N 3.42Å; L854-V862 WeakPolarHBondContact CD2-O 3.38Å; L854-F864 HydrophobicContact CD1-CD2 4.38Å; L854-F864 HydrophobicContact CD2-CB 4.05Å; L854-F864 VanDerWaalsContact CD2-N 3.34Å
855	F	92.7	Very high	91.3	Very high	138 Å²	138	53.8 Å²	53.8	61%	0.605	26%	0.264	S	S	*	.	H	α-helix	trans	-134.9	-9.5	-159.1	-57.5	-61.6	0	0	0	114.7	W851	W851-F855 AromaticContact CD1-CD2 3.75Å; W851-F855 HydrophobicContact CG-CB 4.41Å; W851-F855 HydrophobicContact CG-CD2 4.45Å; W851-F855 PolarHBondContact O-N 3.25Å
856	D	91.6	Very high	90.8	Very high	4 Å²	4	55.9 Å²	55.9	2%	0.021	27%	0.274	C	S	.	.			trans	-71.7	142.3	177.3	-167.7	32.1	0	0	0	111.1	W851 W852 E858 G859 Q861 Q963	W851-D856 HydrophobicContact CE3-CB 4.24Å; W851-D856 HydrophobicContact CH2-CB 3.81Å; W851-D856 VanDerWaalsContact CH2-OD1 3.23Å; W851-D856 WeakPolarHBondContact CH2-OD1 3.5Å; W851-D856 HydrophobicContact CZ2-CB 4.47Å; W851-D856 HydrophobicContact CZ3-CB 3.69Å; W851-D856 PolarHBondContact O-N 3Å; W852-D856 HydrophobicContact CG-CB 4.37Å; W852-D856 PolarHBondContact NE1-OD2 3.38Å; W852-D856 WeakPolarHBondContact O-CB 3.29Å; D856-E858 VanDerWaalsContact C-N 3.29Å; D856-E858 PolarHBondContact O-N 3.35Å; D856-G859 PolarHBondContact O-N 2.98Å; D856-Q861 PolarHBondContact O-NE2 3.48Å; D856-Q963 PolarHBondContact OD2-NE2 2.91Å
857	E	86.6	Confident	90.4	Very high	179 Å²	179	55.5 Å²	55.5	84%	0.836	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-29.4	-179.4	-68.2	-176.6	177.4	0	0	111.5
858	E	84.4	Confident	90	Very high	122 Å²	122	58.6 Å²	58.6	57%	0.57	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-3.1	175.7	-62	-179.4	165.9	0	0	112.7	D856 Q963	D856-E858 VanDerWaalsContact C-N 3.29Å; D856-E858 PolarHBondContact O-N 3.35Å; E858-Q963 PolarHBondContact OE2-NE2 2.67Å
859	G	86.1	Confident	89.4	Confident	14 Å²	14	60.3 Å²	60.3	14%	0.144	28%	0.282	C	S	.	.	S	Bend	trans	-92.2	173.6	-179.7	0	0	0	0	0	113.8	D856 Q861	D856-G859 PolarHBondContact O-N 2.98Å; G859-Q861 VanDerWaalsContact C-N 3.29Å; G859-Q861 PolarHBondContact O-N 2.68Å
860	P	86.9	Confident	88.9	Confident	41 Å²	41	61.5 Å²	61.5	27%	0.266	29%	0.285	S	S	.	.			trans	-76.6	-7.6	-175.2	31	-36.9	0	0	0	115.2	W852 Y853 V862 V887	W852-P860 HydrophobicContact CZ3-CG 4.24Å; Y853-P860 HydrophobicContact CD1-CG 3.93Å; P860-V862 VanDerWaalsContact C-N 3.25Å; P860-V862 HydrophobicContact CB-CG1 3.95Å; P860-V862 HydrophobicContact CG-CG1 4.15Å; P860-V862 PolarHBondContact O-N 2.92Å; P860-V887 HydrophobicContact CB-CG1 4.23Å; P860-V887 HydrophobicContact CB-CG2 3.88Å; P860-V887 HydrophobicContact CG-CG1 4.22Å; P860-V887 HydrophobicContact CG-CG2 3.7Å
861	Q	89.4	Confident	87.9	Confident	121 Å²	121	63.1 Å²	63.1	57%	0.565	29%	0.293	S	S	*	.			trans	51	41.3	178.7	-60.3	-180	5.8	0	0	113.9	Y853 D856 G859	Y853-Q861 CarbonylContact O-C 3.52Å; Y853-Q861 VanDerWaalsContact O-CA 3.24Å; Y853-Q861 WeakPolarHBondContact O-CA 3.33Å; Y853-Q861 PolarHBondContact O-N 3.31Å; Y853-Q861 VanDerWaalsContact O-N 3.09Å; D856-Q861 PolarHBondContact O-NE2 3.48Å; G859-Q861 VanDerWaalsContact C-N 3.29Å; G859-Q861 PolarHBondContact O-N 2.68Å
862	V	89.4	Confident	86.9	Confident	5 Å²	5	63.7 Å²	63.7	3%	0.03	30%	0.298	C	S	.	.			trans	-74.3	155	178.6	-59.7	0	0	0	0	111	Y853 L854 P860 Q866 L867 I883 F888	Y853-V862 PolarHBondContact O-N 3.46Å; L854-V862 WeakPolarHBondContact CD2-O 3.38Å; P860-V862 VanDerWaalsContact C-N 3.25Å; P860-V862 HydrophobicContact CB-CG1 3.95Å; P860-V862 HydrophobicContact CG-CG1 4.15Å; P860-V862 PolarHBondContact O-N 2.92Å; V862-Q866 HydrophobicContact CB-CB 4.33Å; V862-L867 HydrophobicContact CG2-CB 4.2Å; V862-I883 HydrophobicContact CG1-CD1 3.68Å; V862-I883 HydrophobicContact CG1-CG1 4.38Å; V862-I883 HydrophobicContact CG1-CG2 4.43Å; V862-F888 HydrophobicContact CG1-CZ 4.46Å
863	S	89.6	Confident	86	Confident	54 Å²	54	64.1 Å²	64.1	38%	0.378	30%	0.302	S	S	.	.			trans	-72.2	153	171.6	68.6	0	0	0	0	111.7	Y865 Q866 L867	S863-Y865 PolarHBondContact O-N 3.06Å; S863-Y865 VanDerWaalsContact O-N 3.16Å; S863-Q866 WeakPolarHBondContact O-CB 3.49Å; S863-Q866 PolarHBondContact O-N 3.14Å; S863-Q866 VanDerWaalsContact OG-CD 3.32Å; S863-Q866 WeakPolarHBondContact OG-CG 3.4Å; S863-Q866 PolarHBondContact OG-N 3.33Å; S863-Q866 PolarHBondContact OG-OE1 3.25Å; S863-L867 PolarHBondContact O-N 2.94Å
864	F	89.2	Confident	85.1	Confident	99 Å²	99	67.6 Å²	67.6	43%	0.434	32%	0.324	S	S	.	.	H	α-helix	trans	-58.4	-31.6	177	-175	-103.9	0	0	0	112.7	L780 T850 L854 L867 R868	L780-F864 HydrophobicContact CD2-CE2 4.11Å; T850-F864 HydrophobicContact CG2-CD2 4.13Å; T850-F864 HydrophobicContact CG2-CE2 4.2Å; L854-F864 HydrophobicContact CD1-CD2 4.38Å; L854-F864 HydrophobicContact CD2-CB 4.05Å; L854-F864 VanDerWaalsContact CD2-N 3.34Å; F864-L867 PolarHBondContact O-N 3.46Å; F864-R868 PolarHBondContact O-N 3.44Å; F864-R868 VanDerWaalsContact O-N 3.1Å
865	Y	86.4	Confident	83.7	Confident	146 Å²	146	75.7 Å²	75.7	57%	0.573	36%	0.361	S	S	*	.	H	α-helix	trans	-67	-42.8	175.9	-174	-91.9	0	0	0	112	S863 H869 M879	S863-Y865 PolarHBondContact O-N 3.06Å; S863-Y865 VanDerWaalsContact O-N 3.16Å; Y865-H869 AromaticContact CE1-ND1 3.97Å; Y865-H869 AromaticContact CE2-CE1 3.6Å; Y865-H869 AromaticContact CZ-CE1 3.6Å; Y865-H869 AromaticContact CZ-ND1 3.95Å; Y865-H869 PolarHBondContact O-N 3.22Å; Y865-H869 PolarHBondContact O-ND1 3.4Å; Y865-M879 HydrophobicContact CD1-SD 4.15Å; Y865-M879 HydrophobicContact CE1-CE 3.84Å; Y865-M879 HydrophobicContact CE1-SD 3.91Å
866	Q	85.7	Confident	82.5	Confident	44 Å²	44	76.5 Å²	76.5	21%	0.206	37%	0.372	C	S	.	.	H	α-helix	trans	-63	-44	173.6	-77	162.6	-41.8	0	0	111	V862 S863 R868 H869 F870 M879 F880	V862-Q866 HydrophobicContact CB-CB 4.33Å; S863-Q866 WeakPolarHBondContact O-CB 3.49Å; S863-Q866 PolarHBondContact O-N 3.14Å; S863-Q866 VanDerWaalsContact OG-CD 3.32Å; S863-Q866 WeakPolarHBondContact OG-CG 3.4Å; S863-Q866 PolarHBondContact OG-N 3.33Å; S863-Q866 PolarHBondContact OG-OE1 3.25Å; Q866-R868 VanDerWaalsContact C-N 3.35Å; Q866-R868 PolarHBondContact O-N 3.49Å; Q866-H869 CarbonylContact O-C 3.5Å; Q866-H869 PolarHBondContact O-N 3.33Å; Q866-F870 PolarHBondContact O-N 3.23Å; Q866-F870 VanDerWaalsContact O-N 3.15Å; Q866-M879 HydrophobicContact CG-CG 3.97Å; Q866-M879 PolarHBondContact NE2-O 3.04Å; Q866-F880 HydrophobicContact CB-CE1 3.83Å; Q866-F880 HydrophobicContact CB-CZ 4.36Å; Q866-F880 HydrophobicContact CG-CE1 4.28Å; Q866-F880 WeakPolarHBondContact O-CE1 3.42Å; Q866-F880 VanDerWaalsContact O-CZ 3.31Å; Q866-F880 WeakPolarHBondContact O-CZ 3.46Å
867	L	87.1	Confident	81.8	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-60.3	-40.9	179.8	-177.1	61.3	0	0	0	113	L780 P781 T850 Y853 V862 S863 F864 H869 F870 F888	L780-L867 HydrophobicContact CD2-CD2 3.87Å; L780-L867 HydrophobicContact CD2-CG 3.8Å; P781-L867 HydrophobicContact CG-CD1 3.85Å; T850-L867 HydrophobicContact CG2-CD2 3.59Å; Y853-L867 HydrophobicContact CD1-CD1 3.9Å; Y853-L867 HydrophobicContact CD2-CD1 3.62Å; Y853-L867 HydrophobicContact CD2-CD2 4.1Å; Y853-L867 HydrophobicContact CE1-CD1 4.24Å; Y853-L867 HydrophobicContact CE2-CD1 3.96Å; Y853-L867 HydrophobicContact CG-CD1 3.58Å; Y853-L867 HydrophobicContact CG-CD2 4.22Å; V862-L867 HydrophobicContact CG2-CB 4.2Å; S863-L867 PolarHBondContact O-N 2.94Å; F864-L867 PolarHBondContact O-N 3.46Å; L867-H869 PolarHBondContact O-N 2.96Å; L867-F870 WeakPolarHBondContact O-CB 3.28Å; L867-F870 WeakPolarHBondContact O-CD1 3.29Å; L867-F870 PolarHBondContact O-N 3.17Å; L867-F888 HydrophobicContact CD1-CD1 4.14Å; L867-F888 HydrophobicContact CD1-CE1 3.83Å
868	R	85.8	Confident	81.3	Confident	129 Å²	129	74.7 Å²	74.7	49%	0.487	37%	0.374	S	S	.	.	H	α-helix	trans	-67.6	-20.2	176	170.7	168.5	172.4	-156.2	-5.7	113.7	L778 G779 F864 Q866	L778-R868 VanDerWaalsContact O-CD 3.25Å; L778-R868 WeakPolarHBondContact O-CD 3.42Å; L778-R868 WeakPolarHBondContact O-CG 3.34Å; G779-R868 CarbonylContact O-C 3.34Å; G779-R868 WeakPolarHBondContact O-CA 3.29Å; F864-R868 PolarHBondContact O-N 3.44Å; F864-R868 VanDerWaalsContact O-N 3.1Å; Q866-R868 VanDerWaalsContact C-N 3.35Å; Q866-R868 PolarHBondContact O-N 3.49Å
869	H	83.9	Confident	81	Confident	36 Å²	36	71.2 Å²	71.2	17%	0.167	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	23.1	179	-61.9	84.8	0	0	0	111.5	Y865 Q866 L867 M871 Q872 M879 F880	Y865-H869 AromaticContact CE1-ND1 3.97Å; Y865-H869 AromaticContact CE2-CE1 3.6Å; Y865-H869 AromaticContact CZ-CE1 3.6Å; Y865-H869 AromaticContact CZ-ND1 3.95Å; Y865-H869 PolarHBondContact O-N 3.22Å; Y865-H869 PolarHBondContact O-ND1 3.4Å; Q866-H869 CarbonylContact O-C 3.5Å; Q866-H869 PolarHBondContact O-N 3.33Å; L867-H869 PolarHBondContact O-N 2.96Å; H869-M871 PolarHBondContact O-N 3.42Å; H869-M871 VanDerWaalsContact O-N 3.1Å; H869-Q872 WeakPolarHBondContact O-CB 3.36Å; H869-Q872 PolarHBondContact O-N 3.33Å; H869-M879 HydrophobicContact CB-SD 4.03Å; H869-F880 HydrophobicContact CB-CZ 4.46Å; H869-F880 VanDerWaalsContact O-CZ 3.28Å; H869-F880 WeakPolarHBondContact O-CZ 3.23Å
870	F	82	Confident	80.8	Confident	31 Å²	31	70.9 Å²	70.9	14%	0.136	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-53	-35.3	-176.9	76.5	-81.2	0	0	0	113	G779 L780 P781 Q866 L867 Q872 C873 F888	G779-F870 WeakPolarHBondContact O-CE1 3.12Å; L780-F870 VanDerWaalsContact C-CE1 3.47Å; P781-F870 HydrophobicContact CB-CE2 4.39Å; P781-F870 HydrophobicContact CB-CZ 4.36Å; P781-F870 HydrophobicContact CG-CB 4.33Å; P781-F870 HydrophobicContact CG-CD1 3.83Å; P781-F870 HydrophobicContact CG-CD2 3.97Å; P781-F870 HydrophobicContact CG-CE1 4.07Å; P781-F870 HydrophobicContact CG-CE2 4.2Å; P781-F870 HydrophobicContact CG-CG 3.77Å; P781-F870 HydrophobicContact CG-CZ 4.24Å; Q866-F870 PolarHBondContact O-N 3.23Å; Q866-F870 VanDerWaalsContact O-N 3.15Å; L867-F870 WeakPolarHBondContact O-CB 3.28Å; L867-F870 WeakPolarHBondContact O-CD1 3.29Å; L867-F870 PolarHBondContact O-N 3.17Å; F870-Q872 PolarHBondContact O-N 3.43Å; F870-Q872 VanDerWaalsContact O-N 3.1Å; F870-C873 WeakPolarHBondContact O-CB 3.47Å; F870-C873 PolarHBondContact O-N 2.8Å; F870-F888 HydrophobicContact CB-CB 4.36Å; F870-F888 HydrophobicContact CB-CD1 3.51Å; F870-F888 HydrophobicContact CB-CD2 4.11Å; F870-F888 HydrophobicContact CB-CE1 3.72Å; F870-F888 HydrophobicContact CB-CE2 4.29Å; F870-F888 HydrophobicContact CB-CG 3.73Å; F870-F888 HydrophobicContact CB-CZ 4.11Å; F870-F888 HydrophobicContact CD2-CB 4.07Å; F870-F888 HydrophobicContact CD2-CG 4.36Å; F870-F888 HydrophobicContact CG-CD1 4.36Å; F870-F888 HydrophobicContact CG-CG 4.49Å
871	M	72.4	Confident	80.1	Confident	52 Å²	52	76.5 Å²	76.5	26%	0.256	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-60.1	-16.9	175.6	-85.8	-162.9	-67.3	0	0	114.8	V283 Y294 H869	V283-M871 HydrophobicContact CB-CB 4.44Å; V283-M871 HydrophobicContact CG1-CB 3.5Å; V283-M871 HydrophobicContact CG1-CG 3.9Å; V283-M871 HydrophobicContact CG1-SD 3.75Å; V283-M871 HydrophobicContact CG2-CB 4.09Å; V283-M871 WeakPolarHBondContact CG2-O 3.34Å; Y294-M871 HydrophobicContact CE1-SD 4.4Å; H869-M871 PolarHBondContact O-N 3.42Å; H869-M871 VanDerWaalsContact O-N 3.1Å
872	Q	75.9	Confident	79.6	Confident	71 Å²	71	78.4 Å²	78.4	33%	0.332	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-94.5	5.7	175.7	-57.1	179.1	-2.9	0	0	112.5	V283 H869 F870 T874 N877 F880	V283-Q872 HydrophobicContact CG2-CG 3.94Å; H869-Q872 WeakPolarHBondContact O-CB 3.36Å; H869-Q872 PolarHBondContact O-N 3.33Å; F870-Q872 PolarHBondContact O-N 3.43Å; F870-Q872 VanDerWaalsContact O-N 3.1Å; Q872-T874 PolarHBondContact O-N 3.01Å; Q872-T874 VanDerWaalsContact O-N 3.13Å; Q872-N877 PolarHBondContact O-ND2 3.48Å; Q872-F880 HydrophobicContact CB-CE2 4.38Å
873	C	75.6	Confident	79.2	Confident	20 Å²	20	80 Å²	80	14%	0.135	40%	0.395	C	S	.	.			trans	-68.1	109.5	178.6	-164.3	0	0	0	0	109.7	F870 F880 C885 F888	F870-C873 WeakPolarHBondContact O-CB 3.47Å; F870-C873 PolarHBondContact O-N 2.8Å; C873-F880 HydrophobicContact CB-CD1 4.34Å; C873-F880 HydrophobicContact CB-CD2 4.05Å; C873-F880 HydrophobicContact CB-CE2 4.27Å; C873-F880 HydrophobicContact CB-CG 4.08Å; C873-C885 HydrophobicContact CB-CB 3.86Å; C873-C885 WeakPolarHBondContact CB-SG 3.15Å; C873-C885 PolarHBondContact O-SG 3.46Å; C873-C885 WeakPolarHBondContact SG-CA 3.48Å; C873-C885 WeakPolarHBondContact SG-CB 3.25Å; C873-C885 CovalentContact SG-SG 2.04Å; C873-C885 PolarHBondContact SG-SG 3.28Å; C873-F888 HydrophobicContact CB-CD2 4.33Å; C873-F888 HydrophobicContact CB-CE2 4.25Å
874	T	73.6	Confident	78.8	Confident	80 Å²	80	82.4 Å²	82.4	49%	0.491	40%	0.404	S	S	.	.			trans	-138.6	155.3	170.8	59.2	0	0	0	0	108.1	Q872 D876 N877	Q872-T874 PolarHBondContact O-N 3.01Å; Q872-T874 VanDerWaalsContact O-N 3.13Å; T874-D876 PolarHBondContact O-N 3.48Å; T874-N877 PolarHBondContact O-N 2.81Å
875	E	64.4	Low	78.4	Confident	202 Å²	202	79.6 Å²	79.6	94%	0.944	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-27.5	179.4	-65.6	-172.1	163.5	0	0	112.9
876	D	67.1	Low	78.1	Confident	155 Å²	155	79.4 Å²	79.4	83%	0.829	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-8.1	-178.7	-65.1	-44	0	0	0	114.3	T874 P878	T874-D876 PolarHBondContact O-N 3.48Å; D876-P878 WeakPolarHBondContact O-CD 3.33Å
877	N	76.1	Confident	78.1	Confident	33 Å²	33	78.8 Å²	78.8	18%	0.176	40%	0.4	C	S	.	.			trans	-84.7	116	-176	-168.8	-22.5	0	0	0	111.4	Q872 T874 M879 F880	Q872-N877 PolarHBondContact O-ND2 3.48Å; T874-N877 PolarHBondContact O-N 2.81Å; N877-M879 PolarHBondContact O-N 2.92Å; N877-M879 VanDerWaalsContact OD1-CB 3.28Å; N877-M879 WeakPolarHBondContact OD1-CB 3.37Å; N877-M879 PolarHBondContact OD1-N 3.33Å; N877-F880 HydrophobicContact CB-CD2 4.42Å; N877-F880 PolarHBondContact O-N 2.86Å; N877-F880 VanDerWaalsContact O-N 3.15Å
878	P	77.1	Confident	78	Confident	112 Å²	112	79.6 Å²	79.6	73%	0.727	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-63.1	-16.1	-178.4	26.1	-35	0	0	0	114	D876 F880	D876-P878 WeakPolarHBondContact O-CD 3.33Å; P878-F880 VanDerWaalsContact C-N 3.33Å
879	M	76.9	Confident	77.6	Confident	50 Å²	50	81.5 Å²	81.5	25%	0.246	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-69.6	-27.6	177.7	-169.4	-177	-51.6	0	0	113.4	Y865 Q866 H869 N877	Y865-M879 HydrophobicContact CD1-SD 4.15Å; Y865-M879 HydrophobicContact CE1-CE 3.84Å; Y865-M879 HydrophobicContact CE1-SD 3.91Å; Q866-M879 HydrophobicContact CG-CG 3.97Å; Q866-M879 PolarHBondContact NE2-O 3.04Å; H869-M879 HydrophobicContact CB-SD 4.03Å; N877-M879 PolarHBondContact O-N 2.92Å; N877-M879 VanDerWaalsContact OD1-CB 3.28Å; N877-M879 WeakPolarHBondContact OD1-CB 3.37Å; N877-M879 PolarHBondContact OD1-N 3.33Å
880	F	82.4	Confident	77.8	Confident	7 Å²	7	81 Å²	81	3%	0.031	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-114.5	22.8	-175.9	-62.8	-81.3	0	0	0	112.5	Q866 H869 Q872 C873 N877 P878 D882 I883 F888	Q866-F880 HydrophobicContact CB-CE1 3.83Å; Q866-F880 HydrophobicContact CB-CZ 4.36Å; Q866-F880 HydrophobicContact CG-CE1 4.28Å; Q866-F880 WeakPolarHBondContact O-CE1 3.42Å; Q866-F880 VanDerWaalsContact O-CZ 3.31Å; Q866-F880 WeakPolarHBondContact O-CZ 3.46Å; H869-F880 HydrophobicContact CB-CZ 4.46Å; H869-F880 VanDerWaalsContact O-CZ 3.28Å; H869-F880 WeakPolarHBondContact O-CZ 3.23Å; Q872-F880 HydrophobicContact CB-CE2 4.38Å; C873-F880 HydrophobicContact CB-CD1 4.34Å; C873-F880 HydrophobicContact CB-CD2 4.05Å; C873-F880 HydrophobicContact CB-CE2 4.27Å; C873-F880 HydrophobicContact CB-CG 4.08Å; N877-F880 HydrophobicContact CB-CD2 4.42Å; N877-F880 PolarHBondContact O-N 2.86Å; N877-F880 VanDerWaalsContact O-N 3.15Å; P878-F880 VanDerWaalsContact C-N 3.33Å; F880-D882 PolarHBondContact O-N 3.35Å; F880-I883 HydrophobicContact CD1-CD1 4.26Å; F880-I883 PolarHBondContact O-N 3.29Å; F880-F888 HydrophobicContact CD1-CE2 4.02Å; F880-F888 HydrophobicContact CD1-CZ 4.17Å; F880-F888 AromaticContact CE1-CE2 3.9Å; F880-F888 HydrophobicContact CE1-CE2 3.9Å; F880-F888 AromaticContact CE1-CZ 3.76Å; F880-F888 HydrophobicContact CE1-CZ 3.76Å
881	K	72.1	Confident	78.2	Confident	158 Å²	158	83.4 Å²	83.4	69%	0.687	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	127.4	176.9	-167	176.9	-179.7	-179.3	0	109.7	I883	K881-I883 VanDerWaalsContact C-N 3.35Å
882	D	78.7	Confident	79.2	Confident	161 Å²	161	84.6 Å²	84.6	86%	0.861	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	14.5	-176.5	-45.8	-49.8	0	0	0	115.7	F880	F880-D882 PolarHBondContact O-N 3.35Å
883	I	80.8	Confident	79.9	Confident	39 Å²	39	81.4 Å²	81.4	20%	0.2	41%	0.414	C	S	.	.			trans	-115.8	128.8	172.7	-61.4	162.8	0	0	0	109.1	V862 F880 K881 V887 F888	V862-I883 HydrophobicContact CG1-CD1 3.68Å; V862-I883 HydrophobicContact CG1-CG1 4.38Å; V862-I883 HydrophobicContact CG1-CG2 4.43Å; F880-I883 HydrophobicContact CD1-CD1 4.26Å; F880-I883 PolarHBondContact O-N 3.29Å; K881-I883 VanDerWaalsContact C-N 3.35Å; I883-V887 HydrophobicContact CG2-CG1 4.01Å; I883-F888 HydrophobicContact CG2-CE2 4.35Å
884	D	82.1	Confident	80.7	Confident	104 Å²	104	81.2 Å²	81.2	56%	0.556	41%	0.412	S	S	*	.			trans	-76.3	126.6	171.2	-168	-12.2	0	0	0	110.2	E886 V887	D884-E886 PolarHBondContact O-N 3.06Å; D884-E886 PolarHBondContact OD1-N 3.2Å; D884-V887 WeakPolarHBondContact O-CB 3.46Å; D884-V887 WeakPolarHBondContact O-CG1 3.02Å; D884-V887 PolarHBondContact O-N 3.06Å
885	C	80.9	Confident	81.8	Confident	40 Å²	40	77.4 Å²	77.4	27%	0.27	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-68.1	-22.3	-177.1	-62	0	0	0	0	112.7	C873 V887 F888	C873-C885 HydrophobicContact CB-CB 3.86Å; C873-C885 WeakPolarHBondContact CB-SG 3.15Å; C873-C885 PolarHBondContact O-SG 3.46Å; C873-C885 WeakPolarHBondContact SG-CA 3.48Å; C873-C885 WeakPolarHBondContact SG-CB 3.25Å; C873-C885 CovalentContact SG-SG 2.04Å; C873-C885 PolarHBondContact SG-SG 3.28Å; C885-V887 PolarHBondContact O-N 3.38Å; C885-V887 VanDerWaalsContact O-N 3.1Å; C885-F888 PolarHBondContact O-N 3.08Å
886	E	80.4	Confident	83.3	Confident	143 Å²	143	67.8 Å²	67.8	67%	0.668	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-59.2	-21.8	173.9	-68.3	-172.5	-179.7	0	0	112.4	D884 F888 E889 S890	D884-E886 PolarHBondContact O-N 3.06Å; D884-E886 PolarHBondContact OD1-N 3.2Å; E886-F888 PolarHBondContact O-N 3.42Å; E886-E889 PolarHBondContact O-N 2.9Å; E886-S890 PolarHBondContact O-N 3.33Å
887	V	84.8	Confident	84.7	Confident	31 Å²	31	60.4 Å²	60.4	19%	0.188	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-64	-25.2	179.5	83	0	0	0	0	113.4	W852 P860 I883 D884 C885 E889 S890	W852-V887 HydrophobicContact CH2-CG2 3.79Å; W852-V887 HydrophobicContact CZ3-CG2 4.11Å; P860-V887 HydrophobicContact CB-CG1 4.23Å; P860-V887 HydrophobicContact CB-CG2 3.88Å; P860-V887 HydrophobicContact CG-CG1 4.22Å; P860-V887 HydrophobicContact CG-CG2 3.7Å; I883-V887 HydrophobicContact CG2-CG1 4.01Å; D884-V887 WeakPolarHBondContact O-CB 3.46Å; D884-V887 WeakPolarHBondContact O-CG1 3.02Å; D884-V887 PolarHBondContact O-N 3.06Å; C885-V887 PolarHBondContact O-N 3.38Å; C885-V887 VanDerWaalsContact O-N 3.1Å; V887-E889 VanDerWaalsContact C-N 3.26Å; V887-E889 PolarHBondContact O-N 3.36Å; V887-S890 WeakPolarHBondContact O-CB 3.36Å; V887-S890 PolarHBondContact O-N 3.33Å
888	F	84.4	Confident	85.6	Confident	17 Å²	17	59 Å²	59	8%	0.075	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-78	-13.3	176.9	-64.3	-69.2	0	0	0	112.9	P781 Y853 V862 L867 F870 C873 F880 I883 C885 E886	P781-F888 HydrophobicContact CG-CD1 4.21Å; Y853-F888 HydrophobicContact CD1-CD1 4.34Å; Y853-F888 HydrophobicContact CD1-CE1 4.33Å; Y853-F888 AromaticContact CE1-CD1 3.75Å; Y853-F888 HydrophobicContact CE1-CD1 3.75Å; Y853-F888 HydrophobicContact CE1-CE1 4.19Å; Y853-F888 PolarHBondContact OH-O 3.46Å; V862-F888 HydrophobicContact CG1-CZ 4.46Å; L867-F888 HydrophobicContact CD1-CD1 4.14Å; L867-F888 HydrophobicContact CD1-CE1 3.83Å; F870-F888 HydrophobicContact CB-CB 4.36Å; F870-F888 HydrophobicContact CB-CD1 3.51Å; F870-F888 HydrophobicContact CB-CD2 4.11Å; F870-F888 HydrophobicContact CB-CE1 3.72Å; F870-F888 HydrophobicContact CB-CE2 4.29Å; F870-F888 HydrophobicContact CB-CG 3.73Å; F870-F888 HydrophobicContact CB-CZ 4.11Å; F870-F888 HydrophobicContact CD2-CB 4.07Å; F870-F888 HydrophobicContact CD2-CG 4.36Å; F870-F888 HydrophobicContact CG-CD1 4.36Å; F870-F888 HydrophobicContact CG-CG 4.49Å; C873-F888 HydrophobicContact CB-CD2 4.33Å; C873-F888 HydrophobicContact CB-CE2 4.25Å; F880-F888 HydrophobicContact CD1-CE2 4.02Å; F880-F888 HydrophobicContact CD1-CZ 4.17Å; F880-F888 AromaticContact CE1-CE2 3.9Å; F880-F888 HydrophobicContact CE1-CE2 3.9Å; F880-F888 AromaticContact CE1-CZ 3.76Å; F880-F888 HydrophobicContact CE1-CZ 3.76Å; I883-F888 HydrophobicContact CG2-CE2 4.35Å; C885-F888 PolarHBondContact O-N 3.08Å; E886-F888 PolarHBondContact O-N 3.42Å
889	E	78.8	Confident	86.6	Confident	169 Å²	169	53.6 Å²	53.6	79%	0.79	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-100.3	7.2	172.8	-59.6	-177.8	172.8	0	0	112	E886 V887	E886-E889 PolarHBondContact O-N 2.9Å; V887-E889 VanDerWaalsContact C-N 3.26Å; V887-E889 PolarHBondContact O-N 3.36Å
890	S	88	Confident	87.6	Confident	27 Å²	27	51.2 Å²	51.2	19%	0.189	25%	0.25	C	S	.	.			trans	-60	143.9	178.3	176.9	0	0	0	0	113.1	W852 E886 V887 Y892 P893	W852-S890 WeakPolarHBondContact CH2-OG 3.42Å; E886-S890 PolarHBondContact O-N 3.33Å; V887-S890 WeakPolarHBondContact O-CB 3.36Å; V887-S890 PolarHBondContact O-N 3.33Å; S890-Y892 PolarHBondContact OG-N 3.4Å; S890-P893 VanDerWaalsContact O-CD 3.32Å; S890-P893 WeakPolarHBondContact O-CD 3.48Å; S890-P893 WeakPolarHBondContact O-CG 3.29Å
891	R	90.8	Very high	88.2	Confident	80 Å²	80	50.9 Å²	50.9	30%	0.302	25%	0.249	S	C	.	.	H	α-helix	trans	-81.8	-12	177.6	-61	177.9	-175.5	160.4	7.8	114.4	T894 T895 T957	R891-T894 PolarHBondContact O-OG1 2.87Å; R891-T895 WeakPolarHBondContact O-CB 3.35Å; R891-T895 PolarHBondContact O-N 3.3Å; R891-T895 VanDerWaalsContact O-N 3.09Å; R891-T895 PolarHBondContact O-OG1 3.32Å; R891-T957 HydrophobicContact CB-CG2 4.16Å
892	Y	91.9	Very high	89.4	Confident	78 Å²	78	43.4 Å²	43.4	31%	0.306	22%	0.216	S	C	.	.	H	α-helix	trans	-64	-50.8	178.5	-77	-83.2	0	0	0	114.2	W852 S890 T894 T895 M896 T957 L959	W852-Y892 AromaticContact CE2-CG 3.96Å; W852-Y892 AromaticContact CZ2-CD2 3.99Å; W852-Y892 HydrophobicContact CZ2-CD2 3.99Å; W852-Y892 AromaticContact CZ2-CG 3.99Å; W852-Y892 HydrophobicContact CZ2-CG 3.99Å; W852-Y892 AromaticContact NE1-CG 3.83Å; S890-Y892 PolarHBondContact OG-N 3.4Å; Y892-T894 VanDerWaalsContact C-N 3.35Å; Y892-T894 PolarHBondContact O-N 3.11Å; Y892-T895 PolarHBondContact O-N 2.99Å; Y892-T895 VanDerWaalsContact O-N 3.15Å; Y892-M896 WeakPolarHBondContact O-CG 3.32Å; Y892-M896 PolarHBondContact O-N 3.45Å; Y892-T957 HydrophobicContact CD1-CG2 3.5Å; Y892-T957 VanDerWaalsContact CD1-CG2 3.5Å; Y892-T957 HydrophobicContact CD2-CG2 3.84Å; Y892-T957 HydrophobicContact CE1-CG2 3.63Å; Y892-T957 HydrophobicContact CE2-CG2 3.98Å; Y892-T957 HydrophobicContact CG-CG2 3.6Å; Y892-L959 HydrophobicContact CD1-CD2 4.47Å
893	P	92.3	Very high	90.3	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-38.3	-178.2	22.8	-32.9	0	0	0	112.4	A849 W852 Y853 S890 T895 M896 A897	A849-P893 HydrophobicContact CB-CB 4.14Å; W852-P893 HydrophobicContact CB-CB 4.49Å; W852-P893 HydrophobicContact CE3-CB 4.07Å; W852-P893 HydrophobicContact CE3-CG 3.9Å; W852-P893 HydrophobicContact CZ3-CG 4.19Å; Y853-P893 HydrophobicContact CD2-CB 4.2Å; Y853-P893 HydrophobicContact CE2-CB 3.57Å; Y853-P893 HydrophobicContact CE2-CG 3.7Å; Y853-P893 WeakPolarHBondContact OH-CG 3.47Å; S890-P893 VanDerWaalsContact O-CD 3.32Å; S890-P893 WeakPolarHBondContact O-CD 3.48Å; S890-P893 WeakPolarHBondContact O-CG 3.29Å; P893-T895 VanDerWaalsContact C-N 3.33Å; P893-M896 PolarHBondContact O-N 3Å; P893-A897 PolarHBondContact O-N 3.28Å
894	T	91.8	Very high	91	Very high	16 Å²	16	34.3 Å²	34.3	10%	0.098	17%	0.169	C	C	.	.	H	α-helix	trans	-64	-39.6	173.7	55.6	0	0	0	0	111.3	A783 R891 Y892 A897 L898 Q955	A783-T894 WeakPolarHBondContact O-CA 3.47Å; R891-T894 PolarHBondContact O-OG1 2.87Å; Y892-T894 VanDerWaalsContact C-N 3.35Å; Y892-T894 PolarHBondContact O-N 3.11Å; T894-A897 PolarHBondContact O-N 3.31Å; T894-L898 WeakPolarHBondContact O-CB 3.38Å; T894-L898 PolarHBondContact O-N 3.46Å; T894-Q955 PolarHBondContact OG1-O 2.91Å; T894-Q955 VanDerWaalsContact OG1-O 3.12Å
895	T	95.8	Very high	91.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.1	-38.1	175.2	-53.2	0	0	0	0	112.9	R891 Y892 P893 L898 S899 L945 V956 T957 L959	R891-T895 WeakPolarHBondContact O-CB 3.35Å; R891-T895 PolarHBondContact O-N 3.3Å; R891-T895 VanDerWaalsContact O-N 3.09Å; R891-T895 PolarHBondContact O-OG1 3.32Å; Y892-T895 PolarHBondContact O-N 2.99Å; Y892-T895 VanDerWaalsContact O-N 3.15Å; P893-T895 VanDerWaalsContact C-N 3.33Å; T895-L898 PolarHBondContact O-N 2.85Å; T895-S899 VanDerWaalsContact O-CB 3.25Å; T895-S899 WeakPolarHBondContact O-CB 3.26Å; T895-S899 PolarHBondContact O-N 3.18Å; T895-S899 PolarHBondContact O-OG 3.09Å; T895-L945 HydrophobicContact CG2-CD2 3.49Å; T895-L945 VanDerWaalsContact CG2-CD2 3.49Å; T895-V956 HydrophobicContact CG2-CB 4.38Å; T895-V956 VanDerWaalsContact OG1-CA 3.24Å; T895-V956 WeakPolarHBondContact OG1-CA 3.34Å; T895-V956 WeakPolarHBondContact OG1-CB 3.44Å; T895-T957 VanDerWaalsContact CG2-O 3.31Å; T895-T957 WeakPolarHBondContact CG2-O 3.48Å; T895-T957 PolarHBondContact OG1-N 3.14Å; T895-L959 HydrophobicContact CG2-CD1 4.05Å; T895-L959 HydrophobicContact CG2-CD2 3.83Å; T895-L959 HydrophobicContact CG2-CG 3.74Å
896	M	96.3	Very high	92.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.1	-46.5	175.6	-76.5	-66.1	-71.4	0	0	111.3	A848 W851 Y892 P893 S899 V900 L959 Q963 V966 V967	A848-M896 HydrophobicContact CB-CB 4.4Å; W851-M896 HydrophobicContact CE3-CE 3.78Å; W851-M896 HydrophobicContact CZ3-CE 3.89Å; Y892-M896 WeakPolarHBondContact O-CG 3.32Å; Y892-M896 PolarHBondContact O-N 3.45Å; P893-M896 PolarHBondContact O-N 3Å; M896-S899 PolarHBondContact O-N 2.87Å; M896-V900 WeakPolarHBondContact O-CG2 3.41Å; M896-V900 PolarHBondContact O-N 3.22Å; M896-L959 HydrophobicContact CG-CD2 4.07Å; M896-L959 HydrophobicContact SD-CD1 3.82Å; M896-L959 HydrophobicContact SD-CD2 3.82Å; M896-L959 HydrophobicContact SD-CG 4.45Å; M896-Q963 HydrophobicContact CE-CB 4.36Å; M896-Q963 HydrophobicContact SD-CB 3.72Å; M896-Q963 HydrophobicContact SD-CG 4.1Å; M896-V966 HydrophobicContact CE-CB 4.21Å; M896-V966 HydrophobicContact CE-CG1 4.09Å; M896-V967 HydrophobicContact CE-CG2 4.07Å; M896-V967 HydrophobicContact SD-CG2 4.02Å
897	A	95.9	Very high	93.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.9	-48.7	174.7	0	0	0	0	0	111.8	A783 L784 A849 P893 T894 S899 V900 L901	A783-A897 HydrophobicContact CB-CB 4.08Å; A783-A897 WeakPolarHBondContact O-CB 3.29Å; L784-A897 HydrophobicContact CD2-CB 4.04Å; L784-A897 HydrophobicContact CG-CB 4.23Å; A849-A897 HydrophobicContact CB-CB 4.21Å; P893-A897 PolarHBondContact O-N 3.28Å; T894-A897 PolarHBondContact O-N 3.31Å; A897-S899 PolarHBondContact O-N 2.89Å; A897-V900 PolarHBondContact O-N 3.45Å; A897-L901 PolarHBondContact O-N 2.95Å
898	L	96.4	Very high	93.5	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-60.5	-44.2	179	-177.1	64	0	0	0	111.7	L784 Q788 V792 T894 T895 V900 L901 V902 I944 V956	L784-L898 HydrophobicContact CD2-CB 3.93Å; L784-L898 HydrophobicContact CD2-CD1 4.21Å; Q788-L898 HydrophobicContact CB-CD1 4.14Å; Q788-L898 HydrophobicContact CG-CD2 4.27Å; V792-L898 HydrophobicContact CG2-CD1 3.57Å; T894-L898 WeakPolarHBondContact O-CB 3.38Å; T894-L898 PolarHBondContact O-N 3.46Å; T895-L898 PolarHBondContact O-N 2.85Å; L898-V900 VanDerWaalsContact C-N 3.33Å; L898-V900 PolarHBondContact O-N 3.44Å; L898-L901 WeakPolarHBondContact O-CB 3.42Å; L898-L901 PolarHBondContact O-N 2.86Å; L898-V902 HydrophobicContact CD1-CG2 4.36Å; L898-V902 HydrophobicContact CG-CG2 4.48Å; L898-V902 VanDerWaalsContact O-CG2 3.31Å; L898-V902 WeakPolarHBondContact O-CG2 3.47Å; L898-V902 PolarHBondContact O-N 3.34Å; L898-I944 HydrophobicContact CD2-CD1 4.03Å; L898-V956 HydrophobicContact CD2-CG1 3.77Å
899	S	97.1	Very high	94	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-67.3	-33.4	-179.7	-59.5	0	0	0	0	112.4	T895 M896 A897 T903 H941 L959 V967	T895-S899 VanDerWaalsContact O-CB 3.25Å; T895-S899 WeakPolarHBondContact O-CB 3.26Å; T895-S899 PolarHBondContact O-N 3.18Å; T895-S899 PolarHBondContact O-OG 3.09Å; M896-S899 PolarHBondContact O-N 2.87Å; A897-S899 PolarHBondContact O-N 2.89Å; S899-T903 VanDerWaalsContact O-CB 3.27Å; S899-T903 WeakPolarHBondContact O-CB 3.35Å; S899-T903 PolarHBondContact O-N 3.45Å; S899-T903 PolarHBondContact O-OG1 2.9Å; S899-H941 PolarHBondContact OG-NE2 3.44Å; S899-L959 WeakPolarHBondContact OG-CD1 3.28Å; S899-V967 WeakPolarHBondContact O-CG1 3.45Å
900	V	97.3	Very high	94.7	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-67.7	-45	171	166.9	0	0	0	0	111.4	T845 A848 M896 A897 L898 T903 I904 V967 I970	T845-V900 HydrophobicContact CG2-CG1 4.32Å; A848-V900 HydrophobicContact CB-CB 4.23Å; A848-V900 HydrophobicContact CB-CG2 3.59Å; M896-V900 WeakPolarHBondContact O-CG2 3.41Å; M896-V900 PolarHBondContact O-N 3.22Å; A897-V900 PolarHBondContact O-N 3.45Å; L898-V900 VanDerWaalsContact C-N 3.33Å; L898-V900 PolarHBondContact O-N 3.44Å; V900-T903 PolarHBondContact O-N 3.06Å; V900-I904 HydrophobicContact CG1-CD1 3.56Å; V900-I904 HydrophobicContact CG1-CG1 4.19Å; V900-I904 WeakPolarHBondContact O-CB 3.4Å; V900-I904 VanDerWaalsContact O-CG1 3.32Å; V900-I904 WeakPolarHBondContact O-CG1 3.25Å; V900-I904 PolarHBondContact O-N 2.91Å; V900-V967 HydrophobicContact CG2-CB 4.19Å; V900-V967 HydrophobicContact CG2-CG1 3.99Å; V900-V967 HydrophobicContact CG2-CG2 4.11Å; V900-I970 HydrophobicContact CG1-CG2 3.88Å; V900-I970 HydrophobicContact CG2-CB 4.42Å; V900-I970 HydrophobicContact CG2-CG2 4.39Å
901	L	96.3	Very high	94.9	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-55.8	-55.5	176.3	179.8	60.1	0	0	0	110.7	E768 L784 L789 V792 V841 T845 A897 L898 T903 I904 E905	E768-L901 HydrophobicContact CG-CD1 4.43Å; E768-L901 HydrophobicContact CG-CD2 4.2Å; L784-L901 HydrophobicContact CD1-CD2 3.82Å; L789-L901 HydrophobicContact CD2-CD2 4.32Å; V792-L901 HydrophobicContact CB-CD2 4.5Å; V792-L901 HydrophobicContact CG1-CD2 4.07Å; V792-L901 HydrophobicContact CG1-CG 4.33Å; V792-L901 HydrophobicContact CG2-CD2 4.2Å; V841-L901 HydrophobicContact CG1-CD1 3.51Å; T845-L901 HydrophobicContact CG2-CB 3.81Å; T845-L901 HydrophobicContact CG2-CD1 4.45Å; A897-L901 PolarHBondContact O-N 2.95Å; L898-L901 WeakPolarHBondContact O-CB 3.42Å; L898-L901 PolarHBondContact O-N 2.86Å; L901-T903 VanDerWaalsContact C-N 3.32Å; L901-T903 PolarHBondContact O-N 3.35Å; L901-I904 PolarHBondContact O-N 3.22Å; L901-E905 HydrophobicContact CD1-CG 4.24Å; L901-E905 WeakPolarHBondContact O-CG 3.48Å; L901-E905 PolarHBondContact O-N 3.16Å
902	V	96.8	Very high	94.9	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-57.1	-45	179.4	172.5	0	0	0	0	111.5	V792 T796 L898 E905 M906 L938 H941	V792-V902 HydrophobicContact CG2-CG2 4.28Å; T796-V902 HydrophobicContact CG2-CB 4.32Å; T796-V902 HydrophobicContact CG2-CG1 3.76Å; T796-V902 HydrophobicContact CG2-CG2 3.98Å; L898-V902 HydrophobicContact CD1-CG2 4.36Å; L898-V902 HydrophobicContact CG-CG2 4.48Å; L898-V902 VanDerWaalsContact O-CG2 3.31Å; L898-V902 WeakPolarHBondContact O-CG2 3.47Å; L898-V902 PolarHBondContact O-N 3.34Å; V902-E905 PolarHBondContact O-N 3.1Å; V902-M906 VanDerWaalsContact O-CG 3.31Å; V902-M906 WeakPolarHBondContact O-CG 3.44Å; V902-M906 PolarHBondContact O-N 3.45Å; V902-L938 HydrophobicContact CG1-CD2 4.21Å; V902-H941 HydrophobicContact CG1-CB 4.18Å
903	T	96.9	Very high	94.8	Very high	10 Å²	10	6.2 Å²	6.2	6%	0.061	3%	0.033	C	C	.	.	H	α-helix	trans	-69.3	-40.8	-177.3	-55.5	0	0	0	0	112	S899 V900 L901 E905 M906 F907 V967 L968 S971	S899-T903 VanDerWaalsContact O-CB 3.27Å; S899-T903 WeakPolarHBondContact O-CB 3.35Å; S899-T903 PolarHBondContact O-N 3.45Å; S899-T903 PolarHBondContact O-OG1 2.9Å; V900-T903 PolarHBondContact O-N 3.06Å; L901-T903 VanDerWaalsContact C-N 3.32Å; L901-T903 PolarHBondContact O-N 3.35Å; T903-E905 VanDerWaalsContact C-N 3.35Å; T903-M906 PolarHBondContact O-N 3.13Å; T903-F907 HydrophobicContact CG2-CD2 4.15Å; T903-F907 HydrophobicContact CG2-CE2 3.66Å; T903-F907 HydrophobicContact CG2-CZ 4.35Å; T903-F907 VanDerWaalsContact O-CD2 3.27Å; T903-F907 WeakPolarHBondContact O-CD2 3.43Å; T903-F907 PolarHBondContact O-N 3.04Å; T903-V967 WeakPolarHBondContact OG1-CG1 3.29Å; T903-L968 HydrophobicContact CG2-CD2 4.18Å; T903-S971 WeakPolarHBondContact CB-OG 3.39Å; T903-S971 VanDerWaalsContact CG2-CB 3.43Å
904	I	96.4	Very high	94.4	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-61.7	-45.9	174.9	-72.2	174.4	0	0	0	109.9	Y840 V841 V900 L901 M906 F907 N908 V974	Y840-I904 HydrophobicContact CD1-CD1 4.33Å; Y840-I904 HydrophobicContact CE1-CD1 4.08Å; V841-I904 HydrophobicContact CG2-CG2 3.54Å; V900-I904 HydrophobicContact CG1-CD1 3.56Å; V900-I904 HydrophobicContact CG1-CG1 4.19Å; V900-I904 WeakPolarHBondContact O-CB 3.4Å; V900-I904 VanDerWaalsContact O-CG1 3.32Å; V900-I904 WeakPolarHBondContact O-CG1 3.25Å; V900-I904 PolarHBondContact O-N 2.91Å; L901-I904 PolarHBondContact O-N 3.22Å; I904-M906 VanDerWaalsContact C-N 3.35Å; I904-M906 PolarHBondContact O-N 2.81Å; I904-F907 CarbonylContact O-C 3.59Å; I904-F907 PolarHBondContact O-N 3.27Å; I904-F907 VanDerWaalsContact O-N 3.09Å; I904-N908 WeakPolarHBondContact O-CB 3.44Å; I904-N908 PolarHBondContact O-N 3.03Å; I904-V974 HydrophobicContact CG2-CB 4.15Å; I904-V974 HydrophobicContact CG2-CG1 4.14Å; I904-V974 HydrophobicContact CG2-CG2 3.94Å
905	E	95.3	Very high	94	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-66.5	-35.3	-178.3	-69.1	-49.4	133.2	0	0	112.7	Y760 S764 D797 L901 V902 T903 F907 N908 S909	Y760-E905 HydrophobicContact CE2-CB 4.24Å; Y760-E905 WeakPolarHBondContact CE2-O 3.49Å; Y760-E905 VanDerWaalsContact CE2-OE2 3.24Å; Y760-E905 WeakPolarHBondContact CE2-OE2 3.47Å; S764-E905 VanDerWaalsContact CB-CD 3.47Å; S764-E905 WeakPolarHBondContact OG-CG 3.3Å; D797-E905 VanDerWaalsContact OD1-CB 3.32Å; D797-E905 WeakPolarHBondContact OD1-CB 3.16Å; L901-E905 HydrophobicContact CD1-CG 4.24Å; L901-E905 WeakPolarHBondContact O-CG 3.48Å; L901-E905 PolarHBondContact O-N 3.16Å; V902-E905 PolarHBondContact O-N 3.1Å; T903-E905 VanDerWaalsContact C-N 3.35Å; E905-F907 VanDerWaalsContact C-N 3.29Å; E905-F907 PolarHBondContact O-N 3.43Å; E905-N908 CarbonylContact O-C 3.59Å; E905-N908 PolarHBondContact O-N 3.27Å; E905-N908 PolarHBondContact OE2-ND2 2.96Å; E905-S909 WeakPolarHBondContact O-CB 3.36Å; E905-S909 PolarHBondContact O-N 3.4Å
906	M	96.1	Very high	93.3	Very high	7 Å²	7	10.1 Å²	10.1	3%	0.034	5%	0.052	C	C	.	.	H	α-helix	trans	-60.2	-40.3	171.3	-67.5	-49.3	92.9	0	0	112	T796 P800 V902 T903 I904 S909 I934 L938	T796-M906 HydrophobicContact CG2-CE 3.89Å; P800-M906 HydrophobicContact CG-CE 3.67Å; P800-M906 HydrophobicContact CG-SD 4.02Å; V902-M906 VanDerWaalsContact O-CG 3.31Å; V902-M906 WeakPolarHBondContact O-CG 3.44Å; V902-M906 PolarHBondContact O-N 3.45Å; T903-M906 PolarHBondContact O-N 3.13Å; I904-M906 VanDerWaalsContact C-N 3.35Å; I904-M906 PolarHBondContact O-N 2.81Å; M906-S909 PolarHBondContact O-OG 3.3Å; M906-I934 HydrophobicContact CB-CG2 4.02Å; M906-I934 HydrophobicContact CG-CG2 4.04Å; M906-I934 HydrophobicContact SD-CB 4.11Å; M906-I934 HydrophobicContact SD-CG1 3.98Å; M906-I934 HydrophobicContact SD-CG2 3.95Å; M906-L938 HydrophobicContact CG-CD2 3.99Å; M906-L938 HydrophobicContact CG-CG 4.06Å
907	F	95.7	Very high	92.8	Very high	47 Å²	47	13.6 Å²	13.6	21%	0.206	7%	0.068	C	C	.	.	H	α-helix	trans	-72.7	-35.7	174.6	-68.3	-41.3	0	0	0	113.1	T903 I904 E905 S909 L910 N911 I972 V974 I975	T903-F907 HydrophobicContact CG2-CD2 4.15Å; T903-F907 HydrophobicContact CG2-CE2 3.66Å; T903-F907 HydrophobicContact CG2-CZ 4.35Å; T903-F907 VanDerWaalsContact O-CD2 3.27Å; T903-F907 WeakPolarHBondContact O-CD2 3.43Å; T903-F907 PolarHBondContact O-N 3.04Å; I904-F907 CarbonylContact O-C 3.59Å; I904-F907 PolarHBondContact O-N 3.27Å; I904-F907 VanDerWaalsContact O-N 3.09Å; E905-F907 VanDerWaalsContact C-N 3.29Å; E905-F907 PolarHBondContact O-N 3.43Å; F907-S909 VanDerWaalsContact C-N 3.29Å; F907-S909 PolarHBondContact O-N 3.14Å; F907-L910 HydrophobicContact CD1-CD1 4.42Å; F907-L910 WeakPolarHBondContact O-CB 3.44Å; F907-L910 PolarHBondContact O-N 3.46Å; F907-N911 PolarHBondContact O-N 2.89Å; F907-N911 VanDerWaalsContact O-N 3.12Å; F907-I972 HydrophobicContact CE2-CB 4.39Å; F907-I972 HydrophobicContact CE2-CG1 3.61Å; F907-I972 HydrophobicContact CZ-CG1 3.8Å; F907-V974 HydrophobicContact CB-CG1 3.6Å; F907-V974 HydrophobicContact CD2-CG1 4.45Å; F907-V974 HydrophobicContact CG-CG1 4.49Å; F907-I975 HydrophobicContact CB-CD1 4.03Å; F907-I975 HydrophobicContact CB-CG1 3.79Å; F907-I975 HydrophobicContact CD1-CD1 3.63Å; F907-I975 HydrophobicContact CD1-CG1 4.36Å; F907-I975 HydrophobicContact CE1-CD1 4.23Å; F907-I975 HydrophobicContact CG-CD1 3.87Å; F907-I975 HydrophobicContact CG-CG1 4.12Å
908	N	93.9	Very high	92.4	Very high	3 Å²	3	14 Å²	14	2%	0.016	7%	0.071	C	C	.	.	H	α-helix	trans	-66.3	-32.9	175.8	-166.2	29.5	0	0	0	111.8	Y760 I904 E905 L910 N911 S912	Y760-N908 HydrophobicContact CD2-CB 4.47Å; Y760-N908 HydrophobicContact CE2-CB 4.36Å; I904-N908 WeakPolarHBondContact O-CB 3.44Å; I904-N908 PolarHBondContact O-N 3.03Å; E905-N908 CarbonylContact O-C 3.59Å; E905-N908 PolarHBondContact O-N 3.27Å; E905-N908 PolarHBondContact OE2-ND2 2.96Å; N908-L910 VanDerWaalsContact C-N 3.3Å; N908-L910 PolarHBondContact O-N 3.48Å; N908-N911 WeakPolarHBondContact O-CB 3.32Å; N908-N911 PolarHBondContact O-N 2.89Å; N908-S912 WeakPolarHBondContact O-CB 3.38Å; N908-S912 PolarHBondContact O-N 3.33Å; N908-S912 PolarHBondContact O-OG 2.86Å
909	S	94.4	Very high	92.1	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-63.7	-35.9	173.4	81.7	0	0	0	0	111.7	E905 M906 F907 S912 L913 I934	E905-S909 WeakPolarHBondContact O-CB 3.36Å; E905-S909 PolarHBondContact O-N 3.4Å; M906-S909 PolarHBondContact O-OG 3.3Å; F907-S909 VanDerWaalsContact C-N 3.29Å; F907-S909 PolarHBondContact O-N 3.14Å; S909-S912 CarbonylContact O-C 3.55Å; S909-S912 WeakPolarHBondContact O-CA 3.05Å; S909-S912 WeakPolarHBondContact O-CB 3.33Å; S909-S912 PolarHBondContact O-N 3.03Å; S909-L913 PolarHBondContact O-N 3.33Å; S909-I934 WeakPolarHBondContact OG-CD1 3.38Å
910	L	93.9	Very high	91.7	Very high	24 Å²	24	22.9 Å²	22.9	13%	0.126	12%	0.118	C	C	.	.	H	α-helix	trans	-66.8	-46	172.5	-62.7	179.2	0	0	0	111.2	F907 N908 S912 L913 L919 P924 L930 L931 I934	F907-L910 HydrophobicContact CD1-CD1 4.42Å; F907-L910 WeakPolarHBondContact O-CB 3.44Å; F907-L910 PolarHBondContact O-N 3.46Å; N908-L910 VanDerWaalsContact C-N 3.3Å; N908-L910 PolarHBondContact O-N 3.48Å; L910-S912 PolarHBondContact O-N 3.18Å; L910-L913 HydrophobicContact CD2-CD1 4.42Å; L910-L913 VanDerWaalsContact O-CB 3.28Å; L910-L913 WeakPolarHBondContact O-CB 3.42Å; L910-L913 WeakPolarHBondContact O-CG 3.48Å; L910-L913 PolarHBondContact O-N 3.09Å; L910-L919 HydrophobicContact CB-CD2 4.48Å; L910-L919 WeakPolarHBondContact O-CD2 3.39Å; L910-P924 HydrophobicContact CD2-CB 4.02Å; L910-L930 HydrophobicContact CD2-CD2 4.04Å; L910-L931 HydrophobicContact CD2-CD2 4.27Å; L910-I934 HydrophobicContact CD2-CD1 3.49Å; L910-I934 VanDerWaalsContact CD2-CD1 3.49Å; L910-I934 HydrophobicContact CG-CD1 3.9Å
911	N	91.9	Very high	91.1	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-56.5	-32.1	173.1	-72.3	-23.4	0	0	0	111.5	F907 N908 L913 V974 D978 K982	F907-N911 PolarHBondContact O-N 2.89Å; F907-N911 VanDerWaalsContact O-N 3.12Å; N908-N911 WeakPolarHBondContact O-CB 3.32Å; N908-N911 PolarHBondContact O-N 2.89Å; N911-L913 PolarHBondContact O-N 3.45Å; N911-V974 PolarHBondContact ND2-O 2.86Å; N911-D978 HydrophobicContact CB-CB 4.15Å; N911-D978 WeakPolarHBondContact CB-OD2 3.27Å; N911-D978 VanDerWaalsContact ND2-CB 3.28Å; N911-D978 WeakPolarHBondContact ND2-CB 3.42Å; N911-K982 WeakPolarHBondContact O-CE 3.37Å; N911-K982 PolarHBondContact O-NZ 3.21Å
912	S	90.9	Very high	90.5	Very high	10 Å²	10	33.4 Å²	33.4	7%	0.07	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	10.3	175.7	-58.3	0	0	0	0	113.8	Q756 L804 N908 S909 L910 S914	Q756-S912 WeakPolarHBondContact CG-O 3.43Å; Q756-S912 PolarHBondContact NE2-O 3.42Å; L804-S912 VanDerWaalsContact CD2-O 3.28Å; L804-S912 WeakPolarHBondContact CD2-O 3.38Å; N908-S912 WeakPolarHBondContact O-CB 3.38Å; N908-S912 PolarHBondContact O-N 3.33Å; N908-S912 PolarHBondContact O-OG 2.86Å; S909-S912 CarbonylContact O-C 3.55Å; S909-S912 WeakPolarHBondContact O-CA 3.05Å; S909-S912 WeakPolarHBondContact O-CB 3.33Å; S909-S912 PolarHBondContact O-N 3.03Å; L910-S912 PolarHBondContact O-N 3.18Å; S912-S914 VanDerWaalsContact C-N 3.28Å; S912-S914 PolarHBondContact O-N 3.41Å
913	L	88.8	Confident	90.2	Very high	6 Å²	6	34.6 Å²	34.6	3%	0.031	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-31.5	169.6	-83.2	163.7	0	0	0	113.3	N807 S909 L910 N911 L919 P924 N927 L930	N807-L913 PolarHBondContact ND2-O 3.25Å; N807-L913 VanDerWaalsContact ND2-O 3.16Å; S909-L913 PolarHBondContact O-N 3.33Å; L910-L913 HydrophobicContact CD2-CD1 4.42Å; L910-L913 VanDerWaalsContact O-CB 3.28Å; L910-L913 WeakPolarHBondContact O-CB 3.42Å; L910-L913 WeakPolarHBondContact O-CG 3.48Å; L910-L913 PolarHBondContact O-N 3.09Å; N911-L913 PolarHBondContact O-N 3.45Å; L913-L919 HydrophobicContact CD1-CD2 4.11Å; L913-P924 HydrophobicContact CD1-CB 4.49Å; L913-N927 HydrophobicContact CD2-CB 3.69Å; L913-L930 HydrophobicContact CD1-CD2 4.03Å; L913-L930 HydrophobicContact CD2-CD2 3.53Å; L913-L930 HydrophobicContact CG-CD2 3.58Å
914	S	84.8	Confident	89.9	Confident	11 Å²	11	35.7 Å²	35.7	8%	0.077	17%	0.174	C	C	.	.			trans	-147.6	142.3	178.4	-179.3	0	0	0	0	109.9	Q756 S912 Q917 K982	Q756-S914 VanDerWaalsContact NE2-C 3.25Å; S912-S914 VanDerWaalsContact C-N 3.28Å; S912-S914 PolarHBondContact O-N 3.41Å; S914-Q917 VanDerWaalsContact OG-CB 3.25Å; S914-Q917 WeakPolarHBondContact OG-CB 3.45Å; S914-Q917 WeakPolarHBondContact OG-CG 3.5Å; S914-Q917 PolarHBondContact OG-N 3.15Å; S914-K982 WeakPolarHBondContact O-CE 3.43Å; S914-K982 PolarHBondContact O-NZ 3.26Å; S914-K982 VanDerWaalsContact O-NZ 3.08Å
915	E	82.6	Confident	89.7	Confident	59 Å²	59	44.2 Å²	44.2	28%	0.276	21%	0.206	S	C	.	.	S	Bend	trans	-59.9	-55.3	175.8	179	166.4	-171.3	0	0	111.9	R759 L830 R833	R759-E915 IonicContact CZ-OE1 3.84Å; R759-E915 IonicContact CZ-OE2 2.81Å; R759-E915 VanDerWaalsContact CZ-OE2 3.3Å; R759-E915 IonicContact NH1-OE1 3.25Å; R759-E915 IonicContact NH1-OE2 2.68Å; R759-E915 PolarHBondContact NH1-OE2 3.32Å; R759-E915 IonicContact NH2-OE1 2.78Å; R759-E915 PolarHBondContact NH2-OE1 3.26Å; R759-E915 IonicContact NH2-OE2 3.02Å; R759-E915 PolarHBondContact NH2-OE2 2.89Å; L830-E915 HydrophobicContact CD1-CG 4.38Å; R833-E915 PolarHBondContact NH1-O 2.81Å
916	N	82	Confident	89.4	Confident	32 Å²	32	47.1 Å²	47.1	17%	0.171	22%	0.224	C	C	.	.	S	Bend	trans	-116.1	-17	-174.6	-73.3	-27.2	0	0	0	113.6	S985 R986 E990	N916-S985 WeakPolarHBondContact OD1-CB 3.14Å; N916-S985 PolarHBondContact OD1-OG 3.04Å; N916-R986 HydrophobicContact CB-CG 4.24Å; N916-R986 WeakPolarHBondContact O-CD 3.39Å; N916-R986 WeakPolarHBondContact O-CG 3.2Å; N916-R986 PolarHBondContact O-NH1 3.38Å; N916-E990 PolarHBondContact ND2-OE1 3.03Å
917	Q	84.4	Confident	89.2	Confident	73 Å²	73	47 Å²	47	34%	0.341	22%	0.223	S	C	.	.			trans	-75.5	138.6	179.2	-57	-161.8	7.9	0	0	111.6	S914 M922 K982	S914-Q917 VanDerWaalsContact OG-CB 3.25Å; S914-Q917 WeakPolarHBondContact OG-CB 3.45Å; S914-Q917 WeakPolarHBondContact OG-CG 3.5Å; S914-Q917 PolarHBondContact OG-N 3.15Å; Q917-M922 HydrophobicContact CB-CB 4.35Å; Q917-K982 WeakPolarHBondContact O-CD 3.09Å; Q917-K982 PolarHBondContact O-NZ 3.24Å
918	S	88.3	Confident	89.1	Confident	9 Å²	9	50.9 Å²	50.9	6%	0.063	25%	0.245	C	C	.	.			trans	-69.3	147.9	173.2	178.9	0	0	0	0	110.2	L920 R921 M922 E979 R986	S918-L920 PolarHBondContact O-N 3.09Å; S918-L920 VanDerWaalsContact O-N 3.11Å; S918-L920 PolarHBondContact OG-N 2.92Å; S918-R921 PolarHBondContact O-N 3.43Å; S918-M922 PolarHBondContact O-N 2.79Å; S918-E979 VanDerWaalsContact CA-OE1 3.29Å; S918-E979 WeakPolarHBondContact CA-OE1 3.47Å; S918-E979 WeakPolarHBondContact CA-OE2 3.43Å; S918-E979 WeakPolarHBondContact CB-OE2 3.46Å; S918-E979 VanDerWaalsContact OG-CD 3.23Å; S918-E979 PolarHBondContact OG-OE1 3.1Å; S918-E979 PolarHBondContact OG-OE2 2.83Å; S918-R986 VanDerWaalsContact N-NH1 3.14Å
919	L	89.6	Confident	89.1	Confident	27 Å²	27	59.3 Å²	59.3	14%	0.141	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-21	169.7	-70.5	174.1	0	0	0	112.8	L910 L913 M922 P923 P924 I975 E979	L910-L919 HydrophobicContact CB-CD2 4.48Å; L910-L919 WeakPolarHBondContact O-CD2 3.39Å; L913-L919 HydrophobicContact CD1-CD2 4.11Å; L919-M922 WeakPolarHBondContact CA-O 3.45Å; L919-M922 CarbonylContact O-C 3.59Å; L919-P923 VanDerWaalsContact O-CA 3.32Å; L919-P923 WeakPolarHBondContact O-CA 3.36Å; L919-P924 HydrophobicContact CD2-CG 4.32Å; L919-I975 HydrophobicContact CD1-CG2 3.93Å; L919-E979 PolarHBondContact N-OE1 3.46Å
920	L	88.9	Confident	89.1	Confident	162 Å²	162	59.3 Å²	59.3	85%	0.848	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-28.9	172.4	-63.5	176.3	0	0	0	113	S918	S918-L920 PolarHBondContact O-N 3.09Å; S918-L920 VanDerWaalsContact O-N 3.11Å; S918-L920 PolarHBondContact OG-N 2.92Å
921	R	85.1	Confident	89.2	Confident	194 Å²	194	60.8 Å²	60.8	73%	0.732	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-38.7	177.5	-74	-167.6	178.3	178.2	0.7	112.3	S918 P923	S918-R921 PolarHBondContact O-N 3.43Å; R921-P923 WeakPolarHBondContact O-CD 3.31Å
922	M	84.2	Confident	89.4	Confident	26 Å²	26	62.7 Å²	62.7	13%	0.128	30%	0.304	C	S	.	.	S	Bend	trans	-117.4	89.1	175.3	-169.9	176.2	-73.4	0	0	108.9	Q917 S918 L919 V926	Q917-M922 HydrophobicContact CB-CB 4.35Å; S918-M922 PolarHBondContact O-N 2.79Å; L919-M922 WeakPolarHBondContact CA-O 3.45Å; L919-M922 CarbonylContact O-C 3.59Å; M922-V926 HydrophobicContact CG-CB 4.34Å; M922-V926 HydrophobicContact CG-CG1 4.28Å; M922-V926 HydrophobicContact CG-CG2 4.11Å
923	P	90.5	Very high	89.6	Confident	25 Å²	25	62.7 Å²	62.7	16%	0.162	31%	0.305	C	S	.	.			trans	-64.3	156	-174.8	-24.5	34.6	0	0	0	114.1	L919 R921 W925 V926	L919-P923 VanDerWaalsContact O-CA 3.32Å; L919-P923 WeakPolarHBondContact O-CA 3.36Å; R921-P923 WeakPolarHBondContact O-CD 3.31Å; P923-W925 HydrophobicContact CB-CD2 3.55Å; P923-W925 HydrophobicContact CB-CE3 3.93Å; P923-W925 HydrophobicContact CB-CG 4.17Å; P923-W925 HydrophobicContact CB-CH2 3.71Å; P923-W925 HydrophobicContact CB-CZ2 3.3Å; P923-W925 HydrophobicContact CB-CZ3 4Å; P923-W925 HydrophobicContact CG-CH2 4.22Å; P923-W925 HydrophobicContact CG-CZ2 3.54Å; P923-W925 PolarHBondContact O-N 3.2Å; P923-W925 VanDerWaalsContact O-N 3.09Å; P923-V926 VanDerWaalsContact O-CB 3.27Å; P923-V926 WeakPolarHBondContact O-CB 3.37Å; P923-V926 WeakPolarHBondContact O-CG2 3.24Å; P923-V926 PolarHBondContact O-N 3.28Å
924	P	90.3	Very high	89.9	Confident	34 Å²	34	63.3 Å²	63.3	22%	0.221	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-52.2	-33.5	176.7	-31.5	37.7	0	0	0	115.7	L910 L913 L919 V926 L931	L910-P924 HydrophobicContact CD2-CB 4.02Å; L913-P924 HydrophobicContact CD1-CB 4.49Å; L919-P924 HydrophobicContact CD2-CG 4.32Å; P924-V926 PolarHBondContact O-N 3.5Å; P924-L931 HydrophobicContact CB-CD2 4.14Å
925	W	91.5	Very high	90.5	Very high	179 Å²	179	68 Å²	68	68%	0.678	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-76.1	-1.4	-178.8	56.2	77.1	0	0	0	114.6	P923 N927 L931	P923-W925 HydrophobicContact CB-CD2 3.55Å; P923-W925 HydrophobicContact CB-CE3 3.93Å; P923-W925 HydrophobicContact CB-CG 4.17Å; P923-W925 HydrophobicContact CB-CH2 3.71Å; P923-W925 HydrophobicContact CB-CZ2 3.3Å; P923-W925 HydrophobicContact CB-CZ3 4Å; P923-W925 HydrophobicContact CG-CH2 4.22Å; P923-W925 HydrophobicContact CG-CZ2 3.54Å; P923-W925 PolarHBondContact O-N 3.2Å; P923-W925 VanDerWaalsContact O-N 3.09Å; W925-N927 PolarHBondContact O-N 3.32Å; W925-L931 HydrophobicContact CB-CD1 4.23Å
926	V	88.9	Confident	91.2	Very high	61 Å²	61	69.2 Å²	69.2	37%	0.37	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-62.1	-36.1	172.2	170.7	0	0	0	0	110.8	P808 M922 P923 P924	P808-V926 HydrophobicContact CG-CG1 3.47Å; P808-V926 VanDerWaalsContact CG-CG1 3.47Å; M922-V926 HydrophobicContact CG-CB 4.34Å; M922-V926 HydrophobicContact CG-CG1 4.28Å; M922-V926 HydrophobicContact CG-CG2 4.11Å; P923-V926 VanDerWaalsContact O-CB 3.27Å; P923-V926 WeakPolarHBondContact O-CB 3.37Å; P923-V926 WeakPolarHBondContact O-CG2 3.24Å; P923-V926 PolarHBondContact O-N 3.28Å; P924-V926 PolarHBondContact O-N 3.5Å
927	N	92.2	Very high	91.8	Very high	4 Å²	4	67.7 Å²	67.7	2%	0.021	33%	0.331	C	S	.	.			trans	-113.4	93.9	173.9	-172.3	-10.2	0	0	0	110.6	A803 N807 L913 W925 W929 L930 L931	A803-N927 PolarHBondContact O-ND2 3.31Å; N807-N927 PolarHBondContact OD1-ND2 3.05Å; L913-N927 HydrophobicContact CD2-CB 3.69Å; W925-N927 PolarHBondContact O-N 3.32Å; N927-W929 PolarHBondContact O-N 3.44Å; N927-W929 WeakPolarHBondContact OD1-CB 3.3Å; N927-W929 PolarHBondContact OD1-N 3.5Å; N927-W929 VanDerWaalsContact OD1-N 3.08Å; N927-L930 HydrophobicContact CB-CB 3.99Å; N927-L930 WeakPolarHBondContact O-CB 3.39Å; N927-L930 PolarHBondContact O-N 3.42Å; N927-L930 PolarHBondContact OD1-N 3.34Å; N927-L930 VanDerWaalsContact OD1-N 3.15Å; N927-L931 PolarHBondContact O-N 2.94Å
928	I	93.4	Very high	92.4	Very high	129 Å²	129	66.7 Å²	66.7	66%	0.662	33%	0.327	S	S	*	.	H	α-helix	trans	-63	-30.9	178.2	-62.4	178.2	0	0	0	111.5	L930 L931 G932	I928-L930 VanDerWaalsContact C-N 3.32Å; I928-L930 PolarHBondContact O-N 3.01Å; I928-L931 PolarHBondContact O-N 2.87Å; I928-G932 PolarHBondContact O-N 3.43Å
929	W	93.7	Very high	92.8	Very high	179 Å²	179	69.3 Å²	69.3	68%	0.678	35%	0.345	S	S	*	.	H	α-helix	trans	-65.8	-36.8	177.2	-60.6	101.8	0	0	0	111.6	A803 F806 N927 G932 A933	A803-W929 HydrophobicContact CB-CB 4.43Å; F806-W929 HydrophobicContact CD2-CB 4.44Å; F806-W929 HydrophobicContact CG-CG 4.46Å; N927-W929 PolarHBondContact O-N 3.44Å; N927-W929 WeakPolarHBondContact OD1-CB 3.3Å; N927-W929 PolarHBondContact OD1-N 3.5Å; N927-W929 VanDerWaalsContact OD1-N 3.08Å; W929-G932 PolarHBondContact O-N 3.07Å; W929-A933 WeakPolarHBondContact O-CB 3.3Å; W929-A933 PolarHBondContact O-N 3.45Å
930	L	95.1	Very high	93.1	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-64	-45.1	175.3	-177.8	63.8	0	0	0	111.4	P800 A803 L804 L910 L913 N927 I928 G932 A933 I934	P800-L930 HydrophobicContact CB-CD1 3.94Å; A803-L930 HydrophobicContact CB-CB 4.22Å; A803-L930 HydrophobicContact CB-CD1 4.09Å; L804-L930 HydrophobicContact CD2-CD1 4.18Å; L804-L930 HydrophobicContact CD2-CD2 3.95Å; L804-L930 HydrophobicContact CG-CD1 4.19Å; L910-L930 HydrophobicContact CD2-CD2 4.04Å; L913-L930 HydrophobicContact CD1-CD2 4.03Å; L913-L930 HydrophobicContact CD2-CD2 3.53Å; L913-L930 HydrophobicContact CG-CD2 3.58Å; N927-L930 HydrophobicContact CB-CB 3.99Å; N927-L930 WeakPolarHBondContact O-CB 3.39Å; N927-L930 PolarHBondContact O-N 3.42Å; N927-L930 PolarHBondContact OD1-N 3.34Å; N927-L930 VanDerWaalsContact OD1-N 3.15Å; I928-L930 VanDerWaalsContact C-N 3.32Å; I928-L930 PolarHBondContact O-N 3.01Å; L930-G932 VanDerWaalsContact C-N 3.33Å; L930-G932 PolarHBondContact O-N 3.31Å; L930-A933 PolarHBondContact O-N 3.23Å; L930-I934 HydrophobicContact CD1-CD1 4.36Å; L930-I934 HydrophobicContact CD1-CG1 4.46Å; L930-I934 HydrophobicContact CG-CD1 4.03Å; L930-I934 VanDerWaalsContact O-CG1 3.32Å; L930-I934 WeakPolarHBondContact O-CG1 3.48Å; L930-I934 PolarHBondContact O-N 3.34Å
931	L	95.3	Very high	93.4	Very high	56 Å²	56	62.2 Å²	62.2	29%	0.293	31%	0.308	S	S	.	.	H	α-helix	trans	-61.1	-43	175.9	-63.8	-179.4	0	0	0	111.9	L910 P924 W925 N927 I928 A933 I934 I935	L910-L931 HydrophobicContact CD2-CD2 4.27Å; P924-L931 HydrophobicContact CB-CD2 4.14Å; W925-L931 HydrophobicContact CB-CD1 4.23Å; N927-L931 PolarHBondContact O-N 2.94Å; I928-L931 PolarHBondContact O-N 2.87Å; L931-A933 VanDerWaalsContact C-N 3.35Å; L931-I934 PolarHBondContact O-N 3.27Å; L931-I935 VanDerWaalsContact O-CG1 3.29Å; L931-I935 WeakPolarHBondContact O-CG1 3.42Å; L931-I935 PolarHBondContact O-N 3.1Å
932	G	96.2	Very high	93.9	Very high	40 Å²	40	57.1 Å²	57.1	41%	0.412	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-41.6	174.5	0	0	0	0	0	112.7	I928 W929 L930 I935 L936	I928-G932 PolarHBondContact O-N 3.43Å; W929-G932 PolarHBondContact O-N 3.07Å; L930-G932 VanDerWaalsContact C-N 3.33Å; L930-G932 PolarHBondContact O-N 3.31Å; G932-I935 PolarHBondContact O-N 2.98Å; G932-L936 WeakPolarHBondContact O-CB 3.34Å; G932-L936 PolarHBondContact O-N 3.49Å
933	A	95.7	Very high	94.4	Very high	11 Å²	11	59.3 Å²	59.3	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-40	177.5	0	0	0	0	0	112.4	L799 A803 W929 L930 L931 L936 S937	L799-A933 HydrophobicContact CB-CB 4.37Å; A803-A933 HydrophobicContact CB-CB 3.65Å; W929-A933 WeakPolarHBondContact O-CB 3.3Å; W929-A933 PolarHBondContact O-N 3.45Å; L930-A933 PolarHBondContact O-N 3.23Å; L931-A933 VanDerWaalsContact C-N 3.35Å; A933-L936 PolarHBondContact O-N 2.89Å; A933-S937 WeakPolarHBondContact O-CB 3.44Å; A933-S937 PolarHBondContact O-N 3.25Å; A933-S937 PolarHBondContact O-OG 2.99Å
934	I	96.1	Very high	94.6	Very high	19 Å²	19	58.1 Å²	58.1	10%	0.097	30%	0.296	C	S	.	.	H	α-helix	trans	-62.1	-47.3	174.3	-70.1	166	0	0	0	110.5	M906 S909 L910 L930 L931 L936 S937 L938	M906-I934 HydrophobicContact CB-CG2 4.02Å; M906-I934 HydrophobicContact CG-CG2 4.04Å; M906-I934 HydrophobicContact SD-CB 4.11Å; M906-I934 HydrophobicContact SD-CG1 3.98Å; M906-I934 HydrophobicContact SD-CG2 3.95Å; S909-I934 WeakPolarHBondContact OG-CD1 3.38Å; L910-I934 HydrophobicContact CD2-CD1 3.49Å; L910-I934 VanDerWaalsContact CD2-CD1 3.49Å; L910-I934 HydrophobicContact CG-CD1 3.9Å; L930-I934 HydrophobicContact CD1-CD1 4.36Å; L930-I934 HydrophobicContact CD1-CG1 4.46Å; L930-I934 HydrophobicContact CG-CD1 4.03Å; L930-I934 VanDerWaalsContact O-CG1 3.32Å; L930-I934 WeakPolarHBondContact O-CG1 3.48Å; L930-I934 PolarHBondContact O-N 3.34Å; L931-I934 PolarHBondContact O-N 3.27Å; I934-L936 VanDerWaalsContact C-N 3.32Å; I934-L936 PolarHBondContact O-N 3.12Å; I934-S937 PolarHBondContact O-N 3.36Å; I934-L938 HydrophobicContact CG2-CD1 4.05Å; I934-L938 WeakPolarHBondContact O-CG 3.34Å; I934-L938 PolarHBondContact O-N 3.31Å
935	I	96.7	Very high	94.8	Very high	110 Å²	110	56.6 Å²	56.6	56%	0.564	29%	0.286	S	S	*	.	H	α-helix	trans	-60.8	-43.5	178.3	-68.9	166.2	0	0	0	110.7	L931 G932 S939	L931-I935 VanDerWaalsContact O-CG1 3.29Å; L931-I935 WeakPolarHBondContact O-CG1 3.42Å; L931-I935 PolarHBondContact O-N 3.1Å; G932-I935 PolarHBondContact O-N 2.98Å; I935-S939 WeakPolarHBondContact O-CB 3.38Å; I935-S939 PolarHBondContact O-N 3.32Å; I935-S939 PolarHBondContact O-OG 3.05Å
936	L	96.4	Very high	94.9	Very high	84 Å²	84	54.1 Å²	54.1	44%	0.44	28%	0.277	S	S	.	.	H	α-helix	trans	-64.2	-43.3	177.3	-178.7	58.6	0	0	0	111.6	L799 G932 A933 I934 S939 L940	L799-L936 HydrophobicContact CD1-CB 4.43Å; L799-L936 HydrophobicContact CD1-CD2 3.76Å; L799-L936 HydrophobicContact CD1-CG 3.83Å; L799-L936 HydrophobicContact CD2-CD2 4.25Å; G932-L936 WeakPolarHBondContact O-CB 3.34Å; G932-L936 PolarHBondContact O-N 3.49Å; A933-L936 PolarHBondContact O-N 2.89Å; I934-L936 VanDerWaalsContact C-N 3.32Å; I934-L936 PolarHBondContact O-N 3.12Å; L936-S939 WeakPolarHBondContact O-CB 3.08Å; L936-S939 PolarHBondContact O-N 2.84Å; L936-L940 HydrophobicContact CD1-CD1 4.43Å; L936-L940 HydrophobicContact CD1-CG 4.35Å; L936-L940 HydrophobicContact CG-CD1 4.23Å; L936-L940 WeakPolarHBondContact O-CG 3.27Å; L936-L940 PolarHBondContact O-N 2.89Å
937	S	95.8	Very high	95.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-43.7	179.8	-54.7	0	0	0	0	111.6	T796 A933 I934 S939 L940 H941	T796-S937 PolarHBondContact O-OG 2.91Å; A933-S937 WeakPolarHBondContact O-CB 3.44Å; A933-S937 PolarHBondContact O-N 3.25Å; A933-S937 PolarHBondContact O-OG 2.99Å; I934-S937 PolarHBondContact O-N 3.36Å; S937-S939 VanDerWaalsContact C-N 3.32Å; S937-S939 PolarHBondContact O-N 3.49Å; S937-L940 PolarHBondContact O-N 3.31Å; S937-H941 PolarHBondContact O-N 3.48Å
938	L	95.8	Very high	95.1	Very high	52 Å²	52	62.7 Å²	62.7	27%	0.272	32%	0.318	S	S	.	.	H	α-helix	trans	-64	-37.6	173	-70.7	173.4	0	0	0	112	V902 M906 I934 H941 F942	V902-L938 HydrophobicContact CG1-CD2 4.21Å; M906-L938 HydrophobicContact CG-CD2 3.99Å; M906-L938 HydrophobicContact CG-CG 4.06Å; I934-L938 HydrophobicContact CG2-CD1 4.05Å; I934-L938 WeakPolarHBondContact O-CG 3.34Å; I934-L938 PolarHBondContact O-N 3.31Å; L938-H941 WeakPolarHBondContact O-CB 3.48Å; L938-H941 PolarHBondContact O-N 3.44Å; L938-F942 WeakPolarHBondContact O-CD2 3.44Å; L938-F942 PolarHBondContact O-N 2.91Å
939	S	96.6	Very high	94.8	Very high	63 Å²	63	60.7 Å²	60.7	44%	0.441	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-39.6	176.5	-58.4	0	0	0	0	112.1	I935 L936 S937 F942 L943	I935-S939 WeakPolarHBondContact O-CB 3.38Å; I935-S939 PolarHBondContact O-N 3.32Å; I935-S939 PolarHBondContact O-OG 3.05Å; L936-S939 WeakPolarHBondContact O-CB 3.08Å; L936-S939 PolarHBondContact O-N 2.84Å; S937-S939 VanDerWaalsContact C-N 3.32Å; S937-S939 PolarHBondContact O-N 3.49Å; S939-F942 PolarHBondContact O-N 3.31Å; S939-L943 PolarHBondContact O-N 3.02Å
940	L	95.6	Very high	94.6	Very high	39 Å²	39	54.2 Å²	54.2	20%	0.204	29%	0.291	C	S	.	.	H	α-helix	trans	-68.3	-34.4	173.5	-70.7	173.3	0	0	0	112	W791 V795 L799 L936 S937 L943 I944	W791-L940 HydrophobicContact CZ2-CB 4.43Å; V795-L940 HydrophobicContact CG1-CD1 3.72Å; L799-L940 HydrophobicContact CD1-CD1 3.75Å; L936-L940 HydrophobicContact CD1-CD1 4.43Å; L936-L940 HydrophobicContact CD1-CG 4.35Å; L936-L940 HydrophobicContact CG-CD1 4.23Å; L936-L940 WeakPolarHBondContact O-CG 3.27Å; L936-L940 PolarHBondContact O-N 2.89Å; S937-L940 PolarHBondContact O-N 3.31Å; L940-L943 HydrophobicContact CD2-CD2 4.04Å; L940-L943 VanDerWaalsContact O-CB 3.32Å; L940-L943 WeakPolarHBondContact O-CB 3.5Å; L940-L943 PolarHBondContact O-N 3.11Å; L940-I944 PolarHBondContact O-N 2.81Å
941	H	96.3	Very high	94.4	Very high	1 Å²	1	55 Å²	55	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-61.8	-45.5	170.4	-171.9	62.6	0	0	0	111.4	S899 V902 S937 L938 L943 I944 L945 W964	S899-H941 PolarHBondContact OG-NE2 3.44Å; V902-H941 HydrophobicContact CG1-CB 4.18Å; S937-H941 PolarHBondContact O-N 3.48Å; L938-H941 WeakPolarHBondContact O-CB 3.48Å; L938-H941 PolarHBondContact O-N 3.44Å; H941-L943 VanDerWaalsContact C-N 3.28Å; H941-L943 PolarHBondContact O-N 2.9Å; H941-I944 WeakPolarHBondContact O-CG1 3.13Å; H941-I944 PolarHBondContact O-N 3.3Å; H941-L945 WeakPolarHBondContact O-CG 3.26Å; H941-L945 PolarHBondContact O-N 3.05Å; H941-W964 AromaticContact CD2-CH2 3.87Å; H941-W964 AromaticContact NE2-CH2 3.97Å
942	F	95.9	Very high	94	Very high	87 Å²	87	56.3 Å²	56.3	38%	0.382	30%	0.303	S	S	.	.	H	α-helix	trans	-64.9	-33.1	173.1	-69.1	-59.2	0	0	0	112.6	L938 S939 I944 L945 Y946 W964	L938-F942 WeakPolarHBondContact O-CD2 3.44Å; L938-F942 PolarHBondContact O-N 2.91Å; S939-F942 PolarHBondContact O-N 3.31Å; F942-I944 PolarHBondContact O-N 3.37Å; F942-L945 HydrophobicContact CD1-CD1 4.47Å; F942-L945 PolarHBondContact O-N 3.31Å; F942-Y946 HydrophobicContact CB-CD2 4.31Å; F942-Y946 HydrophobicContact CD1-CD2 4.31Å; F942-Y946 AromaticContact CD1-CE2 3.85Å; F942-Y946 HydrophobicContact CD1-CE2 3.85Å; F942-Y946 VanDerWaalsContact O-CD2 3.3Å; F942-Y946 WeakPolarHBondContact O-CD2 3.29Å; F942-Y946 PolarHBondContact O-N 3.15Å; F942-W964 HydrophobicContact CD1-CZ2 4.2Å; F942-W964 AromaticContact CE1-CE2 3.92Å; F942-W964 AromaticContact CE1-CH2 3.93Å; F942-W964 HydrophobicContact CE1-CH2 3.93Å; F942-W964 AromaticContact CE1-CZ2 3.39Å; F942-W964 HydrophobicContact CE1-CZ2 3.39Å; F942-W964 HydrophobicContact CZ-CH2 4.2Å; F942-W964 HydrophobicContact CZ-CZ2 4.05Å
943	L	95.1	Very high	93.5	Very high	72 Å²	72	57.5 Å²	57.5	38%	0.377	30%	0.3	S	S	.	.	H	α-helix	trans	-59.9	-47.4	175.7	-173.5	75.3	0	0	0	111.5	S939 L940 H941 L945 Y946 V947 L950	S939-L943 PolarHBondContact O-N 3.02Å; L940-L943 HydrophobicContact CD2-CD2 4.04Å; L940-L943 VanDerWaalsContact O-CB 3.32Å; L940-L943 WeakPolarHBondContact O-CB 3.5Å; L940-L943 PolarHBondContact O-N 3.11Å; H941-L943 VanDerWaalsContact C-N 3.28Å; H941-L943 PolarHBondContact O-N 2.9Å; L943-L945 PolarHBondContact O-N 2.96Å; L943-Y946 PolarHBondContact O-N 2.7Å; L943-V947 HydrophobicContact CD1-CB 4.03Å; L943-V947 HydrophobicContact CD1-CG1 4.49Å; L943-V947 HydrophobicContact CD1-CG2 3.55Å; L943-V947 HydrophobicContact CG-CG2 4.41Å; L943-V947 WeakPolarHBondContact O-CB 3.41Å; L943-V947 PolarHBondContact O-N 3.32Å; L943-L950 HydrophobicContact CD2-CD1 4.18Å; L943-L950 HydrophobicContact CG-CD1 3.87Å
944	I	94.7	Very high	93.1	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-67.5	-22.6	179.4	64.2	165.4	0	0	0	113	W791 L898 L940 H941 F942 L950 P951 F954	W791-I944 HydrophobicContact CZ2-CG2 3.91Å; L898-I944 HydrophobicContact CD2-CD1 4.03Å; L940-I944 PolarHBondContact O-N 2.81Å; H941-I944 WeakPolarHBondContact O-CG1 3.13Å; H941-I944 PolarHBondContact O-N 3.3Å; F942-I944 PolarHBondContact O-N 3.37Å; I944-L950 HydrophobicContact CB-CB 4.45Å; I944-L950 HydrophobicContact CG2-CD1 4.33Å; I944-P951 WeakPolarHBondContact O-CD 3.5Å; I944-P951 VanDerWaalsContact O-CG 3.3Å; I944-P951 WeakPolarHBondContact O-CG 3.37Å; I944-F954 HydrophobicContact CB-CD2 4.08Å; I944-F954 HydrophobicContact CB-CE2 4.42Å; I944-F954 HydrophobicContact CG2-CD2 4Å; I944-F954 HydrophobicContact CG2-CE2 3.83Å
945	L	93.9	Very high	92.7	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-84	-36.1	177.8	-66.5	179.5	0	0	0	113.6	T895 H941 F942 L943 P951 V956 P958 W964	T895-L945 HydrophobicContact CG2-CD2 3.49Å; T895-L945 VanDerWaalsContact CG2-CD2 3.49Å; H941-L945 WeakPolarHBondContact O-CG 3.26Å; H941-L945 PolarHBondContact O-N 3.05Å; F942-L945 HydrophobicContact CD1-CD1 4.47Å; F942-L945 PolarHBondContact O-N 3.31Å; L943-L945 PolarHBondContact O-N 2.96Å; L945-P951 WeakPolarHBondContact O-CG 3.22Å; L945-V956 HydrophobicContact CD2-CB 3.83Å; L945-V956 HydrophobicContact CD2-CG2 3.84Å; L945-P958 WeakPolarHBondContact O-CG 3.43Å; L945-W964 HydrophobicContact CD1-CZ2 4.02Å
946	Y	93.9	Very high	92.5	Very high	127 Å²	127	53.9 Å²	53.9	50%	0.498	28%	0.278	S	S	.	.	H	α-helix	trans	-111.1	-15.7	-167.5	-71.6	-80.1	0	0	0	115.1	F942 L943 P958	F942-Y946 HydrophobicContact CB-CD2 4.31Å; F942-Y946 HydrophobicContact CD1-CD2 4.31Å; F942-Y946 AromaticContact CD1-CE2 3.85Å; F942-Y946 HydrophobicContact CD1-CE2 3.85Å; F942-Y946 VanDerWaalsContact O-CD2 3.3Å; F942-Y946 WeakPolarHBondContact O-CD2 3.29Å; F942-Y946 PolarHBondContact O-N 3.15Å; L943-Y946 PolarHBondContact O-N 2.7Å; Y946-P958 HydrophobicContact CD1-CB 4.18Å; Y946-P958 HydrophobicContact CD1-CG 4.06Å; Y946-P958 HydrophobicContact CE1-CB 3.65Å; Y946-P958 HydrophobicContact CE1-CG 4.05Å
947	V	94.4	Very high	92.4	Very high	69 Å²	69	51.2 Å²	51.2	42%	0.418	27%	0.265	S	S	.	.	S	Bend	trans	-107.8	108.2	-174	-179.4	0	0	0	0	111.9	L943 L950 P951	L943-V947 HydrophobicContact CD1-CB 4.03Å; L943-V947 HydrophobicContact CD1-CG1 4.49Å; L943-V947 HydrophobicContact CD1-CG2 3.55Å; L943-V947 HydrophobicContact CG-CG2 4.41Å; L943-V947 WeakPolarHBondContact O-CB 3.41Å; L943-V947 PolarHBondContact O-N 3.32Å; V947-L950 HydrophobicContact CB-CD1 4.48Å; V947-L950 WeakPolarHBondContact O-CB 3.41Å; V947-L950 PolarHBondContact O-N 3.36Å; V947-P951 WeakPolarHBondContact O-CD 3.35Å
948	E	89.9	Confident	92.3	Very high	177 Å²	177	53.7 Å²	53.7	83%	0.827	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	134.9	171.1	-65.3	-176.2	179.9	0	0	110.8
949	P	88.8	Confident	92.2	Very high	86 Å²	86	51.6 Å²	51.6	56%	0.558	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	cis	-96.7	10.6	14.2	37.7	-36.5	0	0	0	115.9	L952 I953	P949-L952 WeakPolarHBondContact O-CB 3.43Å; P949-L952 PolarHBondContact O-N 3.46Å; P949-I953 PolarHBondContact O-N 3.21Å
950	L	88.5	Confident	92.1	Very high	43 Å²	43	50.3 Å²	50.3	23%	0.225	26%	0.261	C	S	.	.	H	α-helix	trans	-61.8	-41.5	-169.7	-57.3	171.7	0	0	0	114.8	L943 I944 V947 L952 I953 F954	L943-L950 HydrophobicContact CD2-CD1 4.18Å; L943-L950 HydrophobicContact CG-CD1 3.87Å; I944-L950 HydrophobicContact CB-CB 4.45Å; I944-L950 HydrophobicContact CG2-CD1 4.33Å; V947-L950 HydrophobicContact CB-CD1 4.48Å; V947-L950 WeakPolarHBondContact O-CB 3.41Å; V947-L950 PolarHBondContact O-N 3.36Å; L950-L952 PolarHBondContact O-N 3.03Å; L950-I953 PolarHBondContact O-N 3.36Å; L950-F954 HydrophobicContact CB-CD2 4.36Å; L950-F954 HydrophobicContact CD2-CE2 4.37Å; L950-F954 WeakPolarHBondContact O-CD2 3.31Å; L950-F954 PolarHBondContact O-N 2.8Å
951	P	90.6	Very high	92	Very high	18 Å²	18	58 Å²	58	12%	0.117	29%	0.287	C	S	.	.	H	α-helix	trans	-59.2	-30.3	179.2	-24.5	31.6	0	0	0	113.9	I944 L945 V947 Q955 V956	I944-P951 WeakPolarHBondContact O-CD 3.5Å; I944-P951 VanDerWaalsContact O-CG 3.3Å; I944-P951 WeakPolarHBondContact O-CG 3.37Å; L945-P951 WeakPolarHBondContact O-CG 3.22Å; V947-P951 WeakPolarHBondContact O-CD 3.35Å; P951-Q955 WeakPolarHBondContact O-CA 3.47Å; P951-Q955 PolarHBondContact O-N 3.29Å; P951-V956 HydrophobicContact CB-CG2 4.13Å; P951-V956 WeakPolarHBondContact CB-O 3.46Å; P951-V956 PolarHBondContact O-N 3.21Å
952	L	86.3	Confident	91.8	Very high	83 Å²	83	61 Å²	61	44%	0.435	31%	0.308	S	S	.	.	H	α-helix	trans	-70.2	-42.8	176.3	-175.4	67.9	0	0	0	111.3	P949 L950 Q955	P949-L952 WeakPolarHBondContact O-CB 3.43Å; P949-L952 PolarHBondContact O-N 3.46Å; L950-L952 PolarHBondContact O-N 3.03Å; L952-Q955 PolarHBondContact O-N 2.91Å
953	I	86.1	Confident	91.7	Very high	65 Å²	65	56.8 Å²	56.8	33%	0.333	29%	0.29	S	S	.	.	H	α-helix	trans	-66.7	-42.4	-179.4	-62.5	172.6	0	0	0	110.8	V89 P949 L950	V89-I953 HydrophobicContact CG1-CG2 4.13Å; P949-I953 PolarHBondContact O-N 3.21Å; L950-I953 PolarHBondContact O-N 3.36Å
954	F	87.8	Confident	91.7	Very high	17 Å²	17	54.6 Å²	54.6	8%	0.075	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-1.1	-177.8	-69.8	-72.4	0	0	0	113.8	V787 Q788 W791 I944 L950 V956	V787-F954 HydrophobicContact CG1-CD1 3.85Å; V787-F954 HydrophobicContact CG1-CE1 3.82Å; Q788-F954 WeakPolarHBondContact CG-O 3.47Å; Q788-F954 PolarHBondContact NE2-O 3.04Å; W791-F954 HydrophobicContact CB-CD1 4.43Å; W791-F954 HydrophobicContact CB-CE1 3.6Å; W791-F954 HydrophobicContact CB-CZ 4.12Å; W791-F954 HydrophobicContact CD2-CE1 4.2Å; W791-F954 AromaticContact CD2-CZ 3.81Å; W791-F954 HydrophobicContact CD2-CZ 3.81Å; W791-F954 HydrophobicContact CE3-CE1 4.32Å; W791-F954 AromaticContact CE3-CZ 3.66Å; W791-F954 HydrophobicContact CE3-CZ 3.66Å; W791-F954 AromaticContact CG-CE1 3.92Å; W791-F954 HydrophobicContact CG-CE1 3.92Å; W791-F954 HydrophobicContact CG-CZ 4.02Å; W791-F954 HydrophobicContact CZ3-CZ 4.34Å; I944-F954 HydrophobicContact CB-CD2 4.08Å; I944-F954 HydrophobicContact CB-CE2 4.42Å; I944-F954 HydrophobicContact CG2-CD2 4Å; I944-F954 HydrophobicContact CG2-CE2 3.83Å; L950-F954 HydrophobicContact CB-CD2 4.36Å; L950-F954 HydrophobicContact CD2-CE2 4.37Å; L950-F954 WeakPolarHBondContact O-CD2 3.31Å; L950-F954 PolarHBondContact O-N 2.8Å; F954-V956 VanDerWaalsContact C-N 3.33Å; F954-V956 HydrophobicContact CB-CG1 4.25Å; F954-V956 HydrophobicContact CB-CG2 3.96Å; F954-V956 PolarHBondContact O-N 2.97Å
955	Q	88.2	Confident	91.8	Very high	46 Å²	46	56.7 Å²	56.7	22%	0.215	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	49.5	-175.3	-63.2	-72	-8.7	0	0	112.3	I785 T894 P951 L952	I785-Q955 HydrophobicContact CD1-CB 4.01Å; I785-Q955 HydrophobicContact CD1-CG 4.1Å; T894-Q955 PolarHBondContact OG1-O 2.91Å; T894-Q955 VanDerWaalsContact OG1-O 3.12Å; P951-Q955 WeakPolarHBondContact O-CA 3.47Å; P951-Q955 PolarHBondContact O-N 3.29Å; L952-Q955 PolarHBondContact O-N 2.91Å
956	V	92.9	Very high	91.8	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.006	30%	0.296	C	S	.	.			trans	-123.3	165.1	-179.8	-64.9	0	0	0	0	112.1	T895 L898 L945 P951 F954	T895-V956 HydrophobicContact CG2-CB 4.38Å; T895-V956 VanDerWaalsContact OG1-CA 3.24Å; T895-V956 WeakPolarHBondContact OG1-CA 3.34Å; T895-V956 WeakPolarHBondContact OG1-CB 3.44Å; L898-V956 HydrophobicContact CD2-CG1 3.77Å; L945-V956 HydrophobicContact CD2-CB 3.83Å; L945-V956 HydrophobicContact CD2-CG2 3.84Å; P951-V956 HydrophobicContact CB-CG2 4.13Å; P951-V956 WeakPolarHBondContact CB-O 3.46Å; P951-V956 PolarHBondContact O-N 3.21Å; F954-V956 VanDerWaalsContact C-N 3.33Å; F954-V956 HydrophobicContact CB-CG1 4.25Å; F954-V956 HydrophobicContact CB-CG2 3.96Å; F954-V956 PolarHBondContact O-N 2.97Å
957	T	93.6	Very high	92	Very high	27 Å²	27	51.7 Å²	51.7	17%	0.166	27%	0.272	C	S	.	.			trans	-143.4	148.2	179.4	-174.2	0	0	0	0	111.3	R891 Y892 T895 L959	R891-T957 HydrophobicContact CB-CG2 4.16Å; Y892-T957 HydrophobicContact CD1-CG2 3.5Å; Y892-T957 VanDerWaalsContact CD1-CG2 3.5Å; Y892-T957 HydrophobicContact CD2-CG2 3.84Å; Y892-T957 HydrophobicContact CE1-CG2 3.63Å; Y892-T957 HydrophobicContact CE2-CG2 3.98Å; Y892-T957 HydrophobicContact CG-CG2 3.6Å; T895-T957 VanDerWaalsContact CG2-O 3.31Å; T895-T957 WeakPolarHBondContact CG2-O 3.48Å; T895-T957 PolarHBondContact OG1-N 3.14Å; T957-L959 PolarHBondContact O-N 3.32Å
958	P	94.3	Very high	92.1	Very high	53 Å²	53	51.5 Å²	51.5	34%	0.344	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-54.6	134.9	175.5	-27.2	34.9	0	0	0	113.7	L945 Y946	L945-P958 WeakPolarHBondContact O-CG 3.43Å; Y946-P958 HydrophobicContact CD1-CB 4.18Å; Y946-P958 HydrophobicContact CD1-CG 4.06Å; Y946-P958 HydrophobicContact CE1-CB 3.65Å; Y946-P958 HydrophobicContact CE1-CG 4.05Å
959	L	93.6	Very high	92.3	Very high	8 Å²	8	50.1 Å²	50.1	4%	0.042	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-91.5	145.5	175.4	-61.9	179.7	0	0	0	111.9	Y892 T895 M896 S899 T957 Q963 W964 V967	Y892-L959 HydrophobicContact CD1-CD2 4.47Å; T895-L959 HydrophobicContact CG2-CD1 4.05Å; T895-L959 HydrophobicContact CG2-CD2 3.83Å; T895-L959 HydrophobicContact CG2-CG 3.74Å; M896-L959 HydrophobicContact CG-CD2 4.07Å; M896-L959 HydrophobicContact SD-CD1 3.82Å; M896-L959 HydrophobicContact SD-CD2 3.82Å; M896-L959 HydrophobicContact SD-CG 4.45Å; S899-L959 WeakPolarHBondContact OG-CD1 3.28Å; T957-L959 PolarHBondContact O-N 3.32Å; L959-Q963 HydrophobicContact CB-CB 4.2Å; L959-Q963 HydrophobicContact CD2-CB 4.43Å; L959-W964 HydrophobicContact CD1-CZ2 4.36Å; L959-V967 HydrophobicContact CD1-CG2 4.27Å
960	C	93.6	Very high	92.7	Very high	36 Å²	36	47.7 Å²	47.7	24%	0.243	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-81	169.4	172.5	71.6	0	0	0	0	111.9	S962 Q963 W964	C960-S962 PolarHBondContact O-N 3.09Å; C960-S962 PolarHBondContact SG-OG 3.35Å; C960-Q963 PolarHBondContact O-N 2.89Å; C960-Q963 VanDerWaalsContact SG-CG 3.52Å; C960-Q963 PolarHBondContact SG-OE1 2.95Å; C960-Q963 VanDerWaalsContact SG-OE1 3.34Å; C960-W964 PolarHBondContact O-N 3.42Å
961	W	92.8	Very high	93	Very high	199 Å²	199	45.6 Å²	45.6	75%	0.754	23%	0.231	S	C	*	.	H	α-helix	trans	-65.5	-35.8	-175.1	-179.4	-110.1	0	0	0	113.4	W964 V965	W961-W964 HydrophobicContact CE3-CB 4.37Å; W961-W964 PolarHBondContact O-N 3.48Å; W961-V965 HydrophobicContact CZ2-CG2 4.38Å; W961-V965 WeakPolarHBondContact O-CG2 3.44Å; W961-V965 PolarHBondContact O-N 3.02Å
962	S	92.8	Very high	93.3	Very high	64 Å²	64	48.7 Å²	48.7	45%	0.448	25%	0.245	S	C	.	.	H	α-helix	trans	-63.3	-42.2	176.4	46.1	0	0	0	0	111.5	C960 V965 V966	C960-S962 PolarHBondContact O-N 3.09Å; C960-S962 PolarHBondContact SG-OG 3.35Å; S962-V965 WeakPolarHBondContact O-CB 3.35Å; S962-V965 PolarHBondContact O-N 3.03Å; S962-V966 PolarHBondContact O-N 3.06Å
963	Q	94.4	Very high	93.8	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-45.6	173.6	-74.2	162.1	-2.5	0	0	111.5	W851 D856 E858 M896 L959 C960 V965 V966 V967	W851-Q963 HydrophobicContact CZ3-CG 4.34Å; D856-Q963 PolarHBondContact OD2-NE2 2.91Å; E858-Q963 PolarHBondContact OE2-NE2 2.67Å; M896-Q963 HydrophobicContact CE-CB 4.36Å; M896-Q963 HydrophobicContact SD-CB 3.72Å; M896-Q963 HydrophobicContact SD-CG 4.1Å; L959-Q963 HydrophobicContact CB-CB 4.2Å; L959-Q963 HydrophobicContact CD2-CB 4.43Å; C960-Q963 PolarHBondContact O-N 2.89Å; C960-Q963 VanDerWaalsContact SG-CG 3.52Å; C960-Q963 PolarHBondContact SG-OE1 2.95Å; C960-Q963 VanDerWaalsContact SG-OE1 3.34Å; Q963-V965 VanDerWaalsContact C-N 3.31Å; Q963-V965 PolarHBondContact O-N 3.12Å; Q963-V966 WeakPolarHBondContact O-CB 3.38Å; Q963-V966 PolarHBondContact O-N 3.5Å; Q963-V967 WeakPolarHBondContact O-CG2 3.33Å; Q963-V967 PolarHBondContact O-N 2.95Å
964	W	95.5	Very high	94.2	Very high	26 Å²	26	43.9 Å²	43.9	10%	0.098	22%	0.223	C	C	.	.	H	α-helix	trans	-60	-35.9	174.6	-85.5	110.8	0	0	0	113.9	H941 F942 L945 L959 C960 W961 V966 V967 L968	H941-W964 AromaticContact CD2-CH2 3.87Å; H941-W964 AromaticContact NE2-CH2 3.97Å; F942-W964 HydrophobicContact CD1-CZ2 4.2Å; F942-W964 AromaticContact CE1-CE2 3.92Å; F942-W964 AromaticContact CE1-CH2 3.93Å; F942-W964 HydrophobicContact CE1-CH2 3.93Å; F942-W964 AromaticContact CE1-CZ2 3.39Å; F942-W964 HydrophobicContact CE1-CZ2 3.39Å; F942-W964 HydrophobicContact CZ-CH2 4.2Å; F942-W964 HydrophobicContact CZ-CZ2 4.05Å; L945-W964 HydrophobicContact CD1-CZ2 4.02Å; L959-W964 HydrophobicContact CD1-CZ2 4.36Å; C960-W964 PolarHBondContact O-N 3.42Å; W961-W964 HydrophobicContact CE3-CB 4.37Å; W961-W964 PolarHBondContact O-N 3.48Å; W964-V966 VanDerWaalsContact C-N 3.28Å; W964-V966 PolarHBondContact O-N 3.17Å; W964-V967 HydrophobicContact CE3-CB 4.13Å; W964-V967 HydrophobicContact CE3-CG1 4.05Å; W964-V967 HydrophobicContact CE3-CG2 4.44Å; W964-V967 HydrophobicContact CZ3-CG1 3.99Å; W964-V967 WeakPolarHBondContact O-CB 3.22Å; W964-V967 PolarHBondContact O-N 3.28Å; W964-L968 WeakPolarHBondContact O-CG 3.32Å; W964-L968 PolarHBondContact O-N 3Å
965	V	95.5	Very high	94.5	Very high	45 Å²	45	44.9 Å²	44.9	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-62.9	-37.1	174.6	168.9	0	0	0	0	111.1	W961 S962 Q963 K969	W961-V965 HydrophobicContact CZ2-CG2 4.38Å; W961-V965 WeakPolarHBondContact O-CG2 3.44Å; W961-V965 PolarHBondContact O-N 3.02Å; S962-V965 WeakPolarHBondContact O-CB 3.35Å; S962-V965 PolarHBondContact O-N 3.03Å; Q963-V965 VanDerWaalsContact C-N 3.31Å; Q963-V965 PolarHBondContact O-N 3.12Å; V965-K969 HydrophobicContact CG1-CD 4.16Å; V965-K969 WeakPolarHBondContact O-CB 3.44Å; V965-K969 VanDerWaalsContact O-CG 3.29Å; V965-K969 WeakPolarHBondContact O-CG 3.43Å; V965-K969 PolarHBondContact O-N 3.27Å
966	V	95.4	Very high	94.8	Very high	22 Å²	22	48.5 Å²	48.5	13%	0.133	25%	0.249	C	C	.	.	H	α-helix	trans	-67.5	-44.7	174.7	175.5	0	0	0	0	110.8	W851 M896 S962 Q963 W964 L968 K969 I970	W851-V966 HydrophobicContact CD2-CG1 3.93Å; W851-V966 HydrophobicContact CD2-CG2 4.38Å; W851-V966 HydrophobicContact CE3-CG1 4.05Å; W851-V966 HydrophobicContact CE3-CG2 4.46Å; W851-V966 HydrophobicContact CG-CG1 4.35Å; W851-V966 HydrophobicContact CH2-CB 4.47Å; W851-V966 HydrophobicContact CH2-CG2 3.7Å; W851-V966 HydrophobicContact CZ2-CG2 3.59Å; W851-V966 HydrophobicContact CZ3-CB 4.43Å; W851-V966 HydrophobicContact CZ3-CG1 4.44Å; W851-V966 HydrophobicContact CZ3-CG2 4.13Å; M896-V966 HydrophobicContact CE-CB 4.21Å; M896-V966 HydrophobicContact CE-CG1 4.09Å; S962-V966 PolarHBondContact O-N 3.06Å; Q963-V966 WeakPolarHBondContact O-CB 3.38Å; Q963-V966 PolarHBondContact O-N 3.5Å; W964-V966 VanDerWaalsContact C-N 3.28Å; W964-V966 PolarHBondContact O-N 3.17Å; V966-L968 VanDerWaalsContact C-N 3.3Å; V966-L968 PolarHBondContact O-N 3.27Å; V966-K969 PolarHBondContact O-N 3.41Å; V966-K969 VanDerWaalsContact O-N 3.17Å; V966-I970 HydrophobicContact CG1-CD1 3.77Å; V966-I970 HydrophobicContact CG1-CG1 4.39Å; V966-I970 WeakPolarHBondContact O-CG1 3.14Å; V966-I970 PolarHBondContact O-N 3.48Å
967	V	96.6	Very high	94.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-52.6	-49.5	174.5	173.2	0	0	0	0	110.7	M896 S899 V900 T903 L959 Q963 W964 I970 S971	M896-V967 HydrophobicContact CE-CG2 4.07Å; M896-V967 HydrophobicContact SD-CG2 4.02Å; S899-V967 WeakPolarHBondContact O-CG1 3.45Å; V900-V967 HydrophobicContact CG2-CB 4.19Å; V900-V967 HydrophobicContact CG2-CG1 3.99Å; V900-V967 HydrophobicContact CG2-CG2 4.11Å; T903-V967 WeakPolarHBondContact OG1-CG1 3.29Å; L959-V967 HydrophobicContact CD1-CG2 4.27Å; Q963-V967 WeakPolarHBondContact O-CG2 3.33Å; Q963-V967 PolarHBondContact O-N 2.95Å; W964-V967 HydrophobicContact CE3-CB 4.13Å; W964-V967 HydrophobicContact CE3-CG1 4.05Å; W964-V967 HydrophobicContact CE3-CG2 4.44Å; W964-V967 HydrophobicContact CZ3-CG1 3.99Å; W964-V967 WeakPolarHBondContact O-CB 3.22Å; W964-V967 PolarHBondContact O-N 3.28Å; V967-I970 PolarHBondContact O-N 3.5Å; V967-S971 VanDerWaalsContact O-CB 3.27Å; V967-S971 WeakPolarHBondContact O-CB 3.39Å; V967-S971 PolarHBondContact O-N 3.33Å; V967-S971 PolarHBondContact O-OG 3.42Å
968	L	96.1	Very high	94.9	Very high	65 Å²	65	49.9 Å²	49.9	34%	0.34	26%	0.255	S	S	.	.	H	α-helix	trans	-65.2	-41.1	179.2	-70.4	172.9	0	0	0	113.1	T903 W964 V966 I970 S971 I972	T903-L968 HydrophobicContact CG2-CD2 4.18Å; W964-L968 WeakPolarHBondContact O-CG 3.32Å; W964-L968 PolarHBondContact O-N 3Å; V966-L968 VanDerWaalsContact C-N 3.3Å; V966-L968 PolarHBondContact O-N 3.27Å; L968-I970 VanDerWaalsContact C-N 3.32Å; L968-I970 PolarHBondContact O-N 3.03Å; L968-S971 PolarHBondContact O-N 2.97Å; L968-I972 HydrophobicContact CB-CD1 4.33Å; L968-I972 WeakPolarHBondContact O-CB 3.35Å; L968-I972 VanDerWaalsContact O-CG1 3.29Å; L968-I972 WeakPolarHBondContact O-CG1 3.24Å; L968-I972 PolarHBondContact O-N 3.2Å
969	K	95.8	Very high	94.8	Very high	148 Å²	148	49 Å²	49	64%	0.643	25%	0.246	S	C	*	.	H	α-helix	trans	-62.8	-38.5	178.7	-79.2	174.9	178.7	177.7	0	112.5	V965 V966 P973	V965-K969 HydrophobicContact CG1-CD 4.16Å; V965-K969 WeakPolarHBondContact O-CB 3.44Å; V965-K969 VanDerWaalsContact O-CG 3.29Å; V965-K969 WeakPolarHBondContact O-CG 3.43Å; V965-K969 PolarHBondContact O-N 3.27Å; V966-K969 PolarHBondContact O-N 3.41Å; V966-K969 VanDerWaalsContact O-N 3.17Å; K969-P973 VanDerWaalsContact O-CD 3.25Å; K969-P973 WeakPolarHBondContact O-CD 3.46Å; K969-P973 WeakPolarHBondContact O-CG 3.33Å
970	I	95.6	Very high	94.8	Very high	35 Å²	35	51.1 Å²	51.1	18%	0.179	27%	0.265	C	S	.	.	H	α-helix	trans	-75.2	-32.6	176.3	-64.1	173.6	0	0	0	110.5	Y840 A848 V900 V966 V967 L968	Y840-I970 PolarHBondContact OH-O 2.86Å; A848-I970 HydrophobicContact CB-CD1 4.02Å; V900-I970 HydrophobicContact CG1-CG2 3.88Å; V900-I970 HydrophobicContact CG2-CB 4.42Å; V900-I970 HydrophobicContact CG2-CG2 4.39Å; V966-I970 HydrophobicContact CG1-CD1 3.77Å; V966-I970 HydrophobicContact CG1-CG1 4.39Å; V966-I970 WeakPolarHBondContact O-CG1 3.14Å; V966-I970 PolarHBondContact O-N 3.48Å; V967-I970 PolarHBondContact O-N 3.5Å; L968-I970 VanDerWaalsContact C-N 3.32Å; L968-I970 PolarHBondContact O-N 3.03Å
971	S	96.3	Very high	94.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-86.3	-43.1	-171	-53.5	0	0	0	0	114.7	T903 V967 L968 V974	T903-S971 WeakPolarHBondContact CB-OG 3.39Å; T903-S971 VanDerWaalsContact CG2-CB 3.43Å; V967-S971 VanDerWaalsContact O-CB 3.27Å; V967-S971 WeakPolarHBondContact O-CB 3.39Å; V967-S971 PolarHBondContact O-N 3.33Å; V967-S971 PolarHBondContact O-OG 3.42Å; L968-S971 PolarHBondContact O-N 2.97Å; S971-V974 WeakPolarHBondContact O-CG1 3.33Å; S971-V974 PolarHBondContact O-N 3.48Å
972	I	95.8	Very high	94.6	Very high	82 Å²	82	40.7 Å²	40.7	42%	0.421	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-39.1	-175.8	-70.5	167.4	0	0	0	114.4	F907 L968 V974 I975	F907-I972 HydrophobicContact CE2-CB 4.39Å; F907-I972 HydrophobicContact CE2-CG1 3.61Å; F907-I972 HydrophobicContact CZ-CG1 3.8Å; L968-I972 HydrophobicContact CB-CD1 4.33Å; L968-I972 WeakPolarHBondContact O-CB 3.35Å; L968-I972 VanDerWaalsContact O-CG1 3.29Å; L968-I972 WeakPolarHBondContact O-CG1 3.24Å; L968-I972 PolarHBondContact O-N 3.2Å; I972-V974 PolarHBondContact O-N 3.1Å; I972-I975 PolarHBondContact O-N 2.94Å; I972-I975 VanDerWaalsContact O-N 3.12Å
973	P	96.4	Very high	94.4	Very high	47 Å²	47	43.9 Å²	43.9	31%	0.305	23%	0.225	S	C	.	.	H	α-helix	trans	-60.7	-16	-176.9	-23.1	32.7	0	0	0	115	Y840 K969 I975 L976 L977	Y840-P973 WeakPolarHBondContact OH-CB 3.18Å; K969-P973 VanDerWaalsContact O-CD 3.25Å; K969-P973 WeakPolarHBondContact O-CD 3.46Å; K969-P973 WeakPolarHBondContact O-CG 3.33Å; P973-I975 PolarHBondContact O-N 3.01Å; P973-L976 PolarHBondContact O-N 3.31Å; P973-L976 VanDerWaalsContact O-N 3.09Å; P973-L977 PolarHBondContact O-N 2.87Å
974	V	95.1	Very high	94.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.6	-33.3	174.1	76.9	0	0	0	0	112.4	I837 Y840 I904 F907 N911 S971 I972 D978	I837-V974 HydrophobicContact CG2-CG2 4.07Å; Y840-V974 HydrophobicContact CD1-CB 4.13Å; Y840-V974 HydrophobicContact CD1-CG2 4.17Å; Y840-V974 HydrophobicContact CE1-CB 4.01Å; I904-V974 HydrophobicContact CG2-CB 4.15Å; I904-V974 HydrophobicContact CG2-CG1 4.14Å; I904-V974 HydrophobicContact CG2-CG2 3.94Å; F907-V974 HydrophobicContact CB-CG1 3.6Å; F907-V974 HydrophobicContact CD2-CG1 4.45Å; F907-V974 HydrophobicContact CG-CG1 4.49Å; N911-V974 PolarHBondContact ND2-O 2.86Å; S971-V974 WeakPolarHBondContact O-CG1 3.33Å; S971-V974 PolarHBondContact O-N 3.48Å; I972-V974 PolarHBondContact O-N 3.1Å; V974-D978 PolarHBondContact O-N 3.48Å
975	I	94.6	Very high	93.7	Very high	38 Å²	38	46.3 Å²	46.3	20%	0.195	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-46	175.4	-61	178.3	0	0	0	110.1	F907 L919 I972 P973 D978 E979	F907-I975 HydrophobicContact CB-CD1 4.03Å; F907-I975 HydrophobicContact CB-CG1 3.79Å; F907-I975 HydrophobicContact CD1-CD1 3.63Å; F907-I975 HydrophobicContact CD1-CG1 4.36Å; F907-I975 HydrophobicContact CE1-CD1 4.23Å; F907-I975 HydrophobicContact CG-CD1 3.87Å; F907-I975 HydrophobicContact CG-CG1 4.12Å; L919-I975 HydrophobicContact CD1-CG2 3.93Å; I972-I975 PolarHBondContact O-N 2.94Å; I972-I975 VanDerWaalsContact O-N 3.12Å; P973-I975 PolarHBondContact O-N 3.01Å; I975-D978 PolarHBondContact O-N 3.06Å; I975-E979 HydrophobicContact CG2-CG 4.47Å; I975-E979 WeakPolarHBondContact O-CB 3.31Å; I975-E979 WeakPolarHBondContact O-CG 3.39Å; I975-E979 PolarHBondContact O-N 2.95Å
976	L	94.8	Very high	93.1	Very high	122 Å²	122	46.5 Å²	46.5	64%	0.639	24%	0.235	S	C	*	.	H	α-helix	trans	-67.8	-39.7	-178.2	-61.1	177.7	0	0	0	111.3	P973 A980	P973-L976 PolarHBondContact O-N 3.31Å; P973-L976 VanDerWaalsContact O-N 3.09Å; L976-A980 WeakPolarHBondContact O-CB 3.38Å; L976-A980 PolarHBondContact O-N 3.5Å
977	L	94.8	Very high	92.5	Very high	57 Å²	57	49.2 Å²	49.2	30%	0.298	25%	0.249	S	C	.	.	H	α-helix	trans	-58.5	-51.7	174.8	176.6	61.7	0	0	0	110.6	Y840 P973 A980 L981	Y840-L977 HydrophobicContact CD2-CD2 4.42Å; Y840-L977 HydrophobicContact CG-CD2 4.11Å; P973-L977 PolarHBondContact O-N 2.87Å; L977-A980 PolarHBondContact O-N 3.02Å; L977-L981 HydrophobicContact CD1-CD1 4.31Å; L977-L981 HydrophobicContact CG-CD1 4.24Å; L977-L981 WeakPolarHBondContact O-CG 3.43Å; L977-L981 PolarHBondContact O-N 3.2Å; L977-L981 VanDerWaalsContact O-N 3.1Å
978	D	92.9	Very high	91.6	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-68.9	-37.8	-178	-169.1	64.3	0	0	0	113	R833 I837 N911 V974 I975 A980 L981 K982	R833-D978 IonicContact CZ-OD1 3.7Å; R833-D978 IonicContact CZ-OD2 3.08Å; R833-D978 IonicContact NE-OD1 2.68Å; R833-D978 PolarHBondContact NE-OD1 3.34Å; R833-D978 IonicContact NH2-OD1 3.67Å; R833-D978 PolarHBondContact NH2-OD1 3.22Å; R833-D978 IonicContact NH2-OD2 2.73Å; R833-D978 PolarHBondContact NH2-OD2 3.34Å; I837-D978 HydrophobicContact CD1-CB 4.33Å; I837-D978 VanDerWaalsContact CD1-OD1 3.23Å; I837-D978 WeakPolarHBondContact CD1-OD1 3.28Å; N911-D978 HydrophobicContact CB-CB 4.15Å; N911-D978 WeakPolarHBondContact CB-OD2 3.27Å; N911-D978 VanDerWaalsContact ND2-CB 3.28Å; N911-D978 WeakPolarHBondContact ND2-CB 3.42Å; V974-D978 PolarHBondContact O-N 3.48Å; I975-D978 PolarHBondContact O-N 3.06Å; D978-A980 VanDerWaalsContact C-N 3.29Å; D978-A980 PolarHBondContact O-N 3.19Å; D978-L981 PolarHBondContact O-N 3.1Å; D978-L981 VanDerWaalsContact O-N 3.13Å; D978-K982 WeakPolarHBondContact O-CG 3.28Å; D978-K982 PolarHBondContact O-N 3.02Å; D978-K982 WeakPolarHBondContact OD2-CE 3.29Å; D978-K982 IonicContact OD2-NZ 2.78Å
979	E	93.5	Very high	90.5	Very high	33 Å²	33	56.3 Å²	56.3	15%	0.154	28%	0.282	C	S	.	.	H	α-helix	trans	-61.1	-37.9	174.3	-83.7	-62.1	152.8	0	0	112.5	S918 L919 I975 Y983	S918-E979 VanDerWaalsContact CA-OE1 3.29Å; S918-E979 WeakPolarHBondContact CA-OE1 3.47Å; S918-E979 WeakPolarHBondContact CA-OE2 3.43Å; S918-E979 WeakPolarHBondContact CB-OE2 3.46Å; S918-E979 VanDerWaalsContact OG-CD 3.23Å; S918-E979 PolarHBondContact OG-OE1 3.1Å; S918-E979 PolarHBondContact OG-OE2 2.83Å; L919-E979 PolarHBondContact N-OE1 3.46Å; I975-E979 HydrophobicContact CG2-CG 4.47Å; I975-E979 WeakPolarHBondContact O-CB 3.31Å; I975-E979 WeakPolarHBondContact O-CG 3.39Å; I975-E979 PolarHBondContact O-N 2.95Å; E979-Y983 WeakPolarHBondContact O-CB 3.27Å; E979-Y983 PolarHBondContact O-N 3.34Å
980	A	93.3	Very high	88.8	Confident	53 Å²	53	53.6 Å²	53.6	44%	0.438	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-43.6	172.9	0	0	0	0	0	111.5	L976 L977 D978 Y983 I984	L976-A980 WeakPolarHBondContact O-CB 3.38Å; L976-A980 PolarHBondContact O-N 3.5Å; L977-A980 PolarHBondContact O-N 3.02Å; D978-A980 VanDerWaalsContact C-N 3.29Å; D978-A980 PolarHBondContact O-N 3.19Å; A980-Y983 WeakPolarHBondContact O-CB 3.41Å; A980-Y983 PolarHBondContact O-N 3.19Å; A980-I984 WeakPolarHBondContact O-CG1 3.24Å; A980-I984 PolarHBondContact O-N 3.44Å; A980-I984 VanDerWaalsContact O-N 3.07Å
981	L	92	Very high	86.5	Confident	15 Å²	15	57.1 Å²	57.1	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-40.7	177.5	-65.5	170.4	0	0	0	112	W829 R833 A836 I837 L977 D978 I984 S985	W829-L981 HydrophobicContact CH2-CD2 4.19Å; W829-L981 HydrophobicContact CZ2-CD2 4.22Å; R833-L981 HydrophobicContact CB-CD1 4.45Å; R833-L981 HydrophobicContact CG-CB 4.15Å; R833-L981 HydrophobicContact CG-CD1 3.84Å; A836-L981 HydrophobicContact CB-CD1 4.37Å; I837-L981 HydrophobicContact CG1-CD1 4.48Å; L977-L981 HydrophobicContact CD1-CD1 4.31Å; L977-L981 HydrophobicContact CG-CD1 4.24Å; L977-L981 WeakPolarHBondContact O-CG 3.43Å; L977-L981 PolarHBondContact O-N 3.2Å; L977-L981 VanDerWaalsContact O-N 3.1Å; D978-L981 PolarHBondContact O-N 3.1Å; D978-L981 VanDerWaalsContact O-N 3.13Å; L981-I984 PolarHBondContact O-N 3.44Å; L981-S985 PolarHBondContact O-N 3.24Å
982	K	89.4	Confident	84	Confident	1 Å²	1	62.6 Å²	62.6	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-62.7	-40.6	172.4	-73.9	179.3	168.4	-176.8	0	112.1	R833 N911 S914 Q917 D978 I984 S985 R986	R833-K982 VanDerWaalsContact CZ-CG 3.48Å; N911-K982 WeakPolarHBondContact O-CE 3.37Å; N911-K982 PolarHBondContact O-NZ 3.21Å; S914-K982 WeakPolarHBondContact O-CE 3.43Å; S914-K982 PolarHBondContact O-NZ 3.26Å; S914-K982 VanDerWaalsContact O-NZ 3.08Å; Q917-K982 WeakPolarHBondContact O-CD 3.09Å; Q917-K982 PolarHBondContact O-NZ 3.24Å; D978-K982 WeakPolarHBondContact O-CG 3.28Å; D978-K982 PolarHBondContact O-N 3.02Å; D978-K982 WeakPolarHBondContact OD2-CE 3.29Å; D978-K982 IonicContact OD2-NZ 2.78Å; K982-I984 VanDerWaalsContact C-N 3.34Å; K982-I984 PolarHBondContact O-N 3.03Å; K982-S985 WeakPolarHBondContact O-CB 3.39Å; K982-S985 PolarHBondContact O-N 3.24Å; K982-R986 WeakPolarHBondContact O-CG 3.28Å; K982-R986 PolarHBondContact O-N 2.94Å; K982-R986 VanDerWaalsContact O-N 3.1Å
983	Y	89.4	Confident	81.7	Confident	132 Å²	132	66 Å²	66	52%	0.518	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-41.6	176.8	178.8	-88.8	0	0	0	112.1	E979 A980 N987	E979-Y983 WeakPolarHBondContact O-CB 3.27Å; E979-Y983 PolarHBondContact O-N 3.34Å; A980-Y983 WeakPolarHBondContact O-CB 3.41Å; A980-Y983 PolarHBondContact O-N 3.19Å; Y983-N987 WeakPolarHBondContact CE1-ND2 3.5Å; Y983-N987 WeakPolarHBondContact CE2-ND2 3.2Å; Y983-N987 PolarHBondContact O-N 3.06Å; Y983-N987 PolarHBondContact OH-ND2 3.03Å
984	I	89.4	Confident	79.3	Confident	67 Å²	67	69.3 Å²	69.3	34%	0.344	35%	0.346	S	S	.	.	H	α-helix	trans	-62.6	-45.7	174.9	-66.1	165.8	0	0	0	110.5	W829 A980 L981 K982 R986 N987 H988	W829-I984 HydrophobicContact CH2-CB 4.38Å; W829-I984 HydrophobicContact CH2-CD1 4.46Å; W829-I984 HydrophobicContact CH2-CG2 3.79Å; W829-I984 HydrophobicContact CZ2-CB 4.02Å; W829-I984 HydrophobicContact CZ2-CG2 3.71Å; A980-I984 WeakPolarHBondContact O-CG1 3.24Å; A980-I984 PolarHBondContact O-N 3.44Å; A980-I984 VanDerWaalsContact O-N 3.07Å; L981-I984 PolarHBondContact O-N 3.44Å; K982-I984 VanDerWaalsContact C-N 3.34Å; K982-I984 PolarHBondContact O-N 3.03Å; I984-R986 PolarHBondContact O-N 3.02Å; I984-N987 PolarHBondContact O-N 3.27Å; I984-H988 PolarHBondContact O-N 3.24Å
985	S	85	Confident	76.7	Confident	9 Å²	9	74.4 Å²	74.4	6%	0.063	37%	0.368	C	S	.	.	H	α-helix	trans	-52.6	-53.4	178.2	-158.1	0	0	0	0	112.1	N916 L981 K982 N987 L989 E990	N916-S985 WeakPolarHBondContact OD1-CB 3.14Å; N916-S985 PolarHBondContact OD1-OG 3.04Å; L981-S985 PolarHBondContact O-N 3.24Å; K982-S985 WeakPolarHBondContact O-CB 3.39Å; K982-S985 PolarHBondContact O-N 3.24Å; S985-N987 PolarHBondContact O-N 3.16Å; S985-L989 PolarHBondContact O-N 3.37Å; S985-E990 PolarHBondContact O-N 3.16Å
986	R	83	Confident	74.2	Confident	49 Å²	49	79.7 Å²	79.7	19%	0.185	39%	0.39	C	S	.	.	H	α-helix	trans	-65.1	-39.3	-176.9	-67.4	-174.8	-60.6	-99.7	2	114	N916 S918 K982 I984	N916-R986 HydrophobicContact CB-CG 4.24Å; N916-R986 WeakPolarHBondContact O-CD 3.39Å; N916-R986 WeakPolarHBondContact O-CG 3.2Å; N916-R986 PolarHBondContact O-NH1 3.38Å; S918-R986 VanDerWaalsContact N-NH1 3.14Å; K982-R986 WeakPolarHBondContact O-CG 3.28Å; K982-R986 PolarHBondContact O-N 2.94Å; K982-R986 VanDerWaalsContact O-N 3.1Å; I984-R986 PolarHBondContact O-N 3.02Å
987	N	82.4	Confident	71.8	Confident	80 Å²	80	79.5 Å²	79.5	43%	0.428	38%	0.382	S	S	.	.	H	α-helix	trans	-97.8	-19.1	-168.1	-69.2	-20	0	0	0	114.3	Y983 I984 S985	Y983-N987 WeakPolarHBondContact CE1-ND2 3.5Å; Y983-N987 WeakPolarHBondContact CE2-ND2 3.2Å; Y983-N987 PolarHBondContact O-N 3.06Å; Y983-N987 PolarHBondContact OH-ND2 3.03Å; I984-N987 PolarHBondContact O-N 3.27Å; S985-N987 PolarHBondContact O-N 3.16Å
988	H	77.8	Confident	69.1	Low	138 Å²	138	84.4 Å²	84.4	64%	0.639	40%	0.396	S	S	*	.	H	α-helix	trans	-128.2	-7.8	-171.5	-61.3	80.8	0	0	0	114.2	I984	I984-H988 PolarHBondContact O-N 3.24Å
989	L	72.9	Confident	66.4	Low	75 Å²	75	93.1 Å²	93.1	39%	0.393	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-33.8	-175.2	-66.2	171.7	0	0	0	114.7	W829 S985 D991	W829-L989 HydrophobicContact CB-CD1 4.09Å; W829-L989 HydrophobicContact CD2-CD1 3.42Å; W829-L989 VanDerWaalsContact CD2-CD1 3.42Å; W829-L989 HydrophobicContact CE3-CD1 4.04Å; W829-L989 HydrophobicContact CG-CD1 3.41Å; W829-L989 VanDerWaalsContact CG-CD1 3.41Å; W829-L989 HydrophobicContact CZ2-CD1 4.29Å; S985-L989 PolarHBondContact O-N 3.37Å; L989-D991 VanDerWaalsContact C-N 3.32Å; L989-D991 PolarHBondContact O-N 3.01Å
990	E	60	Low	63.8	Low	91 Å²	91	100.6 Å²	100.6	43%	0.425	46%	0.456	S	S	.	.	H	α-helix	trans	-68.2	-24.5	-176.4	-77.8	179	162.1	0	0	114.4	N916 S985 D992	N916-E990 PolarHBondContact ND2-OE1 3.03Å; S985-E990 PolarHBondContact O-N 3.16Å; E990-D992 VanDerWaalsContact C-N 3.29Å; E990-D992 PolarHBondContact O-N 2.8Å
991	D	47.2	Very low	61.2	Low	109 Å²	109	105.2 Å²	105.2	58%	0.583	46%	0.462	S	S	*	.	H	α-helix	trans	-73	-12.8	-170.2	-127	-28.4	0	0	0	115	L989 K995	L989-D991 VanDerWaalsContact C-N 3.32Å; L989-D991 PolarHBondContact O-N 3.01Å; D991-K995 WeakPolarHBondContact O-CD 3.08Å; D991-K995 WeakPolarHBondContact O-CG 3.38Å; D991-K995 PolarHBondContact O-NZ 3.49Å; D991-K995 IonicContact OD1-NZ 3.8Å; D991-K995 PolarHBondContact OD1-NZ 3.02Å
992	D	44.2	Very low	58.5	Low	116 Å²	116	112.4 Å²	112.4	62%	0.62	50%	0.495	S	S	*	.	H	α-helix	trans	-103.4	-29.3	-173.1	-100.5	-9.4	0	0	0	114.5	E990 K996	E990-D992 VanDerWaalsContact C-N 3.29Å; E990-D992 PolarHBondContact O-N 2.8Å; D992-K996 PolarHBondContact O-N 3.26Å
993	E	48	Very low	55.7	Low	153 Å²	153	119.8 Å²	119.8	72%	0.715	53%	0.53	S	S	*	.	H	α-helix	trans	-78.5	-45.3	-179	-77.6	-107.3	134.7	0	0	111.8	K995 K996 Y997	E993-K995 VanDerWaalsContact C-N 3.29Å; E993-K995 PolarHBondContact O-N 3.15Å; E993-K996 PolarHBondContact O-N 2.04Å; E993-K996 VanDerWaalsContact O-N 3.14Å; E993-Y997 PolarHBondContact O-N 3.2Å
994	E	45.8	Very low	52.9	Low	116 Å²	116	122.9 Å²	122.9	54%	0.542	56%	0.555	S	S	.	*	H	α-helix	trans	-63.2	-36.3	-179.8	-133.7	-161.7	140.7	0	0	111.6	R998	E994-R998 WeakPolarHBondContact O-CG 3.44Å; E994-R998 PolarHBondContact O-N 3.31Å; E994-R998 VanDerWaalsContact O-N 3.1Å; E994-R998 IonicContact OE1-CZ 3.36Å; E994-R998 IonicContact OE1-NE 2.78Å; E994-R998 IonicContact OE1-NH2 2.72Å; E994-R998 PolarHBondContact OE1-NH2 3.13Å
995	K	40.3	Very low	51.1	Low	108 Å²	108	125.7 Å²	125.7	47%	0.47	57%	0.566	S	S	.	*	H	α-helix	trans	-68.8	-36.3	175.3	-73.2	-175	-169.1	109	0	112.8	D991 E993 R999	D991-K995 WeakPolarHBondContact O-CD 3.08Å; D991-K995 WeakPolarHBondContact O-CG 3.38Å; D991-K995 PolarHBondContact O-NZ 3.49Å; D991-K995 IonicContact OD1-NZ 3.8Å; D991-K995 PolarHBondContact OD1-NZ 3.02Å; E993-K995 VanDerWaalsContact C-N 3.29Å; E993-K995 PolarHBondContact O-N 3.15Å; K995-R999 WeakPolarHBondContact O-CG 3.49Å
996	K	43.2	Very low	49.3	Very low	149 Å²	149	131.8 Å²	131.8	65%	0.648	59%	0.592	S	S	*	*	H	α-helix	trans	-70.5	-38.8	176.7	-86.8	176.1	179.1	167.1	0	111.9	D992 E993 R1000	D992-K996 PolarHBondContact O-N 3.26Å; E993-K996 PolarHBondContact O-N 2.04Å; E993-K996 VanDerWaalsContact O-N 3.14Å; K996-R1000 PolarHBondContact O-N 3.14Å
997	Y	44.3	Very low	47.5	Very low	118 Å²	118	136.4 Å²	136.4	46%	0.463	62%	0.615	S	S	.	*	H	α-helix	trans	-74.7	-44.5	-178.2	-158.3	-86.2	0	0	0	112.7	P817 E993 R999 R1000 W1001	P817-Y997 HydrophobicContact CB-CE1 4.19Å; P817-Y997 HydrophobicContact CG-CD1 4.39Å; P817-Y997 HydrophobicContact CG-CE1 3.66Å; E993-Y997 PolarHBondContact O-N 3.2Å; Y997-R999 PolarHBondContact O-N 3.32Å; Y997-R1000 PolarHBondContact O-N 3Å; Y997-W1001 AromaticContact CE1-CD1 3.68Å; Y997-W1001 PolarHBondContact O-N 2.97Å
998	R	37.3	Very low	45.4	Very low	160 Å²	160	139.8 Å²	139.8	60%	0.604	63%	0.626	S	S	*	*	H	α-helix	trans	-56.4	-34.6	174.6	-75.5	-174.1	-167.1	-156.5	6.1	112.8	E994 Q1002	E994-R998 WeakPolarHBondContact O-CG 3.44Å; E994-R998 PolarHBondContact O-N 3.31Å; E994-R998 VanDerWaalsContact O-N 3.1Å; E994-R998 IonicContact OE1-CZ 3.36Å; E994-R998 IonicContact OE1-NE 2.78Å; E994-R998 IonicContact OE1-NH2 2.72Å; E994-R998 PolarHBondContact OE1-NH2 3.13Å; R998-Q1002 WeakPolarHBondContact O-CG 3.43Å; R998-Q1002 PolarHBondContact O-N 3.12Å
999	R	35.9	Very low	43.4	Very low	184 Å²	184	139.9 Å²	139.9	69%	0.694	63%	0.625	S	S	*	*	H	α-helix	trans	-68.5	-33.7	175.5	-77.8	-179.9	179.8	-175.8	2.3	113.6	K995 Y997 Q1003	K995-R999 WeakPolarHBondContact O-CG 3.49Å; Y997-R999 PolarHBondContact O-N 3.32Å; R999-Q1003 WeakPolarHBondContact O-CG 3.07Å
1000	R	39.1	Very low	41.4	Very low	190 Å²	190	144.2 Å²	144.2	72%	0.717	64%	0.641	S	S	*	*	H	α-helix	trans	-75	-38.6	176.2	-92.9	-178.3	169.8	176.8	-3.1	112.3	K996 Y997 Q1003	K996-R1000 PolarHBondContact O-N 3.14Å; Y997-R1000 PolarHBondContact O-N 3Å; R1000-Q1003 PolarHBondContact O-N 3.03Å
1001	W	39.3	Very low	40.1	Very low	149 Å²	149	148 Å²	148	56%	0.564	66%	0.656	S	S	*	*	H	α-helix	trans	-72.4	-29.5	-178.9	-136.2	91.4	0	0	0	113	Y997 Q1003	Y997-W1001 AromaticContact CE1-CD1 3.68Å; Y997-W1001 PolarHBondContact O-N 2.97Å; W1001-Q1003 PolarHBondContact O-N 3.43Å
1002	Q	34.1	Very low	39.5	Very low	166 Å²	166	151 Å²	151	78%	0.776	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-10.3	172.7	-73.9	179.4	-15.1	0	0	114	R998	R998-Q1002 WeakPolarHBondContact O-CG 3.43Å; R998-Q1002 PolarHBondContact O-N 3.12Å
1003	Q	30.3	Very low	39.2	Very low	157 Å²	157	153.9 Å²	153.9	73%	0.734	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-11	-177.4	-77.2	-178	-14.8	0	0	114.1	R999 R1000 W1001	R999-Q1003 WeakPolarHBondContact O-CG 3.07Å; R1000-Q1003 PolarHBondContact O-N 3.03Å; W1001-Q1003 PolarHBondContact O-N 3.43Å
1004	N	32.6	Very low	38.4	Very low	197 Å²	197	154 Å²	154	100%	1.053	66%	0.66	S	S	*	*			trans	-113.4	0	175.3	-75.8	-20.8	0	0	0	110.2

Retrieved 1,004 of 1,004 residues in 1066.5 ms (Link to these results)

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