A0A5K4F3J7_SCHMA Loading...

ANF_receptor domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F3J7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,185 aa.

						>A0A5K4F3J7_SCHMA|A0A5K4F3J7
MIAYHSLILLVLLHRSVCLEFTIGALLSDDEVISSFKRMVSSVRDSFYDDTVTFKAAGEALALNALKATNQVCNLFNSSEGRIFALIISHPNGAPGSAPLSVSFTCAFYHLPVIGVSARHSIFSDKYSHGSFLRTVPPFSNEASIWVDLIKAFGWREVCVIHSDDHDAKKVLSYLESASQRGIDFKITRQVAINTDEEDAAQMKDFISLLQPVRNEQTRVILLFLRRKFAEYVFLAARKLGMLEAEWAWIVTEQALDASNIPNGVIGVRLLQVTELDHVADAVRIATQSILHLVRTDYDAMKHLHSVKACSDNPSEIQSKSKLPGRSPYMWKDYATKLFRDMLAMNFTDGRTGHLEFNEYGDRIKPIYDIVNAQITNQDINNLSAQKSFEFERPTLVSVGSYGVHQPTPMEWISDEPHPSLLSINLSKLIWPGNSIVKRQQLVCIQRANDGKCQKTEKRLVHAAPISFKKKTHLKVVTIESVPFVQTHPKLSDKCNESDDPLVFKTEIECTHTDPTTGIKKHYCCYGYCIDLLRLLANRTGLELTSTPFTYDLHLVGDGQVGDVDENETHKWTGIIGEILSGTADLAVAPVSITPERAARVEFTKPFKYLGITILVKRERARSNLGSFLQPFESSLWVLVALSVHVVAFVLYLLDHFSPFGRTNSDLDMSVDGSGSYSTLRQFDNEKQLNDKNTLTLTHLRQQQQQKEDEEGMNLSSAVYFAWAVLLNSGIGEGTPHSFSARVLGMVWAGFAMIIVASYTANLAAFLVLDRPEASISGIDDVRLRNPQKDFLFATIRGSPVEMYFKRQVEFATMYRVMETNNYDSVEEAIQAIKSGTLKAFIWDSARLNYEVSIDCELITAGEVFGRNSYGLVMKKNNPWLYELSQAVLNFHERGIMETLDTKWIHIKSNNCERTESSPATLGLTNMAGVFIMIGMGLAAGAILTFVEVLCAKRRCEQKKKHELSTATMQQWRDTVQKRQNDRYFLNATDKQMQLCHNTEISFDDVIHHSVAIDKNNLNSSAIYSTNMKDKQSNNPKPNFSMNMKEKYSVIEDDLLSTKGRINRKRKASDYSCDGNDDSDDGDNDALDSSLSFALHASQNNLKQIGEKYCVTTYRCDQVNNYENNDKVELEKEQEQVGQEGYEEEEEEEEEEEFSELIHRSGTVTTHNNMNNINHYQKSNIISAV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	51.3	Low	61.2	Low	198 Å²	198	121.2 Å²	121.2	98%	0.975	64%	0.638	S	S	*	*				0	-57.7	0	-91.7	177.9	166.1	0	0	113.9	A3 Y4 H5	M1-A3 PolarHBondContact O-N 3.26Å; M1-Y4 WeakPolarHBondContact O-CA 3.43Å; M1-Y4 WeakPolarHBondContact O-CB 3.39Å; M1-Y4 PolarHBondContact O-N 3.4Å; M1-H5 PolarHBondContact O-N 3.31Å
2	I	60.7	Low	60.6	Low	145 Å²	145	122.5 Å²	122.5	74%	0.744	65%	0.645	S	S	*	*	H	α-helix	trans	-56.9	-41.4	-173	-60.1	170.2	0	0	0	113.7	Y4 H5 S6	I2-Y4 VanDerWaalsContact C-N 3.34Å; I2-Y4 PolarHBondContact O-N 3.44Å; I2-H5 PolarHBondContact O-N 3.09Å; I2-S6 PolarHBondContact O-N 3.21Å; I2-S6 PolarHBondContact O-OG 3.42Å
3	A	61.3	Low	59.8	Low	80 Å²	80	122.5 Å²	122.5	66%	0.661	64%	0.644	S	S	*	*	H	α-helix	trans	-63.7	-37	174.4	0	0	0	0	0	113.1	M1 S6 L7	M1-A3 PolarHBondContact O-N 3.26Å; A3-S6 PolarHBondContact O-N 2.98Å; A3-L7 PolarHBondContact O-N 3.3Å
4	Y	63.7	Low	58.7	Low	177 Å²	177	126.1 Å²	126.1	69%	0.694	66%	0.656	S	S	*	*	H	α-helix	trans	-69.7	-40.4	177.1	-124.9	-90.3	0	0	0	111.5	M1 I2 S6 L7 I8	M1-Y4 WeakPolarHBondContact O-CA 3.43Å; M1-Y4 WeakPolarHBondContact O-CB 3.39Å; M1-Y4 PolarHBondContact O-N 3.4Å; I2-Y4 VanDerWaalsContact C-N 3.34Å; I2-Y4 PolarHBondContact O-N 3.44Å; Y4-S6 VanDerWaalsContact C-N 3.35Å; Y4-L7 PolarHBondContact O-N 3.15Å; Y4-I8 HydrophobicContact CD1-CD1 3.91Å; Y4-I8 WeakPolarHBondContact O-CB 3.49Å; Y4-I8 VanDerWaalsContact O-CG1 3.28Å; Y4-I8 WeakPolarHBondContact O-CG1 3.5Å; Y4-I8 PolarHBondContact O-N 3.36Å
5	H	66	Low	57.9	Low	131 Å²	131	132.6 Å²	132.6	61%	0.606	67%	0.668	S	S	*	*	H	α-helix	trans	-64.8	-37.2	171.5	-94.4	-70.7	0	0	0	112.4	M1 I2 I8 L9	M1-H5 PolarHBondContact O-N 3.31Å; I2-H5 PolarHBondContact O-N 3.09Å; H5-I8 PolarHBondContact O-N 3.22Å; H5-L9 VanDerWaalsContact O-CB 3.31Å; H5-L9 WeakPolarHBondContact O-CB 3.49Å; H5-L9 PolarHBondContact O-N 3.42Å
6	S	61.9	Low	57.7	Low	63 Å²	63	131.1 Å²	131.1	44%	0.441	67%	0.674	S	S	.	*	H	α-helix	trans	-67.5	-39.3	176	-56.5	0	0	0	0	111.8	I2 A3 Y4 L9 L10	I2-S6 PolarHBondContact O-N 3.21Å; I2-S6 PolarHBondContact O-OG 3.42Å; A3-S6 PolarHBondContact O-N 2.98Å; Y4-S6 VanDerWaalsContact C-N 3.35Å; S6-L9 PolarHBondContact O-N 3.31Å; S6-L10 WeakPolarHBondContact O-CB 3.22Å; S6-L10 PolarHBondContact O-N 3.29Å
7	L	63.9	Low	57.9	Low	118 Å²	118	128.9 Å²	128.9	62%	0.618	67%	0.668	S	S	*	*	H	α-helix	trans	-66.4	-44.3	174.4	-135.2	89.4	0	0	0	111.6	A3 Y4 L9 L10 V11	A3-L7 PolarHBondContact O-N 3.3Å; Y4-L7 PolarHBondContact O-N 3.15Å; L7-L9 VanDerWaalsContact C-N 3.34Å; L7-L9 PolarHBondContact O-N 3.25Å; L7-L10 PolarHBondContact O-N 3.17Å; L7-V11 VanDerWaalsContact O-CG2 3.32Å; L7-V11 WeakPolarHBondContact O-CG2 3.37Å; L7-V11 PolarHBondContact O-N 3.07Å
8	I	64.3	Low	58.7	Low	79 Å²	79	124.9 Å²	124.9	41%	0.405	65%	0.652	S	S	.	*	H	α-helix	trans	-64.9	-37.7	176.7	-70.8	167.8	0	0	0	110.9	Y4 H5 V11 L12	Y4-I8 HydrophobicContact CD1-CD1 3.91Å; Y4-I8 WeakPolarHBondContact O-CB 3.49Å; Y4-I8 VanDerWaalsContact O-CG1 3.28Å; Y4-I8 WeakPolarHBondContact O-CG1 3.5Å; Y4-I8 PolarHBondContact O-N 3.36Å; H5-I8 PolarHBondContact O-N 3.22Å; I8-V11 PolarHBondContact O-N 3.3Å; I8-L12 HydrophobicContact CG2-CD1 3.73Å; I8-L12 HydrophobicContact CG2-CG 4.28Å; I8-L12 WeakPolarHBondContact O-CB 3.37Å; I8-L12 VanDerWaalsContact O-CG 3.27Å; I8-L12 WeakPolarHBondContact O-CG 3.44Å; I8-L12 PolarHBondContact O-N 2.97Å
9	L	60.6	Low	59.8	Low	112 Å²	112	118.6 Å²	118.6	59%	0.586	62%	0.619	S	S	*	*	H	α-helix	trans	-67.4	-37.2	174.7	-150.1	82.7	0	0	0	111.7	H5 S6 L7 L13	H5-L9 VanDerWaalsContact O-CB 3.31Å; H5-L9 WeakPolarHBondContact O-CB 3.49Å; H5-L9 PolarHBondContact O-N 3.42Å; S6-L9 PolarHBondContact O-N 3.31Å; L7-L9 VanDerWaalsContact C-N 3.34Å; L7-L9 PolarHBondContact O-N 3.25Å; L9-L13 HydrophobicContact CD2-CD1 4.33Å; L9-L13 HydrophobicContact CG-CD1 4.25Å; L9-L13 WeakPolarHBondContact O-CB 3.38Å; L9-L13 WeakPolarHBondContact O-CD1 3.48Å; L9-L13 VanDerWaalsContact O-CG 3.24Å; L9-L13 WeakPolarHBondContact O-CG 3.49Å; L9-L13 PolarHBondContact O-N 3.18Å
10	L	59	Low	61.1	Low	125 Å²	125	116.2 Å²	116.2	65%	0.654	61%	0.605	S	S	*	*	H	α-helix	trans	-67.5	-36.6	173.4	-98.9	150.9	0	0	0	112.9	S6 L7	S6-L10 WeakPolarHBondContact O-CB 3.22Å; S6-L10 PolarHBondContact O-N 3.29Å; L7-L10 PolarHBondContact O-N 3.17Å
11	V	60.3	Low	62.4	Low	105 Å²	105	110.7 Å²	110.7	64%	0.636	58%	0.576	S	S	*	*	H	α-helix	trans	-71.9	-38.4	174.9	170.7	0	0	0	0	111.3	L7 I8 H14	L7-V11 VanDerWaalsContact O-CG2 3.32Å; L7-V11 WeakPolarHBondContact O-CG2 3.37Å; L7-V11 PolarHBondContact O-N 3.07Å; I8-V11 PolarHBondContact O-N 3.3Å; V11-H14 WeakPolarHBondContact O-CB 3.33Å; V11-H14 PolarHBondContact O-N 3.19Å
12	L	54.7	Low	64.3	Low	137 Å²	137	101.7 Å²	101.7	72%	0.717	53%	0.532	S	S	*	.	H	α-helix	trans	-77.2	-19.7	175.2	-68.7	172.8	0	0	0	113.6	I8	I8-L12 HydrophobicContact CG2-CD1 3.73Å; I8-L12 HydrophobicContact CG2-CG 4.28Å; I8-L12 WeakPolarHBondContact O-CB 3.37Å; I8-L12 VanDerWaalsContact O-CG 3.27Å; I8-L12 WeakPolarHBondContact O-CG 3.44Å; I8-L12 PolarHBondContact O-N 2.97Å
13	L	49.4	Very low	65.9	Low	122 Å²	122	94.8 Å²	94.8	64%	0.639	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	6.1	170.1	-78.9	167.3	0	0	0	113.4	L9 R15	L9-L13 HydrophobicContact CD2-CD1 4.33Å; L9-L13 HydrophobicContact CG-CD1 4.25Å; L9-L13 WeakPolarHBondContact O-CB 3.38Å; L9-L13 WeakPolarHBondContact O-CD1 3.48Å; L9-L13 VanDerWaalsContact O-CG 3.24Å; L9-L13 WeakPolarHBondContact O-CG 3.49Å; L9-L13 PolarHBondContact O-N 3.18Å; L13-R15 PolarHBondContact O-N 3.07Å
14	H	44.3	Very low	67.4	Low	174 Å²	174	91 Å²	91	81%	0.806	47%	0.465	S	S	*	.			trans	-75.2	61.7	166.1	-135.8	49.7	0	0	0	110.8	V11 S16	V11-H14 WeakPolarHBondContact O-CB 3.33Å; V11-H14 PolarHBondContact O-N 3.19Å; H14-S16 PolarHBondContact O-N 3.19Å; H14-S16 VanDerWaalsContact O-N 3.15Å
15	R	47.3	Very low	68.9	Low	223 Å²	223	82.5 Å²	82.5	84%	0.842	43%	0.432	S	S	*	.			trans	-56.5	115	175.8	-160.7	178.4	-166.7	-176.2	3.7	107.8	L13 V17	L13-R15 PolarHBondContact O-N 3.07Å; R15-V17 PolarHBondContact O-N 3.01Å
16	S	54.8	Low	70.2	Confident	108 Å²	108	76.3 Å²	76.3	76%	0.755	40%	0.403	S	S	*	.			trans	-51.7	112.2	178.1	16.6	0	0	0	0	109.3	H14 C18	H14-S16 PolarHBondContact O-N 3.19Å; H14-S16 VanDerWaalsContact O-N 3.15Å; S16-C18 PolarHBondContact O-N 3.27Å
17	V	61.1	Low	71.7	Confident	95 Å²	95	73.3 Å²	73.3	58%	0.576	38%	0.382	S	S	*	.			trans	-74.4	102.4	178.6	178.3	0	0	0	0	107.1	R15 L19	R15-V17 PolarHBondContact O-N 3.01Å; V17-L19 PolarHBondContact O-N 2.76Å
18	C	71.4	Confident	72.9	Confident	57 Å²	57	68.1 Å²	68.1	39%	0.385	36%	0.356	S	S	.	.			trans	-60.1	125.7	172.6	-166.4	0	0	0	0	109.1	S16 D50 T53	S16-C18 PolarHBondContact O-N 3.27Å; C18-D50 PolarHBondContact SG-O 3.19Å; C18-T53 WeakPolarHBondContact SG-CG2 3.34Å
19	L	80.1	Confident	74	Confident	5 Å²	5	67.8 Å²	67.8	3%	0.026	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	138.3	175.8	-64.7	179.9	0	0	0	109.2	V17 F21 T51 V52 T53 V294 Y298 K302	V17-L19 PolarHBondContact O-N 2.76Å; L19-F21 HydrophobicContact CB-CE2 3.81Å; L19-F21 HydrophobicContact CB-CZ 4.1Å; L19-F21 HydrophobicContact CD1-CE2 4.36Å; L19-F21 HydrophobicContact CD1-CZ 4.2Å; L19-T51 WeakPolarHBondContact CB-O 3.28Å; L19-T51 PolarHBondContact N-O 3.26Å; L19-V52 HydrophobicContact CB-CG2 4.49Å; L19-V52 CarbonylContact O-C 3.59Å; L19-T53 PolarHBondContact O-N 3.45Å; L19-T53 PolarHBondContact O-OG1 3.24Å; L19-V294 HydrophobicContact CD1-CG1 4.31Å; L19-Y298 HydrophobicContact CD1-CD2 4Å; L19-Y298 HydrophobicContact CD1-CE2 3.46Å; L19-Y298 VanDerWaalsContact CD1-CE2 3.46Å; L19-Y298 HydrophobicContact CG-CE2 4.35Å; L19-K302 HydrophobicContact CD2-CB 3.81Å; L19-K302 HydrophobicContact CD2-CD 4.4Å; L19-K302 HydrophobicContact CD2-CG 3.78Å
20	E	85.1	Confident	75.4	Confident	70 Å²	70	68 Å²	68	33%	0.327	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.3	-178.6	-166	-176.1	94	0	0	109.8	T53 K55	E20-T53 WeakPolarHBondContact CA-O 3.37Å; E20-K55 HydrophobicContact CG-CD 4.19Å; E20-K55 HydrophobicContact CG-CG 4.14Å; E20-K55 VanDerWaalsContact OE1-CD 3.3Å; E20-K55 WeakPolarHBondContact OE1-CD 3.37Å; E20-K55 VanDerWaalsContact OE1-CE 3.24Å; E20-K55 WeakPolarHBondContact OE1-CE 3.17Å; E20-K55 IonicContact OE1-NZ 3.75Å; E20-K55 PolarHBondContact OE1-NZ 2.85Å; E20-K55 WeakPolarHBondContact OE2-CE 3.39Å; E20-K55 IonicContact OE2-NZ 2.66Å; E20-K55 PolarHBondContact OE2-NZ 3.41Å
21	F	89	Confident	77	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.2	178.3	-58.7	-72.6	0	0	0	109.7	L19 V52 T53 F54 K55 F84 I290 V294 M301	L19-F21 HydrophobicContact CB-CE2 3.81Å; L19-F21 HydrophobicContact CB-CZ 4.1Å; L19-F21 HydrophobicContact CD1-CE2 4.36Å; L19-F21 HydrophobicContact CD1-CZ 4.2Å; F21-V52 HydrophobicContact CD2-CG1 3.71Å; F21-V52 HydrophobicContact CE2-CG1 3.79Å; F21-T53 PolarHBondContact N-O 3.38Å; F21-F54 HydrophobicContact CB-CD1 3.97Å; F21-F54 HydrophobicContact CB-CE1 4Å; F21-F54 HydrophobicContact CD2-CE1 4.42Å; F21-F54 CarbonylContact O-C 3.5Å; F21-F54 VanDerWaalsContact O-CA 3.29Å; F21-F54 WeakPolarHBondContact O-CA 3.28Å; F21-K55 PolarHBondContact O-N 3.29Å; F21-F84 HydrophobicContact CB-CD2 4.44Å; F21-F84 AromaticContact CD1-CD2 3.75Å; F21-F84 HydrophobicContact CD1-CD2 3.75Å; F21-F84 HydrophobicContact CD1-CE1 4.32Å; F21-F84 AromaticContact CD1-CE2 3.54Å; F21-F84 HydrophobicContact CD1-CE2 3.54Å; F21-F84 HydrophobicContact CD1-CG 4.28Å; F21-F84 AromaticContact CD1-CZ 3.85Å; F21-F84 HydrophobicContact CD1-CZ 3.85Å; F21-F84 HydrophobicContact CE1-CE1 4.35Å; F21-F84 HydrophobicContact CE1-CE2 4.09Å; F21-F84 AromaticContact CE1-CZ 3.94Å; F21-F84 HydrophobicContact CE1-CZ 3.94Å; F21-I290 HydrophobicContact CB-CG2 4.34Å; F21-I290 HydrophobicContact CD1-CG2 4.24Å; F21-I290 HydrophobicContact CD2-CG2 3.88Å; F21-I290 HydrophobicContact CE2-CG2 4.25Å; F21-I290 HydrophobicContact CG-CG2 3.89Å; F21-V294 HydrophobicContact CE1-CG2 4.49Å; F21-V294 HydrophobicContact CE2-CG2 3.62Å; F21-V294 HydrophobicContact CZ-CG2 3.53Å; F21-M301 HydrophobicContact CD1-CE 4.45Å; F21-M301 HydrophobicContact CE1-CB 4.44Å; F21-M301 HydrophobicContact CE1-CE 3.82Å; F21-M301 HydrophobicContact CZ-CB 4.17Å; F21-M301 HydrophobicContact CZ-CE 4.16Å
22	T	91.4	Very high	78.5	Confident	9 Å²	9	65.5 Å²	65.5	6%	0.055	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134	176.9	-55.3	0	0	0	0	110.1	K55 A57 R82 I83 F84	T22-K55 WeakPolarHBondContact CA-O 3.38Å; T22-K55 HydrophobicContact CG2-CB 4.45Å; T22-A57 HydrophobicContact CG2-CB 3.84Å; T22-R82 WeakPolarHBondContact CA-O 3.44Å; T22-R82 VanDerWaalsContact CB-O 3.25Å; T22-R82 WeakPolarHBondContact CB-O 3.32Å; T22-R82 PolarHBondContact N-O 2.93Å; T22-I83 WeakPolarHBondContact O-CA 3.32Å; T22-F84 PolarHBondContact O-N 2.9Å
23	I	93.6	Very high	80.3	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.4	166.4	-60	174.2	0	0	0	106.9	F36 F54 K55 A57 I87 A286 T287 I290	I23-F36 HydrophobicContact CB-CZ 4.35Å; I23-F36 HydrophobicContact CG2-CE2 4.02Å; I23-F36 HydrophobicContact CG2-CZ 3.97Å; I23-F54 HydrophobicContact CD1-CD1 4.2Å; I23-K55 PolarHBondContact N-O 2.96Å; I23-A57 PolarHBondContact O-N 3.44Å; I23-I87 HydrophobicContact CG2-CD1 4.2Å; I23-I87 HydrophobicContact CG2-CG1 4.28Å; I23-A286 HydrophobicContact CD1-CB 4Å; I23-T287 HydrophobicContact CD1-CG2 3.5Å; I23-T287 VanDerWaalsContact CD1-CG2 3.5Å; I23-I290 HydrophobicContact CG1-CD1 4.41Å
24	G	93.8	Very high	82.4	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	151.6	173.7	0	0	0	0	0	111.4	A57 A85 L86 I87	G24-A57 CarbonylContact C-O 3.59Å; G24-A57 VanDerWaalsContact CA-O 3.25Å; G24-A57 WeakPolarHBondContact CA-O 3.4Å; G24-A85 PolarHBondContact N-O 3.41Å; G24-L86 WeakPolarHBondContact O-CA 3.34Å; G24-I87 PolarHBondContact O-N 2.98Å
25	A	94.7	Very high	84.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	136.4	166.5	0	0	0	0	0	112.5	L27 F36 A57 G58 E59 I87	A25-L27 HydrophobicContact CB-CD1 3.91Å; A25-L27 HydrophobicContact CB-CD2 4.5Å; A25-L27 HydrophobicContact CB-CG 3.94Å; A25-F36 HydrophobicContact CB-CD1 3.67Å; A25-F36 HydrophobicContact CB-CD2 4.14Å; A25-F36 HydrophobicContact CB-CE1 3.42Å; A25-F36 VanDerWaalsContact CB-CE1 3.42Å; A25-F36 HydrophobicContact CB-CE2 3.93Å; A25-F36 HydrophobicContact CB-CG 4.03Å; A25-F36 HydrophobicContact CB-CZ 3.57Å; A25-A57 PolarHBondContact N-O 2.98Å; A25-G58 WeakPolarHBondContact O-CA 3.42Å; A25-E59 PolarHBondContact O-N 2.78Å; A25-E59 VanDerWaalsContact O-N 3.17Å; A25-I87 CarbonylContact C-O 3.59Å; A25-I87 VanDerWaalsContact CA-O 3.26Å; A25-I87 WeakPolarHBondContact CA-O 3.16Å; A25-I87 HydrophobicContact CB-CB 4.13Å
26	L	93.6	Very high	86.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	102.1	169.7	-70.2	174.1	0	0	0	108.1	E59 L61 Q71 V72 L75 L86 I87 I88 S89 V102	L26-E59 WeakPolarHBondContact CA-O 3.45Å; L26-E59 HydrophobicContact CD2-CB 4.12Å; L26-L61 HydrophobicContact CB-CB 4.26Å; L26-L61 HydrophobicContact CB-CD1 4.14Å; L26-L61 HydrophobicContact CD1-CD1 4.16Å; L26-Q71 HydrophobicContact CD2-CB 4.12Å; L26-V72 HydrophobicContact CD1-CG2 3.7Å; L26-L75 HydrophobicContact CD1-CD1 4.32Å; L26-L75 HydrophobicContact CD2-CD1 3.76Å; L26-L75 HydrophobicContact CG-CD1 3.92Å; L26-L86 HydrophobicContact CD1-CD2 4.44Å; L26-L86 HydrophobicContact CG-CD1 4.35Å; L26-I87 PolarHBondContact N-O 3.05Å; L26-I88 HydrophobicContact CB-CG1 4.43Å; L26-I88 WeakPolarHBondContact O-CA 3.4Å; L26-S89 PolarHBondContact O-N 3.4Å; L26-V102 HydrophobicContact CD1-CG1 4.45Å; L26-V102 HydrophobicContact CD1-CG2 4.17Å
27	L	92.7	Very high	88.8	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	176.2	-166.5	-60.2	172.2	0	0	0	112.2	A25 V32 I33 F36 E59 A60 L61 I87 S89 V279	A25-L27 HydrophobicContact CB-CD1 3.91Å; A25-L27 HydrophobicContact CB-CD2 4.5Å; A25-L27 HydrophobicContact CB-CG 3.94Å; L27-V32 HydrophobicContact CD1-CG1 4.04Å; L27-I33 HydrophobicContact CB-CD1 4.44Å; L27-I33 HydrophobicContact CB-CG1 3.83Å; L27-I33 HydrophobicContact CD1-CG1 4.03Å; L27-I33 HydrophobicContact CG-CG1 4.36Å; L27-F36 HydrophobicContact CD1-CB 3.98Å; L27-F36 HydrophobicContact CD1-CG 4.33Å; L27-E59 PolarHBondContact N-O 3.11Å; L27-A60 CarbonylContact O-C 3.58Å; L27-A60 WeakPolarHBondContact O-CA 3.21Å; L27-L61 PolarHBondContact O-N 2.88Å; L27-I87 HydrophobicContact CD2-CG2 4.18Å; L27-S89 WeakPolarHBondContact CA-OG 3.38Å; L27-V279 HydrophobicContact CD1-CG1 4.45Å; L27-V279 HydrophobicContact CD1-CG2 4.4Å; L27-V279 HydrophobicContact CD2-CG2 3.91Å
28	S	89.4	Confident	90.2	Very high	10 Å²	10	39.9 Å²	39.9	7%	0.07	20%	0.201	C	C	.	.	S	Bend	trans	-64.5	-58.4	-179.3	50.3	0	0	0	0	112.9	S89 H90 E275	S28-S89 PolarHBondContact N-OG 3.01Å; S28-S89 VanDerWaalsContact N-OG 3.09Å; S28-H90 WeakPolarHBondContact CB-O 3.43Å; S28-E275 WeakPolarHBondContact CB-OE2 3.33Å; S28-E275 PolarHBondContact OG-OE1 3.05Å; S28-E275 VanDerWaalsContact OG-OE1 3.09Å; S28-E275 PolarHBondContact OG-OE2 3.2Å
29	D	88.3	Confident	91.2	Very high	72 Å²	72	38.5 Å²	38.5	39%	0.385	19%	0.19	S	C	.	.			trans	-130.6	153.5	-170.9	-65	-55.6	0	0	0	113.9	E31 V32 I33 N92	D29-E31 PolarHBondContact O-N 2.98Å; D29-V32 HydrophobicContact CB-CG2 4.32Å; D29-V32 PolarHBondContact O-N 3.16Å; D29-V32 VanDerWaalsContact O-N 3.08Å; D29-I33 WeakPolarHBondContact O-CG1 3.4Å; D29-I33 PolarHBondContact O-N 3.27Å; D29-N92 PolarHBondContact OD1-ND2 3.35Å; D29-N92 PolarHBondContact OD2-ND2 3.38Å
30	D	90.2	Very high	91.7	Very high	115 Å²	115	38.3 Å²	38.3	62%	0.615	19%	0.189	S	C	*	.	H	α-helix	trans	-60.2	-25.1	175.8	-75.1	-38.7	0	0	0	113.8	S34	D30-S34 VanDerWaalsContact O-CB 3.26Å; D30-S34 WeakPolarHBondContact O-CB 3.36Å; D30-S34 PolarHBondContact O-N 3.04Å; D30-S34 PolarHBondContact O-OG 2.95Å
31	E	91	Very high	91.8	Very high	159 Å²	159	38.3 Å²	38.3	74%	0.743	20%	0.196	S	C	*	.	H	α-helix	trans	-69.6	-44.1	173.4	-176.6	172.1	-175.2	0	0	111.8	D29 I33 S34 S35	D29-E31 PolarHBondContact O-N 2.98Å; E31-I33 VanDerWaalsContact C-N 3.32Å; E31-I33 PolarHBondContact O-N 3.44Å; E31-S34 PolarHBondContact O-N 3.35Å; E31-S35 WeakPolarHBondContact O-CB 3.33Å; E31-S35 PolarHBondContact O-N 2.66Å; E31-S35 PolarHBondContact O-OG 3.1Å
32	V	91.8	Very high	91.7	Very high	19 Å²	19	41.2 Å²	41.2	12%	0.115	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-39.5	176.1	-167.8	0	0	0	0	109.5	L27 D29 S35 F36 V279	L27-V32 HydrophobicContact CD1-CG1 4.04Å; D29-V32 HydrophobicContact CB-CG2 4.32Å; D29-V32 PolarHBondContact O-N 3.16Å; D29-V32 VanDerWaalsContact O-N 3.08Å; V32-S35 CarbonylContact O-C 3.56Å; V32-S35 WeakPolarHBondContact O-CB 3.25Å; V32-S35 PolarHBondContact O-N 3.13Å; V32-F36 WeakPolarHBondContact O-CB 3.25Å; V32-F36 PolarHBondContact O-N 3.44Å; V32-V279 HydrophobicContact CG1-CG2 4.1Å
33	I	92.5	Very high	91.2	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-64	-43.2	175.3	-64.2	161.1	0	0	0	112	L27 D29 E31 S35 F36 K37 E59 A60	L27-I33 HydrophobicContact CB-CD1 4.44Å; L27-I33 HydrophobicContact CB-CG1 3.83Å; L27-I33 HydrophobicContact CD1-CG1 4.03Å; L27-I33 HydrophobicContact CG-CG1 4.36Å; D29-I33 WeakPolarHBondContact O-CG1 3.4Å; D29-I33 PolarHBondContact O-N 3.27Å; E31-I33 VanDerWaalsContact C-N 3.32Å; E31-I33 PolarHBondContact O-N 3.44Å; I33-S35 PolarHBondContact O-N 3.09Å; I33-F36 WeakPolarHBondContact O-CB 3.03Å; I33-F36 PolarHBondContact O-N 2.79Å; I33-K37 HydrophobicContact CG2-CD 4.06Å; I33-K37 WeakPolarHBondContact O-CG 3.35Å; I33-K37 PolarHBondContact O-N 3.15Å; I33-E59 WeakPolarHBondContact CD1-O 3.23Å; I33-A60 HydrophobicContact CD1-CB 4.07Å
34	S	93.2	Very high	90.2	Very high	65 Å²	65	49 Å²	49	46%	0.455	25%	0.246	S	C	.	.	H	α-helix	trans	-64.6	-31.1	176.1	-62.9	0	0	0	0	111.7	D30 E31 R38	D30-S34 VanDerWaalsContact O-CB 3.26Å; D30-S34 WeakPolarHBondContact O-CB 3.36Å; D30-S34 PolarHBondContact O-N 3.04Å; D30-S34 PolarHBondContact O-OG 2.95Å; E31-S34 PolarHBondContact O-N 3.35Å; S34-R38 WeakPolarHBondContact O-CG 3.38Å; S34-R38 PolarHBondContact O-N 3.01Å; S34-R38 PolarHBondContact O-NE 3.45Å
35	S	92.7	Very high	88.8	Confident	8 Å²	8	55.7 Å²	55.7	6%	0.056	28%	0.282	C	S	.	.	H	α-helix	trans	-75.4	-42.9	174.2	-54.6	0	0	0	0	112.1	E31 V32 I33 K37 R38 M39 L276	E31-S35 WeakPolarHBondContact O-CB 3.33Å; E31-S35 PolarHBondContact O-N 2.66Å; E31-S35 PolarHBondContact O-OG 3.1Å; V32-S35 CarbonylContact O-C 3.56Å; V32-S35 WeakPolarHBondContact O-CB 3.25Å; V32-S35 PolarHBondContact O-N 3.13Å; I33-S35 PolarHBondContact O-N 3.09Å; S35-K37 PolarHBondContact O-N 3.39Å; S35-R38 WeakPolarHBondContact O-CB 3.36Å; S35-R38 PolarHBondContact O-N 2.9Å; S35-R38 PolarHBondContact OG-NH2 2.98Å; S35-M39 WeakPolarHBondContact O-CG 3.35Å; S35-M39 PolarHBondContact O-N 3.47Å; S35-L276 VanDerWaalsContact CB-CD1 3.45Å
36	F	94.4	Very high	87.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-55.6	-49.2	171	162.3	-105.5	0	0	0	112.1	I23 A25 L27 V32 I33 R38 M39 V40 A56 I87 V279 V283	I23-F36 HydrophobicContact CB-CZ 4.35Å; I23-F36 HydrophobicContact CG2-CE2 4.02Å; I23-F36 HydrophobicContact CG2-CZ 3.97Å; A25-F36 HydrophobicContact CB-CD1 3.67Å; A25-F36 HydrophobicContact CB-CD2 4.14Å; A25-F36 HydrophobicContact CB-CE1 3.42Å; A25-F36 VanDerWaalsContact CB-CE1 3.42Å; A25-F36 HydrophobicContact CB-CE2 3.93Å; A25-F36 HydrophobicContact CB-CG 4.03Å; A25-F36 HydrophobicContact CB-CZ 3.57Å; L27-F36 HydrophobicContact CD1-CB 3.98Å; L27-F36 HydrophobicContact CD1-CG 4.33Å; V32-F36 WeakPolarHBondContact O-CB 3.25Å; V32-F36 PolarHBondContact O-N 3.44Å; I33-F36 WeakPolarHBondContact O-CB 3.03Å; I33-F36 PolarHBondContact O-N 2.79Å; F36-R38 VanDerWaalsContact C-N 3.3Å; F36-R38 PolarHBondContact O-N 2.93Å; F36-M39 PolarHBondContact O-N 3.07Å; F36-M39 VanDerWaalsContact O-N 3.13Å; F36-V40 HydrophobicContact CD2-CG2 3.9Å; F36-V40 HydrophobicContact CE2-CG2 3.43Å; F36-V40 VanDerWaalsContact CE2-CG2 3.43Å; F36-V40 HydrophobicContact CZ-CG2 3.81Å; F36-V40 WeakPolarHBondContact O-CG2 3.28Å; F36-V40 PolarHBondContact O-N 2.88Å; F36-A56 HydrophobicContact CD1-CB 4.26Å; F36-A56 HydrophobicContact CE1-CB 3.66Å; F36-A56 HydrophobicContact CZ-CB 4.05Å; F36-I87 HydrophobicContact CD2-CD1 4.26Å; F36-I87 HydrophobicContact CE2-CD1 3.82Å; F36-V279 HydrophobicContact CB-CG1 4.07Å; F36-V279 HydrophobicContact CD2-CG1 4.06Å; F36-V283 HydrophobicContact CD2-CG2 3.61Å; F36-V283 HydrophobicContact CE2-CG2 3.72Å
37	K	93.8	Very high	85.9	Confident	89 Å²	89	62.9 Å²	62.9	39%	0.387	32%	0.324	S	S	.	.	H	α-helix	trans	-57.4	-41.9	177.9	-74.7	168.2	-178.3	165.5	0	111.7	I33 S35 S41 A56 G58	I33-K37 HydrophobicContact CG2-CD 4.06Å; I33-K37 WeakPolarHBondContact O-CG 3.35Å; I33-K37 PolarHBondContact O-N 3.15Å; S35-K37 PolarHBondContact O-N 3.39Å; K37-S41 WeakPolarHBondContact O-CB 3.11Å; K37-S41 PolarHBondContact O-N 3.27Å; K37-S41 VanDerWaalsContact O-N 3.16Å; K37-S41 PolarHBondContact O-OG 2.81Å; K37-A56 HydrophobicContact CB-CB 4.28Å; K37-A56 HydrophobicContact CG-CB 3.85Å; K37-G58 PolarHBondContact NZ-O 3.44Å
38	R	92.2	Very high	84.2	Confident	157 Å²	157	74.7 Å²	74.7	59%	0.592	37%	0.37	S	S	*	.	H	α-helix	trans	-63.7	-48.9	173.3	-72.3	179.6	-65.9	140.3	-6.4	112	S34 S35 F36 V40 S41 S42	S34-R38 WeakPolarHBondContact O-CG 3.38Å; S34-R38 PolarHBondContact O-N 3.01Å; S34-R38 PolarHBondContact O-NE 3.45Å; S35-R38 WeakPolarHBondContact O-CB 3.36Å; S35-R38 PolarHBondContact O-N 2.9Å; S35-R38 PolarHBondContact OG-NH2 2.98Å; F36-R38 VanDerWaalsContact C-N 3.3Å; F36-R38 PolarHBondContact O-N 2.93Å; R38-V40 PolarHBondContact O-N 3.27Å; R38-S41 WeakPolarHBondContact CA-OG 3.16Å; R38-S41 PolarHBondContact O-N 3.32Å; R38-S41 VanDerWaalsContact O-N 3.17Å; R38-S41 PolarHBondContact O-OG 2.81Å; R38-S42 PolarHBondContact O-N 2.92Å
39	M	91.7	Very high	82.9	Confident	29 Å²	29	78.3 Å²	78.3	14%	0.143	39%	0.388	C	S	.	.	H	α-helix	trans	-58	-49.2	-179.1	-71.7	-172.6	-64.8	0	0	111.9	S35 F36 S41 S42 V43 L276 V279 A280	S35-M39 WeakPolarHBondContact O-CG 3.35Å; S35-M39 PolarHBondContact O-N 3.47Å; F36-M39 PolarHBondContact O-N 3.07Å; F36-M39 VanDerWaalsContact O-N 3.13Å; M39-S41 VanDerWaalsContact C-N 3.33Å; M39-S41 PolarHBondContact O-N 3.4Å; M39-S42 PolarHBondContact O-N 2.87Å; M39-S42 PolarHBondContact O-OG 2.87Å; M39-V43 PolarHBondContact O-N 2.76Å; M39-L276 HydrophobicContact CE-CD1 3.64Å; M39-L276 HydrophobicContact SD-CD1 4.36Å; M39-V279 HydrophobicContact CE-CB 4.23Å; M39-V279 HydrophobicContact CE-CG1 3.69Å; M39-A280 HydrophobicContact CE-CB 4.29Å; M39-A280 HydrophobicContact SD-CB 3.55Å; M39-A280 VanDerWaalsContact SD-CB 3.55Å
40	V	91.2	Very high	81.7	Confident	1 Å²	1	82.2 Å²	82.2	1%	0.006	41%	0.409	C	S	.	.	H	α-helix	trans	-60.7	-41.4	176.6	176.7	0	0	0	0	111.7	F36 R38 S42 V43 F54 A56 V283	F36-V40 HydrophobicContact CD2-CG2 3.9Å; F36-V40 HydrophobicContact CE2-CG2 3.43Å; F36-V40 VanDerWaalsContact CE2-CG2 3.43Å; F36-V40 HydrophobicContact CZ-CG2 3.81Å; F36-V40 WeakPolarHBondContact O-CG2 3.28Å; F36-V40 PolarHBondContact O-N 2.88Å; R38-V40 PolarHBondContact O-N 3.27Å; V40-S42 VanDerWaalsContact C-N 3.34Å; V40-S42 PolarHBondContact O-N 3.42Å; V40-V43 PolarHBondContact O-N 2.79Å; V40-F54 HydrophobicContact CG1-CB 3.69Å; V40-A56 HydrophobicContact CB-CB 3.91Å; V40-A56 HydrophobicContact CG1-CB 4.04Å; V40-A56 HydrophobicContact CG2-CB 4.14Å; V40-V283 HydrophobicContact CG2-CG1 3.93Å; V40-V283 HydrophobicContact CG2-CG2 3.99Å
41	S	86.6	Confident	80.9	Confident	70 Å²	70	78.8 Å²	78.8	49%	0.49	39%	0.393	S	S	.	.	H	α-helix	trans	-65.1	-35.6	178	69.6	0	0	0	0	113.2	K37 R38 M39 V43 R44	K37-S41 WeakPolarHBondContact O-CB 3.11Å; K37-S41 PolarHBondContact O-N 3.27Å; K37-S41 VanDerWaalsContact O-N 3.16Å; K37-S41 PolarHBondContact O-OG 2.81Å; R38-S41 WeakPolarHBondContact CA-OG 3.16Å; R38-S41 PolarHBondContact O-N 3.32Å; R38-S41 VanDerWaalsContact O-N 3.17Å; R38-S41 PolarHBondContact O-OG 2.81Å; M39-S41 VanDerWaalsContact C-N 3.33Å; M39-S41 PolarHBondContact O-N 3.4Å; S41-V43 PolarHBondContact O-N 3.29Å; S41-R44 PolarHBondContact O-N 2.75Å
42	S	85.9	Confident	80.4	Confident	60 Å²	60	72 Å²	72	42%	0.42	36%	0.362	S	S	.	.	H	α-helix	trans	-70.5	-15.2	179.7	68.1	0	0	0	0	114.2	R38 M39 V40 R44 D45	R38-S42 PolarHBondContact O-N 2.92Å; M39-S42 PolarHBondContact O-N 2.87Å; M39-S42 PolarHBondContact O-OG 2.87Å; V40-S42 VanDerWaalsContact C-N 3.34Å; V40-S42 PolarHBondContact O-N 3.42Å; S42-R44 PolarHBondContact O-N 3.41Å; S42-D45 PolarHBondContact O-N 3.42Å; S42-D45 VanDerWaalsContact O-N 3.09Å
43	V	82.4	Confident	80.1	Confident	18 Å²	18	72 Å²	72	11%	0.109	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-28	176.4	179.1	0	0	0	0	111.4	M39 V40 S41 D45 S46 F47 F54 V283 T287	M39-V43 PolarHBondContact O-N 2.76Å; V40-V43 PolarHBondContact O-N 2.79Å; S41-V43 PolarHBondContact O-N 3.29Å; V43-D45 VanDerWaalsContact C-N 3.26Å; V43-D45 PolarHBondContact O-N 2.83Å; V43-S46 PolarHBondContact O-N 3.38Å; V43-S46 VanDerWaalsContact O-N 3.14Å; V43-S46 PolarHBondContact O-OG 2.81Å; V43-F47 HydrophobicContact CG1-CD2 3.98Å; V43-F47 HydrophobicContact CG1-CE2 4Å; V43-F54 HydrophobicContact CB-CD2 4.42Å; V43-F54 HydrophobicContact CG1-CD2 3.99Å; V43-F54 HydrophobicContact CG1-CE2 4.1Å; V43-V283 HydrophobicContact CG2-CG1 4.46Å; V43-T287 HydrophobicContact CG1-CG2 4.26Å; V43-T287 HydrophobicContact CG2-CG2 4.2Å
44	R	71.7	Confident	80	Confident	154 Å²	154	73.1 Å²	73.1	58%	0.581	37%	0.367	S	S	*	.	H	α-helix	trans	-54.4	-43.2	172.4	179.2	-178.7	-73.9	152.7	-2.4	111.8	S41 S42 S46 F47 T53	S41-R44 PolarHBondContact O-N 2.75Å; S42-R44 PolarHBondContact O-N 3.41Å; R44-S46 PolarHBondContact O-N 3.31Å; R44-F47 PolarHBondContact O-N 2.8Å; R44-T53 VanDerWaalsContact NH2-CG2 3.33Å
45	D	64.1	Low	79.8	Confident	141 Å²	141	75 Å²	75	75%	0.754	37%	0.367	S	S	*	.	H	α-helix	trans	-72.1	-16.1	-174.9	-52.9	-30.6	0	0	0	112.3	S42 V43	S42-D45 PolarHBondContact O-N 3.42Å; S42-D45 VanDerWaalsContact O-N 3.09Å; V43-D45 VanDerWaalsContact C-N 3.26Å; V43-D45 PolarHBondContact O-N 2.83Å
46	S	63.2	Low	79.8	Confident	78 Å²	78	76.2 Å²	76.2	55%	0.545	38%	0.378	S	S	.	.	H	α-helix	trans	-89.7	-12.4	-178.9	70.6	0	0	0	0	114.8	V43 R44	V43-S46 PolarHBondContact O-N 3.38Å; V43-S46 VanDerWaalsContact O-N 3.14Å; V43-S46 PolarHBondContact O-OG 2.81Å; R44-S46 PolarHBondContact O-N 3.31Å
47	F	65.1	Low	79.6	Confident	74 Å²	74	77.2 Å²	77.2	33%	0.325	39%	0.386	S	S	.	.			trans	-123.9	122.4	-178.1	-72.5	-75.8	0	0	0	111.9	V43 R44 D49 L291	V43-F47 HydrophobicContact CG1-CD2 3.98Å; V43-F47 HydrophobicContact CG1-CE2 4Å; R44-F47 PolarHBondContact O-N 2.8Å; F47-D49 PolarHBondContact O-N 2.71Å; F47-L291 HydrophobicContact CD1-CD1 4.32Å; F47-L291 HydrophobicContact CD2-CD1 3.77Å; F47-L291 HydrophobicContact CE1-CD1 3.96Å; F47-L291 HydrophobicContact CE2-CD1 3.34Å; F47-L291 HydrophobicContact CG-CD1 4.25Å; F47-L291 HydrophobicContact CZ-CD1 3.45Å; F47-L291 VanDerWaalsContact CZ-CD1 3.45Å
48	Y	56.9	Low	79.4	Confident	248 Å²	248	73.5 Å²	73.5	97%	0.973	37%	0.372	S	S	*	.	S	Bend	trans	-69.6	14.5	179.8	-118.6	-88.9	0	0	0	114.9
49	D	61.9	Low	79.3	Confident	85 Å²	85	69.5 Å²	69.5	46%	0.455	36%	0.361	S	S	.	.			trans	-117.8	92.9	-168	-167.5	-12.8	0	0	0	110.1	F47 T51 V52	F47-D49 PolarHBondContact O-N 2.71Å; D49-T51 VanDerWaalsContact CG-OG1 3.26Å; D49-T51 PolarHBondContact O-N 2.91Å; D49-T51 VanDerWaalsContact OD1-CB 3.3Å; D49-T51 WeakPolarHBondContact OD1-CB 3.27Å; D49-T51 VanDerWaalsContact OD1-CG2 3.24Å; D49-T51 WeakPolarHBondContact OD1-CG2 3.28Å; D49-T51 PolarHBondContact OD1-N 3.49Å; D49-T51 PolarHBondContact OD1-OG1 3.41Å; D49-V52 PolarHBondContact O-N 2.84Å
50	D	63.6	Low	79.2	Confident	154 Å²	154	70 Å²	70	82%	0.824	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-5.3	179	-82.1	-28	0	0	0	114	C18	C18-D50 PolarHBondContact SG-O 3.19Å
51	T	73.5	Confident	79.2	Confident	44 Å²	44	70.4 Å²	70.4	27%	0.27	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-16.1	-178.2	67.5	0	0	0	0	114.5	L19 D49	L19-T51 WeakPolarHBondContact CB-O 3.28Å; L19-T51 PolarHBondContact N-O 3.26Å; D49-T51 VanDerWaalsContact CG-OG1 3.26Å; D49-T51 PolarHBondContact O-N 2.91Å; D49-T51 VanDerWaalsContact OD1-CB 3.3Å; D49-T51 WeakPolarHBondContact OD1-CB 3.27Å; D49-T51 VanDerWaalsContact OD1-CG2 3.24Å; D49-T51 WeakPolarHBondContact OD1-CG2 3.28Å; D49-T51 PolarHBondContact OD1-N 3.49Å; D49-T51 PolarHBondContact OD1-OG1 3.41Å
52	V	80.5	Confident	79.2	Confident	17 Å²	17	68.1 Å²	68.1	10%	0.103	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.9	-175.9	-177.4	0	0	0	0	112.5	L19 F21 D49 F54 L291 V294	L19-V52 HydrophobicContact CB-CG2 4.49Å; L19-V52 CarbonylContact O-C 3.59Å; F21-V52 HydrophobicContact CD2-CG1 3.71Å; F21-V52 HydrophobicContact CE2-CG1 3.79Å; D49-V52 PolarHBondContact O-N 2.84Å; V52-F54 HydrophobicContact CG1-CE2 4.1Å; V52-F54 HydrophobicContact CG1-CZ 4.23Å; V52-L291 HydrophobicContact CB-CD2 4.33Å; V52-L291 HydrophobicContact CG1-CD2 4.03Å; V52-L291 HydrophobicContact CG2-CD2 4.46Å; V52-V294 HydrophobicContact CG2-CG1 4.03Å
53	T	85.9	Confident	79.2	Confident	19 Å²	19	70.3 Å²	70.3	12%	0.117	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145.8	174.6	52.5	0	0	0	0	112.1	C18 L19 E20 F21 R44	C18-T53 WeakPolarHBondContact SG-CG2 3.34Å; L19-T53 PolarHBondContact O-N 3.45Å; L19-T53 PolarHBondContact O-OG1 3.24Å; E20-T53 WeakPolarHBondContact CA-O 3.37Å; F21-T53 PolarHBondContact N-O 3.38Å; R44-T53 VanDerWaalsContact NH2-CG2 3.33Å
54	F	88.4	Confident	79.4	Confident	24 Å²	24	73.7 Å²	73.7	11%	0.105	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.6	176.4	-67.4	-80	0	0	0	111.3	F21 I23 V40 V43 V52 T287 I290 L291	F21-F54 HydrophobicContact CB-CD1 3.97Å; F21-F54 HydrophobicContact CB-CE1 4Å; F21-F54 HydrophobicContact CD2-CE1 4.42Å; F21-F54 CarbonylContact O-C 3.5Å; F21-F54 VanDerWaalsContact O-CA 3.29Å; F21-F54 WeakPolarHBondContact O-CA 3.28Å; I23-F54 HydrophobicContact CD1-CD1 4.2Å; V40-F54 HydrophobicContact CG1-CB 3.69Å; V43-F54 HydrophobicContact CB-CD2 4.42Å; V43-F54 HydrophobicContact CG1-CD2 3.99Å; V43-F54 HydrophobicContact CG1-CE2 4.1Å; V52-F54 HydrophobicContact CG1-CE2 4.1Å; V52-F54 HydrophobicContact CG1-CZ 4.23Å; F54-T287 HydrophobicContact CD1-CG2 4.05Å; F54-T287 HydrophobicContact CD2-CG2 4.22Å; F54-T287 HydrophobicContact CE1-CG2 3.99Å; F54-T287 HydrophobicContact CE2-CG2 4.17Å; F54-T287 HydrophobicContact CG-CG2 4.16Å; F54-T287 HydrophobicContact CZ-CG2 4.05Å; F54-I290 HydrophobicContact CE1-CB 4.16Å; F54-I290 HydrophobicContact CE1-CD1 4.08Å; F54-I290 HydrophobicContact CE1-CG2 3.87Å; F54-I290 HydrophobicContact CZ-CB 4.4Å; F54-I290 HydrophobicContact CZ-CG2 4.15Å; F54-L291 HydrophobicContact CE2-CD1 4.34Å; F54-L291 HydrophobicContact CE2-CD2 4.21Å; F54-L291 HydrophobicContact CE2-CG 4.2Å; F54-L291 HydrophobicContact CZ-CD2 4.21Å; F54-L291 HydrophobicContact CZ-CG 3.99Å
55	K	90.2	Very high	80.2	Confident	106 Å²	106	67.6 Å²	67.6	46%	0.461	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	149.6	167.2	-80.6	-171	179.7	153.7	0	110.5	E20 F21 T22 I23	E20-K55 HydrophobicContact CG-CD 4.19Å; E20-K55 HydrophobicContact CG-CG 4.14Å; E20-K55 VanDerWaalsContact OE1-CD 3.3Å; E20-K55 WeakPolarHBondContact OE1-CD 3.37Å; E20-K55 VanDerWaalsContact OE1-CE 3.24Å; E20-K55 WeakPolarHBondContact OE1-CE 3.17Å; E20-K55 IonicContact OE1-NZ 3.75Å; E20-K55 PolarHBondContact OE1-NZ 2.85Å; E20-K55 WeakPolarHBondContact OE2-CE 3.39Å; E20-K55 IonicContact OE2-NZ 2.66Å; E20-K55 PolarHBondContact OE2-NZ 3.41Å; F21-K55 PolarHBondContact O-N 3.29Å; T22-K55 WeakPolarHBondContact CA-O 3.38Å; T22-K55 HydrophobicContact CG2-CB 4.45Å; I23-K55 PolarHBondContact N-O 2.96Å
56	A	92	Very high	81.3	Confident	33 Å²	33	66.6 Å²	66.6	27%	0.273	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.1	173.3	0	0	0	0	0	110.2	F36 K37 V40	F36-A56 HydrophobicContact CD1-CB 4.26Å; F36-A56 HydrophobicContact CE1-CB 3.66Å; F36-A56 HydrophobicContact CZ-CB 4.05Å; K37-A56 HydrophobicContact CB-CB 4.28Å; K37-A56 HydrophobicContact CG-CB 3.85Å; V40-A56 HydrophobicContact CB-CB 3.91Å; V40-A56 HydrophobicContact CG1-CB 4.04Å; V40-A56 HydrophobicContact CG2-CB 4.14Å
57	A	91.4	Very high	82.6	Confident	20 Å²	20	69.3 Å²	69.3	17%	0.165	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.8	164.9	0	0	0	0	0	107.9	T22 I23 G24 A25 L75	T22-A57 HydrophobicContact CG2-CB 3.84Å; I23-A57 PolarHBondContact O-N 3.44Å; G24-A57 CarbonylContact C-O 3.59Å; G24-A57 VanDerWaalsContact CA-O 3.25Å; G24-A57 WeakPolarHBondContact CA-O 3.4Å; A25-A57 PolarHBondContact N-O 2.98Å; A57-L75 HydrophobicContact CB-CD2 3.9Å
58	G	89.4	Confident	83.8	Confident	11 Å²	11	65.8 Å²	65.8	11%	0.113	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	146	177.3	0	0	0	0	0	115.2	A25 K37	A25-G58 WeakPolarHBondContact O-CA 3.42Å; K37-G58 PolarHBondContact NZ-O 3.44Å
59	E	90.5	Very high	85.5	Confident	73 Å²	73	55.5 Å²	55.5	34%	0.341	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	159.3	-172.2	-62.7	-177.4	-170.8	0	0	110.1	A25 L26 L27 I33 Q71	A25-E59 PolarHBondContact O-N 2.78Å; A25-E59 VanDerWaalsContact O-N 3.17Å; L26-E59 WeakPolarHBondContact CA-O 3.45Å; L26-E59 HydrophobicContact CD2-CB 4.12Å; L27-E59 PolarHBondContact N-O 3.11Å; I33-E59 WeakPolarHBondContact CD1-O 3.23Å; E59-Q71 PolarHBondContact OE2-NE2 2.9Å
60	A	89.7	Confident	86.9	Confident	40 Å²	40	55.5 Å²	55.5	33%	0.331	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	133.2	172.2	0	0	0	0	0	110	L27 I33 A62 Q71	L27-A60 CarbonylContact O-C 3.58Å; L27-A60 WeakPolarHBondContact O-CA 3.21Å; I33-A60 HydrophobicContact CD1-CB 4.07Å; A60-A62 PolarHBondContact O-N 3.35Å; A60-Q71 PolarHBondContact O-NE2 3.35Å
61	L	89.3	Confident	88.2	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.052	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-69.9	128.3	-176.1	179.5	61.7	0	0	0	111.2	L26 L27 A68 I88 S89 P91 A98 P99 V102	L26-L61 HydrophobicContact CB-CB 4.26Å; L26-L61 HydrophobicContact CB-CD1 4.14Å; L26-L61 HydrophobicContact CD1-CD1 4.16Å; L27-L61 PolarHBondContact O-N 2.88Å; L61-A68 HydrophobicContact CD1-CB 3.6Å; L61-I88 HydrophobicContact CD2-CD1 4.13Å; L61-I88 HydrophobicContact CD2-CG1 4.13Å; L61-S89 WeakPolarHBondContact CD2-O 3.5Å; L61-P91 WeakPolarHBondContact O-CB 3.3Å; L61-A98 HydrophobicContact CD1-CB 4.38Å; L61-A98 HydrophobicContact CD2-CB 4.15Å; L61-A98 HydrophobicContact CG-CB 4.24Å; L61-P99 HydrophobicContact CD2-CG 3.91Å; L61-V102 HydrophobicContact CD1-CG2 4.34Å
62	A	88.1	Confident	89.1	Confident	22 Å²	22	47.4 Å²	47.4	18%	0.182	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-71.1	137.9	175.1	0	0	0	0	0	112.6	A60 N64 K67 Q71 A98	A60-A62 PolarHBondContact O-N 3.35Å; A62-N64 PolarHBondContact O-N 3.33Å; A62-K67 HydrophobicContact CB-CB 3.62Å; A62-Q71 VanDerWaalsContact CB-OE1 3.23Å; A62-A98 VanDerWaalsContact O-CB 3.26Å; A62-A98 WeakPolarHBondContact O-CB 3.47Å
63	L	84.8	Confident	89.6	Confident	105 Å²	105	47.6 Å²	47.6	55%	0.55	26%	0.263	S	S	.	.	S	Bend	trans	-57.3	-28	174.9	-73.9	156.2	0	0	0	114.4	P91 A94	L63-P91 HydrophobicContact CD2-CB 3.94Å; L63-P91 HydrophobicContact CD2-CG 3.76Å; L63-P91 HydrophobicContact CG-CB 4.17Å; L63-P91 HydrophobicContact CG-CG 4.32Å; L63-A94 HydrophobicContact CD2-CB 4.03Å
64	N	86.9	Confident	89.9	Confident	89 Å²	89	51 Å²	51	48%	0.476	28%	0.28	S	S	.	.	S	Bend	trans	-95.4	123.3	-178.3	-179.6	-42.1	0	0	0	110.3	A62 L66 K67 A68	A62-N64 PolarHBondContact O-N 3.33Å; N64-L66 VanDerWaalsContact C-N 3.33Å; N64-L66 PolarHBondContact O-N 2.77Å; N64-L66 WeakPolarHBondContact OD1-CB 3.28Å; N64-L66 PolarHBondContact OD1-N 2.89Å; N64-K67 HydrophobicContact CB-CB 4.33Å; N64-K67 HydrophobicContact CB-CD 4.37Å; N64-K67 HydrophobicContact CB-CG 4.25Å; N64-K67 WeakPolarHBondContact O-CA 3.16Å; N64-K67 WeakPolarHBondContact O-CB 3.46Å; N64-K67 PolarHBondContact O-N 3.29Å; N64-A68 PolarHBondContact O-N 3.04Å
65	A	88	Confident	90	Very high	26 Å²	26	50 Å²	50	22%	0.215	28%	0.276	C	S	.	.	H	α-helix	trans	-47.3	-46.1	178.6	0	0	0	0	0	114.5	K67 A68 T69 S101	A65-K67 VanDerWaalsContact C-N 3.3Å; A65-K67 PolarHBondContact O-N 3.05Å; A65-A68 WeakPolarHBondContact O-CB 3.4Å; A65-A68 PolarHBondContact O-N 3.2Å; A65-T69 PolarHBondContact O-N 3.02Å; A65-T69 PolarHBondContact O-OG1 3.48Å; A65-S101 WeakPolarHBondContact CA-OG 3.24Å; A65-S101 PolarHBondContact O-OG 3.03Å
66	L	89.1	Confident	90	Very high	120 Å²	120	45 Å²	45	63%	0.628	26%	0.255	S	S	*	.	H	α-helix	trans	-65.4	-35.1	179.6	-173.8	67.5	0	0	0	111.9	N64 N70	N64-L66 VanDerWaalsContact C-N 3.33Å; N64-L66 PolarHBondContact O-N 2.77Å; N64-L66 WeakPolarHBondContact OD1-CB 3.28Å; N64-L66 PolarHBondContact OD1-N 2.89Å; L66-N70 VanDerWaalsContact O-CG 3.31Å; L66-N70 PolarHBondContact O-N 3.14Å; L66-N70 VanDerWaalsContact O-N 3.14Å; L66-N70 PolarHBondContact O-ND2 3.49Å
67	K	90.1	Very high	89.9	Confident	135 Å²	135	47.7 Å²	47.7	59%	0.587	26%	0.264	S	S	*	.	H	α-helix	trans	-70.4	-39.6	174.1	-68	-172.3	177.4	-177.1	0	111.3	A62 N64 A65 N70 Q71	A62-K67 HydrophobicContact CB-CB 3.62Å; N64-K67 HydrophobicContact CB-CB 4.33Å; N64-K67 HydrophobicContact CB-CD 4.37Å; N64-K67 HydrophobicContact CB-CG 4.25Å; N64-K67 WeakPolarHBondContact O-CA 3.16Å; N64-K67 WeakPolarHBondContact O-CB 3.46Å; N64-K67 PolarHBondContact O-N 3.29Å; A65-K67 VanDerWaalsContact C-N 3.3Å; A65-K67 PolarHBondContact O-N 3.05Å; K67-N70 WeakPolarHBondContact O-CB 3.48Å; K67-N70 PolarHBondContact O-N 3.25Å; K67-Q71 WeakPolarHBondContact O-CG 3.37Å; K67-Q71 PolarHBondContact O-N 2.87Å
68	A	90.6	Very high	89.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.6	-45.7	175.5	0	0	0	0	0	112	L61 N64 A65 N70 Q71 V72 A98 V102	L61-A68 HydrophobicContact CD1-CB 3.6Å; N64-A68 PolarHBondContact O-N 3.04Å; A65-A68 WeakPolarHBondContact O-CB 3.4Å; A65-A68 PolarHBondContact O-N 3.2Å; A68-N70 VanDerWaalsContact C-N 3.33Å; A68-N70 PolarHBondContact O-N 2.98Å; A68-Q71 WeakPolarHBondContact O-CB 3.37Å; A68-Q71 PolarHBondContact O-N 3.44Å; A68-Q71 VanDerWaalsContact O-N 3.17Å; A68-V72 WeakPolarHBondContact O-CG2 3.26Å; A68-V72 PolarHBondContact O-N 3.4Å; A68-V72 VanDerWaalsContact O-N 3.08Å; A68-A98 HydrophobicContact CB-CB 4.07Å; A68-V102 HydrophobicContact CB-CG2 3.89Å
69	T	91.1	Very high	89.4	Confident	33 Å²	33	50.7 Å²	50.7	20%	0.202	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-42.3	171.8	-65.7	0	0	0	0	112.1	A65 Q71 V72 C73 T105	A65-T69 PolarHBondContact O-N 3.02Å; A65-T69 PolarHBondContact O-OG1 3.48Å; T69-Q71 VanDerWaalsContact C-N 3.34Å; T69-Q71 PolarHBondContact O-N 2.86Å; T69-V72 WeakPolarHBondContact O-CB 3.42Å; T69-V72 PolarHBondContact O-N 3.25Å; T69-C73 PolarHBondContact O-N 2.78Å; T69-C73 VanDerWaalsContact O-N 3.07Å; T69-C73 PolarHBondContact O-SG 3.18Å; T69-T105 HydrophobicContact CG2-CG2 4.16Å; T69-T105 PolarHBondContact OG1-OG1 3.45Å
70	N	91.7	Very high	89	Confident	85 Å²	85	54.4 Å²	54.4	46%	0.455	30%	0.3	S	S	.	.	H	α-helix	trans	-64.1	-36	175.9	-72.5	-23.1	0	0	0	112.8	L66 K67 A68 C73 N74	L66-N70 VanDerWaalsContact O-CG 3.31Å; L66-N70 PolarHBondContact O-N 3.14Å; L66-N70 VanDerWaalsContact O-N 3.14Å; L66-N70 PolarHBondContact O-ND2 3.49Å; K67-N70 WeakPolarHBondContact O-CB 3.48Å; K67-N70 PolarHBondContact O-N 3.25Å; A68-N70 VanDerWaalsContact C-N 3.33Å; A68-N70 PolarHBondContact O-N 2.98Å; N70-C73 PolarHBondContact O-N 3.06Å; N70-N74 WeakPolarHBondContact O-CB 3.28Å; N70-N74 VanDerWaalsContact O-CG 3.24Å; N70-N74 PolarHBondContact O-N 3.5Å; N70-N74 PolarHBondContact O-ND2 3.01Å
71	Q	91.9	Very high	88.4	Confident	27 Å²	27	52.5 Å²	52.5	13%	0.126	28%	0.284	C	S	.	.	H	α-helix	trans	-63.3	-41.2	173.2	-69.9	-178.7	-78	0	0	111.9	L26 E59 A60 A62 K67 A68 T69 C73 N74 L75	L26-Q71 HydrophobicContact CD2-CB 4.12Å; E59-Q71 PolarHBondContact OE2-NE2 2.9Å; A60-Q71 PolarHBondContact O-NE2 3.35Å; A62-Q71 VanDerWaalsContact CB-OE1 3.23Å; K67-Q71 WeakPolarHBondContact O-CG 3.37Å; K67-Q71 PolarHBondContact O-N 2.87Å; A68-Q71 WeakPolarHBondContact O-CB 3.37Å; A68-Q71 PolarHBondContact O-N 3.44Å; A68-Q71 VanDerWaalsContact O-N 3.17Å; T69-Q71 VanDerWaalsContact C-N 3.34Å; T69-Q71 PolarHBondContact O-N 2.86Å; Q71-C73 VanDerWaalsContact C-N 3.35Å; Q71-C73 PolarHBondContact O-N 3.18Å; Q71-N74 PolarHBondContact O-N 2.98Å; Q71-L75 WeakPolarHBondContact O-CG 3.35Å; Q71-L75 PolarHBondContact O-N 3.4Å
72	V	92.1	Very high	88.2	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-58.2	-47.1	173.5	176.6	0	0	0	0	110.9	L26 A68 T69 N74 L75 F76 L86 V102 T105	L26-V72 HydrophobicContact CD1-CG2 3.7Å; A68-V72 WeakPolarHBondContact O-CG2 3.26Å; A68-V72 PolarHBondContact O-N 3.4Å; A68-V72 VanDerWaalsContact O-N 3.08Å; T69-V72 WeakPolarHBondContact O-CB 3.42Å; T69-V72 PolarHBondContact O-N 3.25Å; V72-N74 VanDerWaalsContact C-N 3.34Å; V72-N74 PolarHBondContact O-N 3.11Å; V72-L75 WeakPolarHBondContact O-CB 3.48Å; V72-L75 PolarHBondContact O-N 2.89Å; V72-F76 HydrophobicContact CG1-CD1 4.31Å; V72-F76 HydrophobicContact CG1-CD2 4.45Å; V72-F76 HydrophobicContact CG1-CE1 3.6Å; V72-F76 HydrophobicContact CG1-CE2 3.78Å; V72-F76 HydrophobicContact CG1-CZ 3.3Å; V72-F76 VanDerWaalsContact O-CD1 3.28Å; V72-F76 WeakPolarHBondContact O-CD1 3.49Å; V72-F76 WeakPolarHBondContact O-CG 3.39Å; V72-F76 PolarHBondContact O-N 3.42Å; V72-L86 HydrophobicContact CG2-CD2 4.23Å; V72-V102 HydrophobicContact CG2-CB 4.14Å; V72-V102 HydrophobicContact CG2-CG1 3.6Å; V72-V102 HydrophobicContact CG2-CG2 3.74Å; V72-T105 HydrophobicContact CG1-CG2 4.1Å
73	C	91.6	Very high	88.4	Confident	21 Å²	21	53.3 Å²	53.3	14%	0.142	28%	0.282	C	S	.	.	H	α-helix	trans	-65.4	-34.8	177.8	-63.6	0	0	0	0	113.2	T69 N70 Q71 F76 N77 C310	T69-C73 PolarHBondContact O-N 2.78Å; T69-C73 VanDerWaalsContact O-N 3.07Å; T69-C73 PolarHBondContact O-SG 3.18Å; N70-C73 PolarHBondContact O-N 3.06Å; Q71-C73 VanDerWaalsContact C-N 3.35Å; Q71-C73 PolarHBondContact O-N 3.18Å; C73-F76 PolarHBondContact O-N 3.22Å; C73-N77 PolarHBondContact O-N 3.45Å; C73-N77 VanDerWaalsContact O-N 3.09Å; C73-N77 PolarHBondContact O-ND2 2.88Å; C73-C310 WeakPolarHBondContact CA-SG 3.38Å; C73-C310 HydrophobicContact CB-CB 3.92Å; C73-C310 WeakPolarHBondContact CB-SG 3.37Å; C73-C310 WeakPolarHBondContact SG-CB 3.34Å; C73-C310 CovalentContact SG-SG 2.04Å; C73-C310 PolarHBondContact SG-SG 2.9Å
74	N	91.6	Very high	88.7	Confident	89 Å²	89	48.3 Å²	48.3	48%	0.476	26%	0.256	S	S	.	.	H	α-helix	trans	-66.9	-41	172.9	-71.3	-16.6	0	0	0	111.9	N70 Q71 V72 F76 N77 S78	N70-N74 WeakPolarHBondContact O-CB 3.28Å; N70-N74 VanDerWaalsContact O-CG 3.24Å; N70-N74 PolarHBondContact O-N 3.5Å; N70-N74 PolarHBondContact O-ND2 3.01Å; Q71-N74 PolarHBondContact O-N 2.98Å; V72-N74 VanDerWaalsContact C-N 3.34Å; V72-N74 PolarHBondContact O-N 3.11Å; N74-F76 VanDerWaalsContact C-N 3.33Å; N74-F76 PolarHBondContact O-N 3.38Å; N74-N77 PolarHBondContact O-N 2.99Å; N74-S78 WeakPolarHBondContact O-CB 3.33Å; N74-S78 PolarHBondContact O-N 2.89Å; N74-S78 PolarHBondContact O-OG 2.87Å
75	L	90.7	Very high	89	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-39.9	175	-74.4	169.9	0	0	0	111.7	L26 A57 Q71 V72 S78 S79 L86	L26-L75 HydrophobicContact CD1-CD1 4.32Å; L26-L75 HydrophobicContact CD2-CD1 3.76Å; L26-L75 HydrophobicContact CG-CD1 3.92Å; A57-L75 HydrophobicContact CB-CD2 3.9Å; Q71-L75 WeakPolarHBondContact O-CG 3.35Å; Q71-L75 PolarHBondContact O-N 3.4Å; V72-L75 WeakPolarHBondContact O-CB 3.48Å; V72-L75 PolarHBondContact O-N 2.89Å; L75-S78 WeakPolarHBondContact CA-OG 3.31Å; L75-S78 PolarHBondContact O-N 3.22Å; L75-S78 PolarHBondContact O-OG 3.3Å; L75-S79 WeakPolarHBondContact O-CB 3.38Å; L75-S79 PolarHBondContact O-N 2.93Å; L75-S79 PolarHBondContact O-OG 3.04Å; L75-L86 HydrophobicContact CD1-CD1 4.25Å
76	F	90	Very high	89.4	Confident	1 Å²	1	42.9 Å²	42.9	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-52	174.8	-63.9	-5.3	0	0	0	110.8	V72 C73 N74 S78 S79 I83 Y109 L111 V307 K308	V72-F76 HydrophobicContact CG1-CD1 4.31Å; V72-F76 HydrophobicContact CG1-CD2 4.45Å; V72-F76 HydrophobicContact CG1-CE1 3.6Å; V72-F76 HydrophobicContact CG1-CE2 3.78Å; V72-F76 HydrophobicContact CG1-CZ 3.3Å; V72-F76 VanDerWaalsContact O-CD1 3.28Å; V72-F76 WeakPolarHBondContact O-CD1 3.49Å; V72-F76 WeakPolarHBondContact O-CG 3.39Å; V72-F76 PolarHBondContact O-N 3.42Å; C73-F76 PolarHBondContact O-N 3.22Å; N74-F76 VanDerWaalsContact C-N 3.33Å; N74-F76 PolarHBondContact O-N 3.38Å; F76-S78 VanDerWaalsContact C-N 3.32Å; F76-S78 PolarHBondContact O-N 3.3Å; F76-S79 PolarHBondContact O-N 2.91Å; F76-S79 PolarHBondContact O-OG 3.43Å; F76-I83 HydrophobicContact CD1-CD1 4.38Å; F76-I83 HydrophobicContact CD1-CG2 3.8Å; F76-I83 HydrophobicContact CE1-CD1 4.38Å; F76-I83 HydrophobicContact CE1-CG2 4.18Å; F76-Y109 AromaticContact CE2-CD2 3.81Å; F76-Y109 HydrophobicContact CE2-CD2 3.81Å; F76-Y109 HydrophobicContact CE2-CE2 4.09Å; F76-L111 HydrophobicContact CE1-CD2 3.46Å; F76-L111 VanDerWaalsContact CE1-CD2 3.46Å; F76-L111 HydrophobicContact CZ-CD2 3.71Å; F76-V307 HydrophobicContact CB-CG1 4.5Å; F76-V307 HydrophobicContact CD2-CB 3.78Å; F76-V307 HydrophobicContact CD2-CG1 3.49Å; F76-V307 VanDerWaalsContact CD2-CG1 3.49Å; F76-V307 HydrophobicContact CD2-CG2 4.43Å; F76-V307 HydrophobicContact CE2-CB 4.06Å; F76-V307 HydrophobicContact CE2-CG1 3.94Å; F76-V307 HydrophobicContact CE2-CG2 4.21Å; F76-V307 HydrophobicContact CG-CB 4.18Å; F76-V307 HydrophobicContact CG-CG1 4.22Å; F76-K308 CarbonylContact C-O 3.56Å
77	N	89	Confident	89.7	Confident	89 Å²	89	37.2 Å²	37.2	48%	0.476	19%	0.193	S	C	.	.	H	α-helix	trans	-56.7	-44	176.6	-71.4	-18.7	0	0	0	112.1	C73 N74 S79 K308 A309	C73-N77 PolarHBondContact O-N 3.45Å; C73-N77 VanDerWaalsContact O-N 3.09Å; C73-N77 PolarHBondContact O-ND2 2.88Å; N74-N77 PolarHBondContact O-N 2.99Å; N77-S79 VanDerWaalsContact C-N 3.27Å; N77-S79 PolarHBondContact O-N 3.39Å; N77-K308 VanDerWaalsContact CA-O 3.32Å; N77-K308 WeakPolarHBondContact CA-O 3.35Å; N77-K308 PolarHBondContact N-O 3.36Å; N77-K308 PolarHBondContact OD1-O 3.47Å; N77-K308 VanDerWaalsContact OD1-O 3.11Å; N77-A309 WeakPolarHBondContact OD1-CA 3.45Å; N77-A309 WeakPolarHBondContact OD1-CB 3.38Å
78	S	87.3	Confident	89.9	Confident	83 Å²	83	30.8 Å²	30.8	58%	0.58	17%	0.165	S	C	*	.	H	α-helix	trans	-69.7	-19.2	-177.2	74.9	0	0	0	0	114.8	N74 L75 F76	N74-S78 WeakPolarHBondContact O-CB 3.33Å; N74-S78 PolarHBondContact O-N 2.89Å; N74-S78 PolarHBondContact O-OG 2.87Å; L75-S78 WeakPolarHBondContact CA-OG 3.31Å; L75-S78 PolarHBondContact O-N 3.22Å; L75-S78 PolarHBondContact O-OG 3.3Å; F76-S78 VanDerWaalsContact C-N 3.32Å; F76-S78 PolarHBondContact O-N 3.3Å
79	S	83.7	Confident	89.9	Confident	11 Å²	11	30.8 Å²	30.8	8%	0.077	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	5.4	-174.4	61	0	0	0	0	113.3	L75 F76 N77 G81 R82	L75-S79 WeakPolarHBondContact O-CB 3.38Å; L75-S79 PolarHBondContact O-N 2.93Å; L75-S79 PolarHBondContact O-OG 3.04Å; F76-S79 PolarHBondContact O-N 2.91Å; F76-S79 PolarHBondContact O-OG 3.43Å; N77-S79 VanDerWaalsContact C-N 3.27Å; N77-S79 PolarHBondContact O-N 3.39Å; S79-G81 PolarHBondContact O-N 2.93Å; S79-R82 WeakPolarHBondContact O-CB 3.46Å; S79-R82 PolarHBondContact O-N 2.88Å
80	E	80.9	Confident	89.8	Confident	152 Å²	152	30.6 Å²	30.6	71%	0.71	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.2	29	-179.9	-59.3	-167.8	172.5	0	0	114.8	H305	E80-H305 PolarHBondContact O-ND1 3.37Å
81	G	77.9	Confident	89.5	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	35.7	-173.8	0	0	0	0	0	114	S79 H305 S306 V307	S79-G81 PolarHBondContact O-N 2.93Å; G81-H305 CarbonylContact O-C 3.53Å; G81-H305 VanDerWaalsContact O-CA 3.26Å; G81-H305 WeakPolarHBondContact O-CA 3.37Å; G81-H305 WeakPolarHBondContact O-CB 3.49Å; G81-H305 PolarHBondContact O-ND1 2.98Å; G81-S306 PolarHBondContact O-N 2.77Å; G81-S306 PolarHBondContact O-OG 3.5Å; G81-V307 VanDerWaalsContact CA-O 3.25Å; G81-V307 WeakPolarHBondContact CA-O 3.38Å
82	R	85.3	Confident	88.8	Confident	47 Å²	47	30.2 Å²	30.2	18%	0.177	16%	0.161	C	C	.	.			trans	-109.7	14.8	169.5	-69.7	-69.2	-173.7	176.7	-9.3	113.2	T22 S79 F84 K302 L304	T22-R82 WeakPolarHBondContact CA-O 3.44Å; T22-R82 VanDerWaalsContact CB-O 3.25Å; T22-R82 WeakPolarHBondContact CB-O 3.32Å; T22-R82 PolarHBondContact N-O 2.93Å; S79-R82 WeakPolarHBondContact O-CB 3.46Å; S79-R82 PolarHBondContact O-N 2.88Å; R82-F84 VanDerWaalsContact O-CD2 3.24Å; R82-F84 WeakPolarHBondContact O-CD2 3.31Å; R82-K302 PolarHBondContact NH2-O 2.76Å; R82-L304 PolarHBondContact NH1-O 2.78Å
83	I	91.2	Very high	87.5	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.8	173.2	-172.2	169.5	0	0	0	111.3	T22 F76 S306	T22-I83 WeakPolarHBondContact O-CA 3.32Å; F76-I83 HydrophobicContact CD1-CD1 4.38Å; F76-I83 HydrophobicContact CD1-CG2 3.8Å; F76-I83 HydrophobicContact CE1-CD1 4.38Å; F76-I83 HydrophobicContact CE1-CG2 4.18Å; I83-S306 PolarHBondContact N-OG 3.43Å; I83-S306 WeakPolarHBondContact O-CB 3.32Å; I83-S306 PolarHBondContact O-OG 2.9Å
84	F	91.9	Very high	86.2	Confident	1 Å²	1	35.2 Å²	35.2	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-18.8	-175.2	-77.5	-103.5	0	0	0	114.4	F21 T22 R82 I290 M301 L304 W331 L338	F21-F84 HydrophobicContact CB-CD2 4.44Å; F21-F84 AromaticContact CD1-CD2 3.75Å; F21-F84 HydrophobicContact CD1-CD2 3.75Å; F21-F84 HydrophobicContact CD1-CE1 4.32Å; F21-F84 AromaticContact CD1-CE2 3.54Å; F21-F84 HydrophobicContact CD1-CE2 3.54Å; F21-F84 HydrophobicContact CD1-CG 4.28Å; F21-F84 AromaticContact CD1-CZ 3.85Å; F21-F84 HydrophobicContact CD1-CZ 3.85Å; F21-F84 HydrophobicContact CE1-CE1 4.35Å; F21-F84 HydrophobicContact CE1-CE2 4.09Å; F21-F84 AromaticContact CE1-CZ 3.94Å; F21-F84 HydrophobicContact CE1-CZ 3.94Å; T22-F84 PolarHBondContact O-N 2.9Å; R82-F84 VanDerWaalsContact O-CD2 3.24Å; R82-F84 WeakPolarHBondContact O-CD2 3.31Å; F84-I290 HydrophobicContact CB-CD1 3.74Å; F84-I290 HydrophobicContact CB-CG1 4.23Å; F84-M301 HydrophobicContact CD1-CE 4.06Å; F84-M301 HydrophobicContact CE1-CE 3.84Å; F84-M301 HydrophobicContact CE1-SD 4.16Å; F84-L304 HydrophobicContact CE1-CD2 4.04Å; F84-L304 HydrophobicContact CE1-CG 4.44Å; F84-W331 HydrophobicContact CD1-CH2 4.09Å; F84-W331 AromaticContact CD1-CZ3 3.85Å; F84-W331 HydrophobicContact CD1-CZ3 3.85Å; F84-W331 AromaticContact CE1-CZ3 3.82Å; F84-W331 HydrophobicContact CE1-CZ3 3.82Å; F84-L338 HydrophobicContact CB-CD2 4.24Å; F84-L338 HydrophobicContact CD1-CD2 4.31Å; F84-L338 WeakPolarHBondContact O-CD2 3.41Å
85	A	94	Very high	84.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	151	174.3	0	0	0	0	0	109.8	G24 P112 A286 M342	G24-A85 PolarHBondContact N-O 3.41Å; A85-P112 WeakPolarHBondContact CA-O 3.37Å; A85-A286 HydrophobicContact CB-CB 3.97Å; A85-M342 HydrophobicContact CB-CE 3.91Å
86	L	95.1	Very high	83.4	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.6	174	-176.9	66.1	0	0	0	110.1	G24 L26 V72 L75 V102 C106 L111 P112 V113 I114	G24-L86 WeakPolarHBondContact O-CA 3.34Å; L26-L86 HydrophobicContact CD1-CD2 4.44Å; L26-L86 HydrophobicContact CG-CD1 4.35Å; V72-L86 HydrophobicContact CG2-CD2 4.23Å; L75-L86 HydrophobicContact CD1-CD1 4.25Å; L86-V102 HydrophobicContact CD2-CG1 3.53Å; L86-C106 VanDerWaalsContact CD2-SG 3.56Å; L86-L111 HydrophobicContact CB-CD2 4.28Å; L86-P112 PolarHBondContact N-O 3.44Å; L86-V113 HydrophobicContact CB-CG2 4.45Å; L86-V113 CarbonylContact O-C 3.2Å; L86-V113 VanDerWaalsContact O-CA 3.26Å; L86-V113 WeakPolarHBondContact O-CA 3.39Å; L86-I114 PolarHBondContact O-N 2.88Å
87	I	95.8	Very high	82.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.9	172.6	-56.9	-178.3	0	0	0	108.4	I23 G24 A25 L26 L27 F36 I114 V116 A282 V283	I23-I87 HydrophobicContact CG2-CD1 4.2Å; I23-I87 HydrophobicContact CG2-CG1 4.28Å; G24-I87 PolarHBondContact O-N 2.98Å; A25-I87 CarbonylContact C-O 3.59Å; A25-I87 VanDerWaalsContact CA-O 3.26Å; A25-I87 WeakPolarHBondContact CA-O 3.16Å; A25-I87 HydrophobicContact CB-CB 4.13Å; L26-I87 PolarHBondContact N-O 3.05Å; L27-I87 HydrophobicContact CD2-CG2 4.18Å; F36-I87 HydrophobicContact CD2-CD1 4.26Å; F36-I87 HydrophobicContact CE2-CD1 3.82Å; I87-I114 WeakPolarHBondContact CA-O 3.33Å; I87-V116 HydrophobicContact CG2-CG2 3.3Å; I87-A282 HydrophobicContact CD1-CB 3.88Å; I87-A282 HydrophobicContact CG1-CB 4.29Å; I87-A282 HydrophobicContact CG2-CB 4.16Å; I87-V283 HydrophobicContact CD1-CG2 3.63Å
88	I	94.1	Very high	82.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	136.2	-179	-169.3	158.8	0	0	0	113.5	L26 L61 P99 V102 V113 I114 V116 F132	L26-I88 HydrophobicContact CB-CG1 4.43Å; L26-I88 WeakPolarHBondContact O-CA 3.4Å; L61-I88 HydrophobicContact CD2-CD1 4.13Å; L61-I88 HydrophobicContact CD2-CG1 4.13Å; I88-P99 HydrophobicContact CD1-CB 3.83Å; I88-P99 HydrophobicContact CD1-CG 4.35Å; I88-P99 HydrophobicContact CG1-CB 4.18Å; I88-P99 HydrophobicContact CG1-CG 4.46Å; I88-V102 HydrophobicContact CD1-CB 3.56Å; I88-V102 HydrophobicContact CD1-CG1 3.59Å; I88-V102 HydrophobicContact CD1-CG2 3.78Å; I88-V113 HydrophobicContact CB-CG1 4.36Å; I88-V113 HydrophobicContact CG2-CG1 3.5Å; I88-V113 VanDerWaalsContact CG2-CG1 3.5Å; I88-I114 PolarHBondContact N-O 3.41Å; I88-V116 WeakPolarHBondContact O-CB 3.29Å; I88-V116 PolarHBondContact O-N 3.08Å; I88-F132 HydrophobicContact CG2-CE2 4.27Å
89	S	91.8	Very high	82.4	Confident	1 Å²	1	33 Å²	33	1%	0.007	21%	0.214	C	C	.	.			trans	-122.5	-164.4	167.3	76	0	0	0	0	111.5	L26 L27 S28 L61 P99 S117 E275	L26-S89 PolarHBondContact O-N 3.4Å; L27-S89 WeakPolarHBondContact CA-OG 3.38Å; S28-S89 PolarHBondContact N-OG 3.01Å; S28-S89 VanDerWaalsContact N-OG 3.09Å; L61-S89 WeakPolarHBondContact CD2-O 3.5Å; S89-P99 WeakPolarHBondContact O-CG 3.39Å; S89-S117 WeakPolarHBondContact CA-OG 3.29Å; S89-E275 WeakPolarHBondContact CB-OE1 3.36Å; S89-E275 PolarHBondContact OG-OE1 2.83Å
90	H	88.3	Confident	82.8	Confident	28 Å²	28	34.6 Å²	34.6	13%	0.13	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-103.6	146.2	-178.4	-82.1	72.8	0	0	0	109.3	S28 S117	S28-H90 WeakPolarHBondContact CB-O 3.43Å; H90-S117 PolarHBondContact N-OG 3.21Å; H90-S117 PolarHBondContact ND1-OG 2.59Å
91	P	84.8	Confident	83.3	Confident	10 Å²	10	28.3 Å²	28.3	7%	0.065	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-71.2	146.4	175.8	32.3	-34.5	0	0	0	110.6	L61 L63	L61-P91 WeakPolarHBondContact O-CB 3.3Å; L63-P91 HydrophobicContact CD2-CB 3.94Å; L63-P91 HydrophobicContact CD2-CG 3.76Å; L63-P91 HydrophobicContact CG-CB 4.17Å; L63-P91 HydrophobicContact CG-CG 4.32Å
92	N	78	Confident	84	Confident	94 Å²	94	28.3 Å²	28.3	50%	0.503	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	139.4	173.3	-80.9	-17.2	0	0	0	111.5	D29	D29-N92 PolarHBondContact OD1-ND2 3.35Å; D29-N92 PolarHBondContact OD2-ND2 3.38Å
93	G	65.5	Low	84.4	Confident	86 Å²	86	26.1 Å²	26.1	89%	0.887	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.9	-20.6	173.8	0	0	0	0	0	116.4
94	A	63	Low	84.4	Confident	42 Å²	42	30.6 Å²	30.6	35%	0.347	21%	0.206	S	C	.	.			trans	-158.6	125.7	169.1	0	0	0	0	0	112.6	L63 G96	L63-A94 HydrophobicContact CD2-CB 4.03Å; A94-G96 PolarHBondContact O-N 3.05Å
95	P	62.2	Low	84.4	Confident	111 Å²	111	31.6 Å²	31.6	72%	0.721	21%	0.212	S	C	*	.			trans	-72.6	78.9	167.6	31.2	-33.2	0	0	0	109.7
96	G	62.4	Low	84.3	Confident	31 Å²	31	31.6 Å²	31.6	32%	0.32	21%	0.212	S	C	.	.			trans	-101.4	178.1	-175.1	0	0	0	0	0	114.4	A94 A98 P99	A94-G96 PolarHBondContact O-N 3.05Å; G96-A98 PolarHBondContact O-N 3.36Å; G96-P99 WeakPolarHBondContact O-CD 3.35Å
97	S	72.4	Confident	84.2	Confident	75 Å²	75	32.2 Å²	32.2	52%	0.524	22%	0.218	S	C	.	.	S	Bend	trans	-68.3	5.3	-176.4	55.2	0	0	0	0	116.1	L100 S101	S97-L100 WeakPolarHBondContact O-CB 3.43Å; S97-L100 PolarHBondContact O-N 2.78Å; S97-S101 PolarHBondContact O-N 3.41Å
98	A	82.6	Confident	84	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.6	-49.1	-175.9	0	0	0	0	0	113.1	L61 A62 A68 G96 L100 S101 V102	L61-A98 HydrophobicContact CD1-CB 4.38Å; L61-A98 HydrophobicContact CD2-CB 4.15Å; L61-A98 HydrophobicContact CG-CB 4.24Å; A62-A98 VanDerWaalsContact O-CB 3.26Å; A62-A98 WeakPolarHBondContact O-CB 3.47Å; A68-A98 HydrophobicContact CB-CB 4.07Å; G96-A98 PolarHBondContact O-N 3.36Å; A98-L100 PolarHBondContact O-N 2.8Å; A98-S101 PolarHBondContact O-N 3.02Å; A98-S101 PolarHBondContact O-OG 3.26Å; A98-V102 PolarHBondContact O-N 3.39Å
99	P	90.4	Very high	83.8	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.013	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-26	177.8	-23.8	37.9	0	0	0	114.1	L61 I88 S89 G96 S103 F123	L61-P99 HydrophobicContact CD2-CG 3.91Å; I88-P99 HydrophobicContact CD1-CB 3.83Å; I88-P99 HydrophobicContact CD1-CG 4.35Å; I88-P99 HydrophobicContact CG1-CB 4.18Å; I88-P99 HydrophobicContact CG1-CG 4.46Å; S89-P99 WeakPolarHBondContact O-CG 3.39Å; G96-P99 WeakPolarHBondContact O-CD 3.35Å; P99-S103 WeakPolarHBondContact O-CB 3.43Å; P99-S103 PolarHBondContact O-N 2.9Å; P99-F123 HydrophobicContact CB-CZ 4.26Å
100	L	91	Very high	83.8	Confident	44 Å²	44	41.5 Å²	41.5	23%	0.23	26%	0.258	C	S	.	.	H	α-helix	trans	-65.2	-47.3	175.7	-171.8	68.9	0	0	0	110.9	S97 A98 V102 S103 F104 I122 F123	S97-L100 WeakPolarHBondContact O-CB 3.43Å; S97-L100 PolarHBondContact O-N 2.78Å; A98-L100 PolarHBondContact O-N 2.8Å; L100-V102 VanDerWaalsContact C-N 3.35Å; L100-V102 PolarHBondContact O-N 3.49Å; L100-S103 PolarHBondContact O-N 2.93Å; L100-F104 HydrophobicContact CD1-CD2 4.5Å; L100-F104 HydrophobicContact CD1-CE2 3.95Å; L100-F104 HydrophobicContact CD2-CE2 4.28Å; L100-F104 HydrophobicContact CG-CD2 4.13Å; L100-F104 HydrophobicContact CG-CE2 3.76Å; L100-F104 VanDerWaalsContact O-CD2 3.26Å; L100-F104 WeakPolarHBondContact O-CD2 3.44Å; L100-F104 PolarHBondContact O-N 3.2Å; L100-I122 HydrophobicContact CD1-CD1 4.06Å; L100-I122 HydrophobicContact CD1-CG1 4.42Å; L100-I122 HydrophobicContact CD1-CG2 3.99Å; L100-I122 HydrophobicContact CD2-CD1 4.37Å; L100-F123 HydrophobicContact CB-CE1 4.44Å; L100-F123 HydrophobicContact CB-CZ 4.16Å; L100-F123 HydrophobicContact CD1-CE1 3.92Å; L100-F123 HydrophobicContact CD1-CZ 4.07Å
101	S	91.4	Very high	84	Confident	21 Å²	21	40.2 Å²	40.2	15%	0.147	25%	0.252	C	S	.	.	H	α-helix	trans	-62.8	-38.1	177.1	66.1	0	0	0	0	113.5	A65 S97 A98 T105	A65-S101 WeakPolarHBondContact CA-OG 3.24Å; A65-S101 PolarHBondContact O-OG 3.03Å; S97-S101 PolarHBondContact O-N 3.41Å; A98-S101 PolarHBondContact O-N 3.02Å; A98-S101 PolarHBondContact O-OG 3.26Å; S101-T105 WeakPolarHBondContact O-CB 3.5Å; S101-T105 PolarHBondContact O-N 2.89Å; S101-T105 VanDerWaalsContact O-N 3.07Å; S101-T105 PolarHBondContact O-OG1 3.18Å
102	V	92.4	Very high	84.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-44.6	174.2	173.6	0	0	0	0	110.8	L26 L61 A68 V72 L86 I88 A98 L100 F104 T105 C106	L26-V102 HydrophobicContact CD1-CG1 4.45Å; L26-V102 HydrophobicContact CD1-CG2 4.17Å; L61-V102 HydrophobicContact CD1-CG2 4.34Å; A68-V102 HydrophobicContact CB-CG2 3.89Å; V72-V102 HydrophobicContact CG2-CB 4.14Å; V72-V102 HydrophobicContact CG2-CG1 3.6Å; V72-V102 HydrophobicContact CG2-CG2 3.74Å; L86-V102 HydrophobicContact CD2-CG1 3.53Å; I88-V102 HydrophobicContact CD1-CB 3.56Å; I88-V102 HydrophobicContact CD1-CG1 3.59Å; I88-V102 HydrophobicContact CD1-CG2 3.78Å; A98-V102 PolarHBondContact O-N 3.39Å; L100-V102 VanDerWaalsContact C-N 3.35Å; L100-V102 PolarHBondContact O-N 3.49Å; V102-F104 PolarHBondContact O-N 3.41Å; V102-T105 WeakPolarHBondContact O-CB 3.28Å; V102-T105 PolarHBondContact O-N 3.36Å; V102-C106 WeakPolarHBondContact O-CB 3.4Å; V102-C106 PolarHBondContact O-N 3.3Å; V102-C106 PolarHBondContact O-SG 2.79Å; V102-C106 VanDerWaalsContact O-SG 3.41Å
103	S	93.6	Very high	85.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-45.7	178.7	-171.7	0	0	0	0	112.1	P99 L100 T105 C106 A107 H129 F132	P99-S103 WeakPolarHBondContact O-CB 3.43Å; P99-S103 PolarHBondContact O-N 2.9Å; L100-S103 PolarHBondContact O-N 2.93Å; S103-T105 PolarHBondContact O-N 2.93Å; S103-C106 PolarHBondContact O-N 3.48Å; S103-A107 WeakPolarHBondContact O-CB 3.21Å; S103-A107 PolarHBondContact O-N 2.89Å; S103-H129 PolarHBondContact OG-ND1 3.32Å; S103-F132 VanDerWaalsContact OG-CD2 3.27Å; S103-F132 WeakPolarHBondContact OG-CD2 3.39Å
104	F	92.5	Very high	86.7	Confident	95 Å²	95	31.2 Å²	31.2	42%	0.417	18%	0.183	S	C	.	.	H	α-helix	trans	-59.4	-45.5	173	-78.5	-62.3	0	0	0	112.8	L100 V102 C106 A107 F108 H129	L100-F104 HydrophobicContact CD1-CD2 4.5Å; L100-F104 HydrophobicContact CD1-CE2 3.95Å; L100-F104 HydrophobicContact CD2-CE2 4.28Å; L100-F104 HydrophobicContact CG-CD2 4.13Å; L100-F104 HydrophobicContact CG-CE2 3.76Å; L100-F104 VanDerWaalsContact O-CD2 3.26Å; L100-F104 WeakPolarHBondContact O-CD2 3.44Å; L100-F104 PolarHBondContact O-N 3.2Å; V102-F104 PolarHBondContact O-N 3.41Å; F104-C106 PolarHBondContact O-N 3.35Å; F104-A107 PolarHBondContact O-N 2.85Å; F104-F108 PolarHBondContact O-N 3.28Å; F104-F108 VanDerWaalsContact O-N 3.13Å; F104-H129 AromaticContact CD1-CE1 3.94Å; F104-H129 AromaticContact CD2-CE1 3.91Å; F104-H129 AromaticContact CE1-CE1 3.7Å; F104-H129 AromaticContact CE2-CE1 3.66Å; F104-H129 AromaticContact CZ-CE1 3.54Å; F104-H129 AromaticContact CZ-NE2 3.73Å
105	T	91.6	Very high	88.2	Confident	22 Å²	22	29.2 Å²	29.2	14%	0.135	17%	0.167	C	C	.	.	H	α-helix	trans	-59.8	-47.9	179.2	-52.3	0	0	0	0	110.6	T69 V72 S101 V102 S103 Y109	T69-T105 HydrophobicContact CG2-CG2 4.16Å; T69-T105 PolarHBondContact OG1-OG1 3.45Å; V72-T105 HydrophobicContact CG1-CG2 4.1Å; S101-T105 WeakPolarHBondContact O-CB 3.5Å; S101-T105 PolarHBondContact O-N 2.89Å; S101-T105 VanDerWaalsContact O-N 3.07Å; S101-T105 PolarHBondContact O-OG1 3.18Å; V102-T105 WeakPolarHBondContact O-CB 3.28Å; V102-T105 PolarHBondContact O-N 3.36Å; S103-T105 PolarHBondContact O-N 2.93Å; T105-Y109 HydrophobicContact CG2-CE2 4.17Å; T105-Y109 WeakPolarHBondContact O-CD2 3.37Å
106	C	92.5	Very high	89.6	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-70.8	-35.7	-180	-66.8	0	0	0	0	113.2	L86 V102 S103 F104 F108 Y109 H110 L111 V113	L86-C106 VanDerWaalsContact CD2-SG 3.56Å; V102-C106 WeakPolarHBondContact O-CB 3.4Å; V102-C106 PolarHBondContact O-N 3.3Å; V102-C106 PolarHBondContact O-SG 2.79Å; V102-C106 VanDerWaalsContact O-SG 3.41Å; S103-C106 PolarHBondContact O-N 3.48Å; F104-C106 PolarHBondContact O-N 3.35Å; C106-F108 VanDerWaalsContact C-N 3.33Å; C106-F108 PolarHBondContact O-N 3.28Å; C106-Y109 CarbonylContact O-C 3.57Å; C106-Y109 PolarHBondContact O-N 2.82Å; C106-H110 CarbonylContact O-C 3.55Å; C106-H110 PolarHBondContact O-N 3.47Å; C106-L111 HydrophobicContact CB-CB 4.19Å; C106-L111 PolarHBondContact O-N 2.86Å; C106-V113 HydrophobicContact CB-CG2 3.24Å
107	A	92.5	Very high	90.9	Very high	15 Å²	15	24.6 Å²	24.6	12%	0.124	13%	0.132	C	C	.	.	H	α-helix	trans	-61.8	-39.3	176.4	0	0	0	0	0	112.2	S103 F104 Y109 H110 S131	S103-A107 WeakPolarHBondContact O-CB 3.21Å; S103-A107 PolarHBondContact O-N 2.89Å; F104-A107 PolarHBondContact O-N 2.85Å; A107-Y109 VanDerWaalsContact C-N 3.28Å; A107-Y109 PolarHBondContact O-N 3.39Å; A107-H110 PolarHBondContact O-N 3.37Å; A107-H110 PolarHBondContact O-ND1 3.5Å; A107-S131 WeakPolarHBondContact CA-OG 3.27Å
108	F	90.6	Very high	91.7	Very high	124 Å²	124	21 Å²	21	54%	0.544	11%	0.108	S	C	.	.	H	α-helix	trans	-59	-36.8	174.7	-178.2	-103.7	0	0	0	112.9	F104 C106 P314	F104-F108 PolarHBondContact O-N 3.28Å; F104-F108 VanDerWaalsContact O-N 3.13Å; C106-F108 VanDerWaalsContact C-N 3.33Å; C106-F108 PolarHBondContact O-N 3.28Å; F108-P314 HydrophobicContact CD1-CG 4.21Å; F108-P314 HydrophobicContact CE1-CG 3.68Å; F108-P314 HydrophobicContact CE2-CG 4.23Å; F108-P314 HydrophobicContact CZ-CG 3.69Å; F108-P314 WeakPolarHBondContact O-CB 3.34Å
109	Y	90.8	Very high	92.1	Very high	16 Å²	16	21.8 Å²	21.8	6%	0.063	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	8.9	174.2	-56.5	-71.9	0	0	0	114.3	F76 T105 C106 A107 L111 V307 C310 D312 P314 I317 W331	F76-Y109 AromaticContact CE2-CD2 3.81Å; F76-Y109 HydrophobicContact CE2-CD2 3.81Å; F76-Y109 HydrophobicContact CE2-CE2 4.09Å; T105-Y109 HydrophobicContact CG2-CE2 4.17Å; T105-Y109 WeakPolarHBondContact O-CD2 3.37Å; C106-Y109 CarbonylContact O-C 3.57Å; C106-Y109 PolarHBondContact O-N 2.82Å; A107-Y109 VanDerWaalsContact C-N 3.28Å; A107-Y109 PolarHBondContact O-N 3.39Å; Y109-L111 PolarHBondContact O-N 2.75Å; Y109-L111 VanDerWaalsContact O-N 3.07Å; Y109-V307 VanDerWaalsContact CB-CG2 3.42Å; Y109-V307 HydrophobicContact CD1-CG1 4.05Å; Y109-V307 HydrophobicContact CD1-CG2 3.84Å; Y109-V307 HydrophobicContact CD2-CG2 4.34Å; Y109-V307 HydrophobicContact CE1-CG1 4.21Å; Y109-V307 HydrophobicContact CG-CG1 4.31Å; Y109-V307 HydrophobicContact CG-CG2 3.62Å; Y109-C310 VanDerWaalsContact OH-CA 3.25Å; Y109-C310 WeakPolarHBondContact OH-CA 3.19Å; Y109-C310 WeakPolarHBondContact OH-CB 3.42Å; Y109-C310 PolarHBondContact OH-O 3.38Å; Y109-D312 WeakPolarHBondContact CE1-O 3.16Å; Y109-P314 HydrophobicContact CD1-CB 4.16Å; Y109-I317 HydrophobicContact CD1-CD1 4.44Å; Y109-W331 PolarHBondContact O-NE1 3.36Å
110	H	91	Very high	92.1	Very high	56 Å²	56	23.9 Å²	23.9	26%	0.259	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	18	-173.8	-57.1	-52.7	0	0	0	115.6	C106 A107 P112 K332 A335	C106-H110 CarbonylContact O-C 3.55Å; C106-H110 PolarHBondContact O-N 3.47Å; A107-H110 PolarHBondContact O-N 3.37Å; A107-H110 PolarHBondContact O-ND1 3.5Å; H110-P112 WeakPolarHBondContact O-CD 3.22Å; H110-K332 WeakPolarHBondContact NE2-CD 3.48Å; H110-K332 VanDerWaalsContact NE2-CE 3.3Å; H110-K332 WeakPolarHBondContact NE2-CE 3.15Å; H110-A335 HydrophobicContact CB-CB 4.1Å; H110-A335 WeakPolarHBondContact O-CB 3.37Å
111	L	92.9	Very high	92.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.			trans	-71.2	125.6	179.7	-177.5	69.1	0	0	0	110.1	F76 L86 C106 Y109 V113 S131 W331	F76-L111 HydrophobicContact CE1-CD2 3.46Å; F76-L111 VanDerWaalsContact CE1-CD2 3.46Å; F76-L111 HydrophobicContact CZ-CD2 3.71Å; L86-L111 HydrophobicContact CB-CD2 4.28Å; C106-L111 HydrophobicContact CB-CB 4.19Å; C106-L111 PolarHBondContact O-N 2.86Å; Y109-L111 PolarHBondContact O-N 2.75Å; Y109-L111 VanDerWaalsContact O-N 3.07Å; L111-V113 PolarHBondContact O-N 2.85Å; L111-S131 VanDerWaalsContact O-CB 3.27Å; L111-S131 WeakPolarHBondContact O-CB 3.47Å; L111-S131 PolarHBondContact O-OG 3.06Å; L111-W331 HydrophobicContact CD1-CH2 4.32Å; L111-W331 HydrophobicContact CD1-CZ2 3.88Å
112	P	95.1	Very high	92	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.117	C	C	.	.			trans	-62	129.8	176.3	-25.9	36.4	0	0	0	112.9	A85 L86 H110 S131 L338 F339 M342	A85-P112 WeakPolarHBondContact CA-O 3.37Å; L86-P112 PolarHBondContact N-O 3.44Å; H110-P112 WeakPolarHBondContact O-CD 3.22Å; P112-S131 WeakPolarHBondContact CA-O 3.26Å; P112-L338 HydrophobicContact CG-CD2 4.23Å; P112-L338 HydrophobicContact CG-CG 4.38Å; P112-F339 HydrophobicContact CB-CD2 4.34Å; P112-F339 HydrophobicContact CG-CB 4.39Å; P112-M342 HydrophobicContact CB-CE 3.94Å; P112-M342 HydrophobicContact CB-SD 3.56Å; P112-M342 VanDerWaalsContact CB-SD 3.56Å; P112-M342 HydrophobicContact CG-CE 4.32Å; P112-M342 HydrophobicContact CG-SD 4.2Å
113	V	95.1	Very high	92	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129	177.4	-177.2	0	0	0	0	110.1	L86 I88 C106 L111 S131 F132 L133	L86-V113 HydrophobicContact CB-CG2 4.45Å; L86-V113 CarbonylContact O-C 3.2Å; L86-V113 VanDerWaalsContact O-CA 3.26Å; L86-V113 WeakPolarHBondContact O-CA 3.39Å; I88-V113 HydrophobicContact CB-CG1 4.36Å; I88-V113 HydrophobicContact CG2-CG1 3.5Å; I88-V113 VanDerWaalsContact CG2-CG1 3.5Å; C106-V113 HydrophobicContact CB-CG2 3.24Å; L111-V113 PolarHBondContact O-N 2.85Å; V113-S131 PolarHBondContact N-O 3.38Å; V113-F132 HydrophobicContact CB-CD2 3.9Å; V113-F132 HydrophobicContact CB-CE2 4.48Å; V113-F132 HydrophobicContact CG1-CD2 3.76Å; V113-F132 HydrophobicContact CG1-CE2 3.85Å; V113-L133 PolarHBondContact O-N 3.28Å; V113-L133 VanDerWaalsContact O-O 3.12Å
114	I	95.8	Very high	91.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	105.9	176.6	-49.9	-175.7	0	0	0	109.8	L86 I87 I88 L133 T135 A282 I285 A286	L86-I114 PolarHBondContact O-N 2.88Å; I87-I114 WeakPolarHBondContact CA-O 3.33Å; I88-I114 PolarHBondContact N-O 3.41Å; I114-L133 CarbonylContact C-O 3.43Å; I114-L133 WeakPolarHBondContact CA-O 3.43Å; I114-L133 HydrophobicContact CB-CD1 4.31Å; I114-L133 HydrophobicContact CD1-CD1 4.41Å; I114-L133 HydrophobicContact CG1-CD1 3.96Å; I114-L133 HydrophobicContact CG1-CD2 4.23Å; I114-L133 HydrophobicContact CG1-CG 4.05Å; I114-L133 HydrophobicContact CG2-CD1 3.85Å; I114-T135 HydrophobicContact CG2-CG2 4.14Å; I114-A282 HydrophobicContact CB-CB 4.32Å; I114-A282 HydrophobicContact CD1-CB 4.43Å; I114-A282 HydrophobicContact CG2-CB 3.62Å; I114-I285 HydrophobicContact CD1-CB 4.31Å; I114-I285 HydrophobicContact CD1-CG2 4.12Å; I114-A286 HydrophobicContact CD1-CB 4.11Å
115	G	93.9	Very high	91.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	119.8	174.2	0	0	0	0	0	112.6	L133 R134 T135	G115-L133 PolarHBondContact N-O 3.06Å; G115-R134 CarbonylContact O-C 3.58Å; G115-R134 WeakPolarHBondContact O-CA 3.32Å; G115-R134 WeakPolarHBondContact O-CB 3.24Å; G115-T135 PolarHBondContact O-N 3.01Å
116	V	92.2	Very high	91.8	Very high	3 Å²	3	23.9 Å²	23.9	2%	0.018	12%	0.119	C	C	.	.	S	Bend	trans	-90.6	-37.7	-178	178.7	0	0	0	0	111.3	I87 I88 V136 E275 H278 V279 A282	I87-V116 HydrophobicContact CG2-CG2 3.3Å; I88-V116 WeakPolarHBondContact O-CB 3.29Å; I88-V116 PolarHBondContact O-N 3.08Å; V116-V136 WeakPolarHBondContact O-CG1 3.29Å; V116-E275 HydrophobicContact CG1-CG 3.75Å; V116-H278 HydrophobicContact CG1-CB 3.48Å; V116-H278 VanDerWaalsContact CG1-CB 3.48Å; V116-V279 HydrophobicContact CG1-CG2 3.79Å; V116-V279 HydrophobicContact CG2-CG2 4.11Å; V116-A282 HydrophobicContact CG2-CB 4.49Å
117	S	89.4	Confident	91.7	Very high	42 Å²	42	34.4 Å²	34.4	29%	0.294	16%	0.161	S	C	.	.	S	Bend	trans	-127	9.7	-179	64	0	0	0	0	114.3	S89 H90 R119	S89-S117 WeakPolarHBondContact CA-OG 3.29Å; H90-S117 PolarHBondContact N-OG 3.21Å; H90-S117 PolarHBondContact ND1-OG 2.59Å; S117-R119 PolarHBondContact O-N 2.8Å
118	A	89.4	Confident	91.6	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.008	17%	0.169	C	C	.	.			trans	-83.3	94.6	-175.2	0	0	0	0	0	113	F123 F132 R134	A118-F123 HydrophobicContact CB-CD2 4.11Å; A118-F123 HydrophobicContact CB-CE2 3.97Å; A118-F132 HydrophobicContact CB-CZ 3.86Å; A118-R134 WeakPolarHBondContact O-CD 3.4Å; A118-R134 PolarHBondContact O-NH1 3.2Å
119	R	89.8	Confident	91.6	Very high	16 Å²	16	29.9 Å²	29.9	6%	0.06	14%	0.143	C	C	.	.			trans	-97	-2.5	-176.8	-64.2	-163.1	66.2	-152.4	-10.1	116.1	S117 V136 P137 P138 F139 E142 E253	S117-R119 PolarHBondContact O-N 2.8Å; R119-V136 HydrophobicContact CG-CB 4.13Å; R119-V136 HydrophobicContact CG-CG2 3.92Å; R119-P137 WeakPolarHBondContact CG-O 3.39Å; R119-P137 PolarHBondContact NE-O 3.37Å; R119-P138 CarbonylContact O-C 3.54Å; R119-P138 WeakPolarHBondContact O-CA 3.36Å; R119-F139 HydrophobicContact CB-CD1 4.35Å; R119-F139 HydrophobicContact CB-CD2 3.83Å; R119-F139 HydrophobicContact CB-CE1 4.03Å; R119-F139 HydrophobicContact CB-CE2 3.47Å; R119-F139 VanDerWaalsContact CB-CE2 3.47Å; R119-F139 HydrophobicContact CB-CG 4.24Å; R119-F139 HydrophobicContact CB-CZ 3.58Å; R119-F139 HydrophobicContact CG-CZ 4.45Å; R119-F139 VanDerWaalsContact O-CD2 3.26Å; R119-F139 WeakPolarHBondContact O-CD2 3.38Å; R119-F139 PolarHBondContact O-N 3.29Å; R119-E142 IonicContact CZ-OE1 2.67Å; R119-E142 IonicContact NH1-OE1 3.1Å; R119-E142 IonicContact NH2-OE1 3.8Å; R119-E142 PolarHBondContact NH2-OE1 3.46Å; R119-E253 IonicContact CZ-OE2 2.84Å; R119-E253 IonicContact NH1-OE1 3.71Å; R119-E253 PolarHBondContact NH1-OE1 3.02Å; R119-E253 IonicContact NH1-OE2 2.62Å; R119-E253 PolarHBondContact NH1-OE2 3.01Å
120	H	90.1	Very high	91.6	Very high	45 Å²	45	30.8 Å²	30.8	21%	0.208	16%	0.157	C	C	.	.			trans	-68.2	138.5	174.5	-68.2	-64.7	0	0	0	112.3	I122 F123 R134 D167	H120-I122 VanDerWaalsContact C-N 3.27Å; H120-I122 HydrophobicContact CB-CG2 3.94Å; H120-I122 PolarHBondContact O-N 2.91Å; H120-F123 HydrophobicContact CB-CD2 4.11Å; H120-F123 HydrophobicContact CB-CE2 4.18Å; H120-F123 WeakPolarHBondContact O-CD2 3.29Å; H120-R134 PolarHBondContact O-NH1 2.94Å; H120-D167 WeakPolarHBondContact CA-OD2 3.35Å; H120-D167 IonicContact CE1-OD2 3.24Å; H120-D167 IonicContact CG-OD2 2.76Å; H120-D167 IonicContact ND1-OD2 3.19Å; H120-D167 PolarHBondContact ND1-OD2 3.42Å
121	S	90.9	Very high	91.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-77.6	-10	-177.8	-56.4	0	0	0	0	113.3	F123 S124 P138 S140 H166 D167	S121-F123 PolarHBondContact O-N 3.23Å; S121-S124 VanDerWaalsContact O-CB 3.32Å; S121-S124 WeakPolarHBondContact O-CB 3.23Å; S121-S124 PolarHBondContact O-N 3.34Å; S121-S124 VanDerWaalsContact O-N 3.09Å; S121-S124 PolarHBondContact O-OG 3.04Å; S121-P138 WeakPolarHBondContact OG-CB 3.49Å; S121-S140 WeakPolarHBondContact OG-CB 3.24Å; S121-S140 PolarHBondContact OG-N 3.23Å; S121-S140 PolarHBondContact OG-OG 3.49Å; S121-H166 PolarHBondContact O-CE1 3.49Å; S121-D167 WeakPolarHBondContact CA-OD1 3.31Å; S121-D167 VanDerWaalsContact CB-OD1 3.29Å; S121-D167 WeakPolarHBondContact CB-OD1 3.48Å; S121-D167 PolarHBondContact N-OD1 3.3Å
122	I	90.7	Very high	91.8	Very high	61 Å²	61	28.3 Å²	28.3	31%	0.313	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-54.9	-37.2	169.5	-166	168.8	0	0	0	112.1	L100 H120 S124 D125 H129 H166	L100-I122 HydrophobicContact CD1-CD1 4.06Å; L100-I122 HydrophobicContact CD1-CG1 4.42Å; L100-I122 HydrophobicContact CD1-CG2 3.99Å; L100-I122 HydrophobicContact CD2-CD1 4.37Å; H120-I122 VanDerWaalsContact C-N 3.27Å; H120-I122 HydrophobicContact CB-CG2 3.94Å; H120-I122 PolarHBondContact O-N 2.91Å; I122-S124 PolarHBondContact O-N 3.42Å; I122-D125 PolarHBondContact O-N 2.87Å; I122-D125 VanDerWaalsContact O-N 3.12Å; I122-H129 PolarHBondContact O-CD2 2.91Å; I122-H166 PolarHBondContact N-ND1 2.95Å
123	F	91.9	Very high	91.8	Very high	5 Å²	5	28.4 Å²	28.4	2%	0.022	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-68.4	-14.8	178.6	-66.1	-71.5	0	0	0	114.5	P99 L100 A118 H120 S121 D125 F132	P99-F123 HydrophobicContact CB-CZ 4.26Å; L100-F123 HydrophobicContact CB-CE1 4.44Å; L100-F123 HydrophobicContact CB-CZ 4.16Å; L100-F123 HydrophobicContact CD1-CE1 3.92Å; L100-F123 HydrophobicContact CD1-CZ 4.07Å; A118-F123 HydrophobicContact CB-CD2 4.11Å; A118-F123 HydrophobicContact CB-CE2 3.97Å; H120-F123 HydrophobicContact CB-CD2 4.11Å; H120-F123 HydrophobicContact CB-CE2 4.18Å; H120-F123 WeakPolarHBondContact O-CD2 3.29Å; S121-F123 PolarHBondContact O-N 3.23Å; F123-D125 VanDerWaalsContact C-N 3.28Å; F123-F132 HydrophobicContact CB-CD1 3.72Å; F123-F132 HydrophobicContact CB-CE1 3.55Å; F123-F132 HydrophobicContact CB-CZ 4.22Å; F123-F132 HydrophobicContact CD1-CD1 4.14Å; F123-F132 HydrophobicContact CD1-CD2 4.12Å; F123-F132 AromaticContact CD1-CE1 3.92Å; F123-F132 HydrophobicContact CD1-CE1 3.92Å; F123-F132 AromaticContact CD1-CE2 3.89Å; F123-F132 HydrophobicContact CD1-CE2 3.89Å; F123-F132 HydrophobicContact CD1-CG 4.23Å; F123-F132 AromaticContact CD1-CZ 3.78Å; F123-F132 HydrophobicContact CD1-CZ 3.78Å; F123-F132 HydrophobicContact CE1-CE2 4.13Å; F123-F132 HydrophobicContact CE1-CZ 4.24Å; F123-F132 HydrophobicContact CG-CD1 4.22Å; F123-F132 AromaticContact CG-CE1 3.78Å; F123-F132 HydrophobicContact CG-CE1 3.78Å; F123-F132 AromaticContact CG-CZ 3.93Å; F123-F132 HydrophobicContact CG-CZ 3.93Å
124	S	91	Very high	91.7	Very high	10 Å²	10	28.3 Å²	28.3	7%	0.07	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-74.3	-18.8	173.4	-56.4	0	0	0	0	112.3	S121 I122 K126 R134 D362	S121-S124 VanDerWaalsContact O-CB 3.32Å; S121-S124 WeakPolarHBondContact O-CB 3.23Å; S121-S124 PolarHBondContact O-N 3.34Å; S121-S124 VanDerWaalsContact O-N 3.09Å; S121-S124 PolarHBondContact O-OG 3.04Å; I122-S124 PolarHBondContact O-N 3.42Å; S124-K126 PolarHBondContact O-N 2.99Å; S124-K126 VanDerWaalsContact O-N 3.14Å; S124-R134 PolarHBondContact OG-NH2 3.15Å; S124-D362 WeakPolarHBondContact CB-OD2 3.49Å; S124-D362 PolarHBondContact OG-OD1 3.2Å; S124-D362 PolarHBondContact OG-OD2 3Å
125	D	92	Very high	91.5	Very high	54 Å²	54	28.3 Å²	28.3	29%	0.289	15%	0.147	S	C	.	.			trans	-70.4	108.5	175.6	174.7	31.7	0	0	0	110.8	I122 F123 Y127 S128 H129	I122-D125 PolarHBondContact O-N 2.87Å; I122-D125 VanDerWaalsContact O-N 3.12Å; F123-D125 VanDerWaalsContact C-N 3.28Å; D125-Y127 VanDerWaalsContact C-N 3.3Å; D125-Y127 PolarHBondContact O-N 3.17Å; D125-Y127 VanDerWaalsContact OD1-CB 3.29Å; D125-Y127 WeakPolarHBondContact OD1-CB 3.11Å; D125-Y127 PolarHBondContact OD1-N 3.42Å; D125-S128 WeakPolarHBondContact OD2-CB 3.48Å; D125-S128 PolarHBondContact OD2-N 3.44Å; D125-S128 PolarHBondContact OD2-OG 3.42Å; D125-H129 WeakPolarHBondContact O-CA 3.1Å; D125-H129 WeakPolarHBondContact O-CB 3.41Å; D125-H129 PolarHBondContact O-N 3.3Å
126	K	90.5	Very high	91.5	Very high	52 Å²	52	28.6 Å²	28.6	23%	0.226	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-12.1	178.7	-71.5	-75	169.3	-91.9	0	113.8	S124 G130 F132 Y360	S124-K126 PolarHBondContact O-N 2.99Å; S124-K126 VanDerWaalsContact O-N 3.14Å; K126-G130 VanDerWaalsContact O-CA 3.3Å; K126-G130 WeakPolarHBondContact O-CA 3.21Å; K126-G130 PolarHBondContact O-N 3.01Å; K126-F132 PolarHBondContact NZ-O 3.33Å; K126-Y360 WeakPolarHBondContact CE-O 3.43Å; K126-Y360 PolarHBondContact NZ-O 2.87Å
127	Y	90.8	Very high	91.5	Very high	222 Å²	222	28.5 Å²	28.5	87%	0.871	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-49	170.1	-172.3	-95.7	0	0	0	110.4	D125	D125-Y127 VanDerWaalsContact C-N 3.3Å; D125-Y127 PolarHBondContact O-N 3.17Å; D125-Y127 VanDerWaalsContact OD1-CB 3.29Å; D125-Y127 WeakPolarHBondContact OD1-CB 3.11Å; D125-Y127 PolarHBondContact OD1-N 3.42Å
128	S	89.2	Confident	91.7	Very high	42 Å²	42	26.5 Å²	26.5	29%	0.294	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-40.2	177.9	-57.1	0	0	0	0	113.7	D125	D125-S128 WeakPolarHBondContact OD2-CB 3.48Å; D125-S128 PolarHBondContact OD2-N 3.44Å; D125-S128 PolarHBondContact OD2-OG 3.42Å
129	H	91.9	Very high	91.8	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.137	C	C	.	.			trans	-120.2	51	-169.7	-59	-68.8	0	0	0	112.5	S103 F104 I122 D125 S131 F132	S103-H129 PolarHBondContact OG-ND1 3.32Å; F104-H129 AromaticContact CD1-CE1 3.94Å; F104-H129 AromaticContact CD2-CE1 3.91Å; F104-H129 AromaticContact CE1-CE1 3.7Å; F104-H129 AromaticContact CE2-CE1 3.66Å; F104-H129 AromaticContact CZ-CE1 3.54Å; F104-H129 AromaticContact CZ-NE2 3.73Å; I122-H129 PolarHBondContact O-CD2 2.91Å; D125-H129 WeakPolarHBondContact O-CA 3.1Å; D125-H129 WeakPolarHBondContact O-CB 3.41Å; D125-H129 PolarHBondContact O-N 3.3Å; H129-S131 VanDerWaalsContact C-N 3.27Å; H129-S131 PolarHBondContact O-N 3.21Å; H129-S131 VanDerWaalsContact O-N 3.11Å; H129-F132 HydrophobicContact CB-CB 3.97Å; H129-F132 WeakPolarHBondContact O-CB 3.48Å; H129-F132 PolarHBondContact O-N 3.15Å; H129-F132 VanDerWaalsContact O-N 3.12Å
130	G	91.2	Very high	91.9	Very high	35 Å²	35	27.4 Å²	27.4	36%	0.361	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.3	-170.4	0	0	0	0	0	117.2	K126 F339	K126-G130 VanDerWaalsContact O-CA 3.3Å; K126-G130 WeakPolarHBondContact O-CA 3.21Å; K126-G130 PolarHBondContact O-N 3.01Å; G130-F339 WeakPolarHBondContact O-CE1 3.09Å
131	S	92.1	Very high	92	Very high	5 Å²	5	27.6 Å²	27.6	4%	0.035	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	13.3	177.7	67.7	0	0	0	0	114.2	A107 L111 P112 V113 H129 F339	A107-S131 WeakPolarHBondContact CA-OG 3.27Å; L111-S131 VanDerWaalsContact O-CB 3.27Å; L111-S131 WeakPolarHBondContact O-CB 3.47Å; L111-S131 PolarHBondContact O-OG 3.06Å; P112-S131 WeakPolarHBondContact CA-O 3.26Å; V113-S131 PolarHBondContact N-O 3.38Å; H129-S131 VanDerWaalsContact C-N 3.27Å; H129-S131 PolarHBondContact O-N 3.21Å; H129-S131 VanDerWaalsContact O-N 3.11Å; S131-F339 WeakPolarHBondContact O-CE2 3.31Å
132	F	95.1	Very high	92.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	135.6	-177.6	-168.6	-89.2	0	0	0	112.3	I88 S103 V113 A118 F123 K126 H129 R134	I88-F132 HydrophobicContact CG2-CE2 4.27Å; S103-F132 VanDerWaalsContact OG-CD2 3.27Å; S103-F132 WeakPolarHBondContact OG-CD2 3.39Å; V113-F132 HydrophobicContact CB-CD2 3.9Å; V113-F132 HydrophobicContact CB-CE2 4.48Å; V113-F132 HydrophobicContact CG1-CD2 3.76Å; V113-F132 HydrophobicContact CG1-CE2 3.85Å; A118-F132 HydrophobicContact CB-CZ 3.86Å; F123-F132 HydrophobicContact CB-CD1 3.72Å; F123-F132 HydrophobicContact CB-CE1 3.55Å; F123-F132 HydrophobicContact CB-CZ 4.22Å; F123-F132 HydrophobicContact CD1-CD1 4.14Å; F123-F132 HydrophobicContact CD1-CD2 4.12Å; F123-F132 AromaticContact CD1-CE1 3.92Å; F123-F132 HydrophobicContact CD1-CE1 3.92Å; F123-F132 AromaticContact CD1-CE2 3.89Å; F123-F132 HydrophobicContact CD1-CE2 3.89Å; F123-F132 HydrophobicContact CD1-CG 4.23Å; F123-F132 AromaticContact CD1-CZ 3.78Å; F123-F132 HydrophobicContact CD1-CZ 3.78Å; F123-F132 HydrophobicContact CE1-CE2 4.13Å; F123-F132 HydrophobicContact CE1-CZ 4.24Å; F123-F132 HydrophobicContact CG-CD1 4.22Å; F123-F132 AromaticContact CG-CE1 3.78Å; F123-F132 HydrophobicContact CG-CE1 3.78Å; F123-F132 AromaticContact CG-CZ 3.93Å; F123-F132 HydrophobicContact CG-CZ 3.93Å; K126-F132 PolarHBondContact NZ-O 3.33Å; H129-F132 HydrophobicContact CB-CB 3.97Å; H129-F132 WeakPolarHBondContact O-CB 3.48Å; H129-F132 PolarHBondContact O-N 3.15Å; H129-F132 VanDerWaalsContact O-N 3.12Å; F132-R134 HydrophobicContact CE1-CB 4.01Å; F132-R134 HydrophobicContact CE1-CG 4.21Å
133	L	94.6	Very high	92.2	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	164.3	168.4	73.5	100.5	0	0	0	109.9	V113 I114 G115 F339 M342 L343 F357 G361	V113-L133 PolarHBondContact O-N 3.28Å; V113-L133 VanDerWaalsContact O-O 3.12Å; I114-L133 CarbonylContact C-O 3.43Å; I114-L133 WeakPolarHBondContact CA-O 3.43Å; I114-L133 HydrophobicContact CB-CD1 4.31Å; I114-L133 HydrophobicContact CD1-CD1 4.41Å; I114-L133 HydrophobicContact CG1-CD1 3.96Å; I114-L133 HydrophobicContact CG1-CD2 4.23Å; I114-L133 HydrophobicContact CG1-CG 4.05Å; I114-L133 HydrophobicContact CG2-CD1 3.85Å; G115-L133 PolarHBondContact N-O 3.06Å; L133-F339 HydrophobicContact CB-CE2 4.15Å; L133-F339 HydrophobicContact CD2-CD2 4.16Å; L133-F339 HydrophobicContact CD2-CE2 3.92Å; L133-M342 HydrophobicContact CD2-CB 3.67Å; L133-M342 HydrophobicContact CD2-CG 4.34Å; L133-M342 HydrophobicContact CD2-SD 3.87Å; L133-L343 HydrophobicContact CB-CD2 4.45Å; L133-F357 HydrophobicContact CD1-CE1 4.17Å; L133-F357 HydrophobicContact CD1-CE2 4.27Å; L133-F357 HydrophobicContact CD1-CZ 3.92Å; L133-G361 CarbonylContact C-O 3.38Å; L133-G361 VanDerWaalsContact CA-O 3.3Å; L133-G361 WeakPolarHBondContact CA-O 3.42Å
134	R	93.4	Very high	92.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	142.9	-177.8	52.8	173.5	170	-162.7	-16.3	115.7	G115 A118 H120 S124 F132 V136 F357 G361 D362	G115-R134 CarbonylContact O-C 3.58Å; G115-R134 WeakPolarHBondContact O-CA 3.32Å; G115-R134 WeakPolarHBondContact O-CB 3.24Å; A118-R134 WeakPolarHBondContact O-CD 3.4Å; A118-R134 PolarHBondContact O-NH1 3.2Å; H120-R134 PolarHBondContact O-NH1 2.94Å; S124-R134 PolarHBondContact OG-NH2 3.15Å; F132-R134 HydrophobicContact CE1-CB 4.01Å; F132-R134 HydrophobicContact CE1-CG 4.21Å; R134-V136 VanDerWaalsContact C-N 3.3Å; R134-V136 HydrophobicContact CB-CG2 4.5Å; R134-V136 WeakPolarHBondContact CD-O 3.27Å; R134-V136 VanDerWaalsContact CG-O 3.31Å; R134-V136 WeakPolarHBondContact CG-O 3.46Å; R134-V136 PolarHBondContact O-N 3.36Å; R134-F357 VanDerWaalsContact O-CE1 3.3Å; R134-F357 WeakPolarHBondContact O-CE1 3.26Å; R134-G361 PolarHBondContact N-O 3.24Å; R134-D362 IonicContact CZ-OD1 3.52Å; R134-D362 IonicContact NE-OD1 2.69Å; R134-D362 PolarHBondContact NE-OD1 3.01Å; R134-D362 IonicContact NH2-OD1 2.8Å; R134-D362 PolarHBondContact NH2-OD1 3.19Å; R134-D362 IonicContact NH2-OD2 3.91Å
135	T	92.8	Very high	92.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-82.2	-4.9	178.9	55.4	0	0	0	0	114.2	I114 G115 H278 A282 I285 L355 R363	I114-T135 HydrophobicContact CG2-CG2 4.14Å; G115-T135 PolarHBondContact O-N 3.01Å; T135-H278 PolarHBondContact O-CE1 2.82Å; T135-H278 PolarHBondContact O-ND1 3.28Å; T135-H278 PolarHBondContact OG1-ND1 3.5Å; T135-A282 HydrophobicContact CG2-CB 4.34Å; T135-I285 HydrophobicContact CG2-CD1 4.06Å; T135-L355 HydrophobicContact CG2-CD1 4.45Å; T135-R363 WeakPolarHBondContact O-CD 3.43Å; T135-R363 PolarHBondContact O-NH1 3.12Å
136	V	92.2	Very high	92.3	Very high	6 Å²	6	22.9 Å²	22.9	4%	0.036	12%	0.12	C	C	.	.	S	Bend	trans	-111.3	146.1	172.8	-73.9	0	0	0	0	110.4	V116 R119 R134 L270 H278	V116-V136 WeakPolarHBondContact O-CG1 3.29Å; R119-V136 HydrophobicContact CG-CB 4.13Å; R119-V136 HydrophobicContact CG-CG2 3.92Å; R134-V136 VanDerWaalsContact C-N 3.3Å; R134-V136 HydrophobicContact CB-CG2 4.5Å; R134-V136 WeakPolarHBondContact CD-O 3.27Å; R134-V136 VanDerWaalsContact CG-O 3.31Å; R134-V136 WeakPolarHBondContact CG-O 3.46Å; R134-V136 PolarHBondContact O-N 3.36Å; V136-L270 HydrophobicContact CG1-CD2 4.17Å; V136-H278 VanDerWaalsContact CG1-CE1 3.46Å; V136-H278 WeakPolarHBondContact CG1-CE1 3.32Å
137	P	93.1	Very high	92.4	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.006	11%	0.11	C	C	.	.			trans	-77.4	153.2	174.7	34.3	-37.5	0	0	0	112	R119 N141 L270 P366 Y368	R119-P137 WeakPolarHBondContact CG-O 3.39Å; R119-P137 PolarHBondContact NE-O 3.37Å; P137-N141 HydrophobicContact CB-CB 4.41Å; P137-L270 HydrophobicContact CG-CD1 3.74Å; P137-L270 HydrophobicContact CG-CD2 4.43Å; P137-P366 HydrophobicContact CB-CB 4.1Å; P137-P366 HydrophobicContact CB-CG 3.87Å; P137-P366 HydrophobicContact CG-CB 3.69Å; P137-P366 HydrophobicContact CG-CG 3.93Å; P137-Y368 WeakPolarHBondContact CB-OH 3.47Å; P137-Y368 HydrophobicContact CG-CE1 4.4Å; P137-Y368 VanDerWaalsContact CG-OH 3.25Å; P137-Y368 WeakPolarHBondContact CG-OH 3.46Å
138	P	92.9	Very high	92.4	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	8%	0.075	C	C	.	.			trans	-64.3	159.1	170.7	20.1	-26.8	0	0	0	113.4	R119 S121 S140 N141	R119-P138 CarbonylContact O-C 3.54Å; R119-P138 WeakPolarHBondContact O-CA 3.36Å; S121-P138 WeakPolarHBondContact OG-CB 3.49Å; P138-S140 PolarHBondContact O-N 2.81Å; P138-N141 WeakPolarHBondContact CG-OD1 3.34Å; P138-N141 PolarHBondContact O-N 3.13Å
139	F	92.3	Very high	92.5	Very high	17 Å²	17	9.2 Å²	9.2	8%	0.075	6%	0.061	C	C	.	.	G	3₁₀ helix	trans	-58.4	-32.3	167.4	-64.5	-62.3	0	0	0	112.1	R119 N141 E142 F224 Q254	R119-F139 HydrophobicContact CB-CD1 4.35Å; R119-F139 HydrophobicContact CB-CD2 3.83Å; R119-F139 HydrophobicContact CB-CE1 4.03Å; R119-F139 HydrophobicContact CB-CE2 3.47Å; R119-F139 VanDerWaalsContact CB-CE2 3.47Å; R119-F139 HydrophobicContact CB-CG 4.24Å; R119-F139 HydrophobicContact CB-CZ 3.58Å; R119-F139 HydrophobicContact CG-CZ 4.45Å; R119-F139 VanDerWaalsContact O-CD2 3.26Å; R119-F139 WeakPolarHBondContact O-CD2 3.38Å; R119-F139 PolarHBondContact O-N 3.29Å; F139-N141 PolarHBondContact O-N 3.08Å; F139-N141 VanDerWaalsContact O-N 3.11Å; F139-E142 WeakPolarHBondContact O-CB 3.46Å; F139-E142 PolarHBondContact O-N 3.03Å; F139-F224 HydrophobicContact CB-CE2 4.2Å; F139-F224 HydrophobicContact CB-CZ 3.98Å; F139-Q254 HydrophobicContact CD1-CG 4.01Å; F139-Q254 HydrophobicContact CE1-CG 3.55Å; F139-Q254 HydrophobicContact CE2-CG 4.11Å; F139-Q254 VanDerWaalsContact CE2-NE2 3.28Å; F139-Q254 HydrophobicContact CG-CG 4.49Å; F139-Q254 HydrophobicContact CZ-CG 3.6Å
140	S	92.1	Very high	92.4	Very high	18 Å²	18	9.3 Å²	9.3	13%	0.126	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	-63.2	-17.9	177.4	60.4	0	0	0	0	114.8	S121 P138 E142 A143	S121-S140 WeakPolarHBondContact OG-CB 3.24Å; S121-S140 PolarHBondContact OG-N 3.23Å; S121-S140 PolarHBondContact OG-OG 3.49Å; P138-S140 PolarHBondContact O-N 2.81Å; S140-E142 PolarHBondContact O-N 2.98Å; S140-A143 WeakPolarHBondContact O-CB 3.48Å; S140-A143 PolarHBondContact O-N 3.49Å
141	N	92.4	Very high	92.2	Very high	49 Å²	49	10.4 Å²	10.4	26%	0.262	6%	0.057	S	C	.	.	G	3₁₀ helix	trans	-72.8	-15.1	174.2	-74.9	12.2	0	0	0	112.5	P137 P138 F139 A143 S144	P137-N141 HydrophobicContact CB-CB 4.41Å; P138-N141 WeakPolarHBondContact CG-OD1 3.34Å; P138-N141 PolarHBondContact O-N 3.13Å; F139-N141 PolarHBondContact O-N 3.08Å; F139-N141 VanDerWaalsContact O-N 3.11Å; N141-A143 PolarHBondContact O-N 2.91Å; N141-S144 PolarHBondContact O-N 2.81Å; N141-S144 PolarHBondContact O-OG 2.72Å
142	E	92.6	Very high	91.9	Very high	1 Å²	1	11 Å²	11	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-65.1	-21.7	173.8	-66.4	171	-153.3	0	0	111.6	R119 F139 S140 S144 I145 W146 T252 E253 V268 Y368	R119-E142 IonicContact CZ-OE1 2.67Å; R119-E142 IonicContact NH1-OE1 3.1Å; R119-E142 IonicContact NH2-OE1 3.8Å; R119-E142 PolarHBondContact NH2-OE1 3.46Å; F139-E142 WeakPolarHBondContact O-CB 3.46Å; F139-E142 PolarHBondContact O-N 3.03Å; S140-E142 PolarHBondContact O-N 2.98Å; E142-S144 VanDerWaalsContact C-N 3.32Å; E142-S144 PolarHBondContact O-N 3.47Å; E142-I145 WeakPolarHBondContact O-CB 3.29Å; E142-I145 PolarHBondContact O-N 2.96Å; E142-I145 VanDerWaalsContact O-N 3.13Å; E142-W146 PolarHBondContact O-N 3.1Å; E142-T252 VanDerWaalsContact OE2-CA 3.31Å; E142-T252 WeakPolarHBondContact OE2-CA 3.4Å; E142-T252 WeakPolarHBondContact OE2-CB 3.03Å; E142-E253 PolarHBondContact OE2-N 3.28Å; E142-E253 VanDerWaalsContact OE2-N 3.14Å; E142-V268 HydrophobicContact CG-CG1 4.18Å; E142-Y368 HydrophobicContact CG-CE1 4.07Å
143	A	92.3	Very high	91.6	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.008	7%	0.065	C	C	.	.	H	α-helix	trans	-61	-33.9	176.3	0	0	0	0	0	113.8	S140 N141 I145 W146 V147 V171 Y174	S140-A143 WeakPolarHBondContact O-CB 3.48Å; S140-A143 PolarHBondContact O-N 3.49Å; N141-A143 PolarHBondContact O-N 2.91Å; A143-I145 VanDerWaalsContact C-N 3.28Å; A143-I145 PolarHBondContact O-N 2.97Å; A143-W146 PolarHBondContact O-N 2.95Å; A143-V147 WeakPolarHBondContact O-CG2 3.38Å; A143-V147 PolarHBondContact O-N 3.17Å; A143-V147 VanDerWaalsContact O-N 3.08Å; A143-V171 HydrophobicContact CB-CB 4.38Å; A143-V171 HydrophobicContact CB-CG1 4.01Å; A143-V171 HydrophobicContact CB-CG2 4.19Å; A143-Y174 HydrophobicContact CB-CD1 3.58Å; A143-Y174 HydrophobicContact CB-CE1 4.33Å; A143-Y174 HydrophobicContact CB-CG 3.98Å
144	S	90.8	Very high	91.1	Very high	28 Å²	28	14.5 Å²	14.5	20%	0.196	9%	0.093	C	C	.	.	H	α-helix	trans	-67.3	-34.4	176.6	74.3	0	0	0	0	111.7	N141 E142 V147 D148 Y174	N141-S144 PolarHBondContact O-N 2.81Å; N141-S144 PolarHBondContact O-OG 2.72Å; E142-S144 VanDerWaalsContact C-N 3.32Å; E142-S144 PolarHBondContact O-N 3.47Å; S144-V147 PolarHBondContact O-N 3.37Å; S144-D148 PolarHBondContact O-N 3.13Å; S144-D148 VanDerWaalsContact O-N 3.07Å; S144-Y174 WeakPolarHBondContact CB-OH 3.36Å
145	I	93.2	Very high	90.9	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-71.7	-39.4	179.1	-54	175.1	0	0	0	109.7	E142 A143 D148 L149 V268 Y368 I370 Y402	E142-I145 WeakPolarHBondContact O-CB 3.29Å; E142-I145 PolarHBondContact O-N 2.96Å; E142-I145 VanDerWaalsContact O-N 3.13Å; A143-I145 VanDerWaalsContact C-N 3.28Å; A143-I145 PolarHBondContact O-N 2.97Å; I145-D148 PolarHBondContact O-N 3.34Å; I145-L149 HydrophobicContact CG2-CD1 4.1Å; I145-L149 HydrophobicContact CG2-CG 4.49Å; I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 VanDerWaalsContact O-CG 3.27Å; I145-L149 WeakPolarHBondContact O-CG 3.43Å; I145-L149 PolarHBondContact O-N 3.17Å; I145-V268 HydrophobicContact CB-CG2 4.35Å; I145-V268 HydrophobicContact CD1-CG1 3.65Å; I145-V268 HydrophobicContact CG2-CG1 4.28Å; I145-V268 HydrophobicContact CG2-CG2 3.77Å; I145-Y368 HydrophobicContact CD1-CD1 4.09Å; I145-Y368 HydrophobicContact CD1-CD2 3.27Å; I145-Y368 HydrophobicContact CD1-CE1 4.43Å; I145-Y368 HydrophobicContact CD1-CE2 3.57Å; I145-Y368 HydrophobicContact CD1-CG 3.51Å; I145-I370 HydrophobicContact CG2-CD1 4.5Å; I145-Y402 HydrophobicContact CB-CD2 4.45Å; I145-Y402 HydrophobicContact CD1-CD1 3.75Å; I145-Y402 HydrophobicContact CD1-CE1 4.22Å; I145-Y402 HydrophobicContact CD1-CG 4.05Å; I145-Y402 HydrophobicContact CG1-CD1 3.56Å; I145-Y402 HydrophobicContact CG1-CD2 4.09Å; I145-Y402 HydrophobicContact CG1-CE1 3.62Å; I145-Y402 HydrophobicContact CG1-CE2 4.14Å; I145-Y402 HydrophobicContact CG1-CG 3.78Å; I145-Y402 HydrophobicContact CG2-CD2 4.05Å; I145-Y402 HydrophobicContact CG2-CG 4.18Å
146	W	93.5	Very high	90.6	Very high	1 Å²	1	22.2 Å²	22.2	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-61.6	-43.9	173.4	-68.4	7.7	0	0	0	111.8	E142 A143 D148 L149 I150 V171 L175 L222 F224 I250 T252	E142-W146 PolarHBondContact O-N 3.1Å; A143-W146 PolarHBondContact O-N 2.95Å; W146-D148 PolarHBondContact O-N 2.87Å; W146-L149 PolarHBondContact O-N 3.45Å; W146-I150 WeakPolarHBondContact O-CB 3.25Å; W146-I150 WeakPolarHBondContact O-CD1 3.43Å; W146-I150 WeakPolarHBondContact O-CG1 3.45Å; W146-I150 PolarHBondContact O-N 2.81Å; W146-V171 HydrophobicContact CE3-CG1 4.34Å; W146-V171 HydrophobicContact CZ3-CG1 4.04Å; W146-L175 HydrophobicContact CE3-CD1 4.23Å; W146-L222 HydrophobicContact CE3-CB 3.92Å; W146-L222 HydrophobicContact CE3-CD1 4.06Å; W146-L222 HydrophobicContact CE3-CG 4.41Å; W146-L222 HydrophobicContact CH2-CB 4.28Å; W146-L222 HydrophobicContact CZ3-CB 3.69Å; W146-F224 HydrophobicContact CH2-CB 4Å; W146-F224 HydrophobicContact CH2-CD2 4.29Å; W146-I250 HydrophobicContact CD2-CG2 4.3Å; W146-I250 HydrophobicContact CG-CG2 4.14Å; W146-I250 HydrophobicContact CZ2-CG2 4.48Å; W146-T252 HydrophobicContact CH2-CG2 3.93Å; W146-T252 HydrophobicContact CZ2-CG2 3.62Å
147	V	91.9	Very high	90.3	Very high	5 Å²	5	23.5 Å²	23.5	3%	0.03	13%	0.128	C	C	.	.	H	α-helix	trans	-60.6	-45.6	175.5	171.7	0	0	0	0	111.6	A143 S144 L149 I150 K151 Y174 L175 A178 I183 F185	A143-V147 WeakPolarHBondContact O-CG2 3.38Å; A143-V147 PolarHBondContact O-N 3.17Å; A143-V147 VanDerWaalsContact O-N 3.08Å; S144-V147 PolarHBondContact O-N 3.37Å; V147-L149 VanDerWaalsContact C-N 3.34Å; V147-L149 PolarHBondContact O-N 2.89Å; V147-I150 PolarHBondContact O-N 3.25Å; V147-K151 WeakPolarHBondContact O-CG 3.16Å; V147-K151 PolarHBondContact O-N 3.44Å; V147-Y174 HydrophobicContact CG2-CD1 4.33Å; V147-Y174 HydrophobicContact CG2-CE1 3.97Å; V147-L175 HydrophobicContact CG2-CD2 3.76Å; V147-A178 HydrophobicContact CG1-CB 4.21Å; V147-A178 HydrophobicContact CG2-CB 3.68Å; V147-I183 HydrophobicContact CG1-CD1 3.71Å; V147-F185 HydrophobicContact CG1-CE1 4.5Å; V147-F185 HydrophobicContact CG2-CE1 4.42Å; V147-F185 HydrophobicContact CG2-CZ 4.28Å
148	D	90.4	Very high	90.2	Very high	25 Å²	25	23.4 Å²	23.4	13%	0.134	13%	0.127	C	C	.	.	H	α-helix	trans	-68.6	-31.9	178.9	-71.6	-24.6	0	0	0	112.5	S144 I145 W146 A152 Y402 P419 L422	S144-D148 PolarHBondContact O-N 3.13Å; S144-D148 VanDerWaalsContact O-N 3.07Å; I145-D148 PolarHBondContact O-N 3.34Å; W146-D148 PolarHBondContact O-N 2.87Å; D148-A152 WeakPolarHBondContact O-CB 3.19Å; D148-A152 PolarHBondContact O-N 3.35Å; D148-Y402 HydrophobicContact CB-CE2 4.01Å; D148-Y402 WeakPolarHBondContact OD2-CE2 3.47Å; D148-Y402 PolarHBondContact OD2-OH 3.48Å; D148-P419 HydrophobicContact CB-CB 3.76Å; D148-P419 HydrophobicContact CB-CG 4.15Å; D148-L422 HydrophobicContact CB-CD2 4.3Å; D148-L422 WeakPolarHBondContact O-CD2 3.37Å
149	L	91.5	Very high	90.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.5	-44.1	171.1	-76.8	169.2	0	0	0	112.3	I145 W146 V147 K151 A152 F153 I250 V268 I370 L422 I424	I145-L149 HydrophobicContact CG2-CD1 4.1Å; I145-L149 HydrophobicContact CG2-CG 4.49Å; I145-L149 WeakPolarHBondContact O-CB 3.4Å; I145-L149 VanDerWaalsContact O-CG 3.27Å; I145-L149 WeakPolarHBondContact O-CG 3.43Å; I145-L149 PolarHBondContact O-N 3.17Å; W146-L149 PolarHBondContact O-N 3.45Å; V147-L149 VanDerWaalsContact C-N 3.34Å; V147-L149 PolarHBondContact O-N 2.89Å; L149-K151 VanDerWaalsContact C-N 3.32Å; L149-K151 PolarHBondContact O-N 2.96Å; L149-A152 PolarHBondContact O-N 3.26Å; L149-F153 HydrophobicContact CB-CD2 4.41Å; L149-F153 HydrophobicContact CB-CE2 4.17Å; L149-F153 HydrophobicContact CD2-CE2 3.99Å; L149-F153 HydrophobicContact CD2-CZ 4.02Å; L149-F153 WeakPolarHBondContact O-CB 3.47Å; L149-F153 WeakPolarHBondContact O-CD2 3.47Å; L149-F153 VanDerWaalsContact O-CG 3.31Å; L149-F153 WeakPolarHBondContact O-CG 3.44Å; L149-F153 PolarHBondContact O-N 3.3Å; L149-I250 HydrophobicContact CB-CD1 4.07Å; L149-I250 HydrophobicContact CD1-CD1 4.1Å; L149-V268 HydrophobicContact CD1-CG2 4.47Å; L149-I370 HydrophobicContact CD2-CD1 4.33Å; L149-L422 HydrophobicContact CD2-CD1 4.09Å; L149-L422 HydrophobicContact CD2-CD2 4.23Å; L149-I424 HydrophobicContact CD2-CD1 3.79Å
150	I	90.9	Very high	90.3	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-57.7	-46	176.7	-72.3	161.2	0	0	0	110.4	W146 V147 F153 G154 W155 V158 F185 L222	W146-I150 WeakPolarHBondContact O-CB 3.25Å; W146-I150 WeakPolarHBondContact O-CD1 3.43Å; W146-I150 WeakPolarHBondContact O-CG1 3.45Å; W146-I150 PolarHBondContact O-N 2.81Å; V147-I150 PolarHBondContact O-N 3.25Å; I150-F153 PolarHBondContact O-N 3.5Å; I150-G154 PolarHBondContact O-N 2.8Å; I150-G154 VanDerWaalsContact O-N 3.09Å; I150-W155 HydrophobicContact CG1-CE3 4.25Å; I150-W155 HydrophobicContact CG2-CB 4.17Å; I150-W155 VanDerWaalsContact CG2-O 3.27Å; I150-W155 WeakPolarHBondContact CG2-O 3.28Å; I150-W155 PolarHBondContact O-N 2.95Å; I150-V158 HydrophobicContact CD1-CG1 4.14Å; I150-V158 HydrophobicContact CG1-CG1 4.27Å; I150-F185 HydrophobicContact CD1-CD2 4.37Å; I150-F185 HydrophobicContact CD1-CE2 4.35Å; I150-F185 HydrophobicContact CG2-CB 3.69Å; I150-F185 HydrophobicContact CG2-CD1 4.11Å; I150-F185 HydrophobicContact CG2-CD2 4.32Å; I150-F185 HydrophobicContact CG2-CG 3.78Å; I150-L222 HydrophobicContact CD1-CD1 3.91Å
151	K	86.9	Confident	90.4	Very high	59 Å²	59	21.9 Å²	21.9	26%	0.257	12%	0.118	S	C	.	.	H	α-helix	trans	-58.9	-53.1	172.4	-72.6	176.6	176.7	177.4	0	112.2	V147 L149 F153 G154 I183	V147-K151 WeakPolarHBondContact O-CG 3.16Å; V147-K151 PolarHBondContact O-N 3.44Å; L149-K151 VanDerWaalsContact C-N 3.32Å; L149-K151 PolarHBondContact O-N 2.96Å; K151-F153 PolarHBondContact O-N 3.44Å; K151-G154 PolarHBondContact O-N 3.34Å; K151-I183 HydrophobicContact CD-CG2 4.25Å; K151-I183 VanDerWaalsContact CE-CD1 3.47Å; K151-I183 HydrophobicContact CG-CG2 3.83Å
152	A	85.9	Confident	90.5	Very high	16 Å²	16	20 Å²	20	13%	0.132	11%	0.108	C	C	.	.	H	α-helix	trans	-62.5	-26.3	-177.4	0	0	0	0	0	113.5	D148 L149 P419 L422	D148-A152 WeakPolarHBondContact O-CB 3.19Å; D148-A152 PolarHBondContact O-N 3.35Å; L149-A152 PolarHBondContact O-N 3.26Å; A152-P419 HydrophobicContact CB-CG 4.49Å; A152-L422 HydrophobicContact CB-CD2 3.6Å
153	F	88.2	Confident	90.4	Very high	17 Å²	17	20 Å²	20	8%	0.075	11%	0.108	C	C	.	.	H	α-helix	trans	-90.4	-9.3	174.7	-63.2	-36.8	0	0	0	114.4	L149 I150 K151 W155 I250 I266 I424 L426 L429 W431 A464	L149-F153 HydrophobicContact CB-CD2 4.41Å; L149-F153 HydrophobicContact CB-CE2 4.17Å; L149-F153 HydrophobicContact CD2-CE2 3.99Å; L149-F153 HydrophobicContact CD2-CZ 4.02Å; L149-F153 WeakPolarHBondContact O-CB 3.47Å; L149-F153 WeakPolarHBondContact O-CD2 3.47Å; L149-F153 VanDerWaalsContact O-CG 3.31Å; L149-F153 WeakPolarHBondContact O-CG 3.44Å; L149-F153 PolarHBondContact O-N 3.3Å; I150-F153 PolarHBondContact O-N 3.5Å; K151-F153 PolarHBondContact O-N 3.44Å; F153-W155 HydrophobicContact CB-CD2 3.72Å; F153-W155 HydrophobicContact CB-CE3 4.28Å; F153-W155 HydrophobicContact CB-CG 3.94Å; F153-W155 HydrophobicContact CB-CZ2 4.24Å; F153-W155 HydrophobicContact CD2-CD2 4.09Å; F153-W155 AromaticContact CD2-CE2 3.99Å; F153-W155 AromaticContact CD2-CE3 3.89Å; F153-W155 HydrophobicContact CD2-CE3 3.89Å; F153-W155 AromaticContact CD2-CH2 3.54Å; F153-W155 HydrophobicContact CD2-CH2 3.54Å; F153-W155 AromaticContact CD2-CZ2 3.74Å; F153-W155 HydrophobicContact CD2-CZ2 3.74Å; F153-W155 AromaticContact CD2-CZ3 3.64Å; F153-W155 HydrophobicContact CD2-CZ3 3.64Å; F153-W155 AromaticContact CE2-CH2 3.93Å; F153-W155 HydrophobicContact CE2-CH2 3.93Å; F153-W155 HydrophobicContact CE2-CZ2 4.37Å; F153-W155 HydrophobicContact CE2-CZ3 4.21Å; F153-W155 HydrophobicContact CG-CD2 4.37Å; F153-W155 HydrophobicContact CG-CH2 4.42Å; F153-W155 HydrophobicContact CG-CZ2 4.18Å; F153-I250 HydrophobicContact CE2-CD1 4.36Å; F153-I266 HydrophobicContact CE2-CD1 4.11Å; F153-I266 HydrophobicContact CZ-CD1 3.86Å; F153-I424 HydrophobicContact CE1-CD1 3.89Å; F153-I424 HydrophobicContact CZ-CD1 3.65Å; F153-L426 HydrophobicContact CD1-CD2 4.25Å; F153-L426 HydrophobicContact CE1-CD2 3.79Å; F153-L429 HydrophobicContact CE1-CD1 3.97Å; F153-L429 HydrophobicContact CZ-CD1 4.16Å; F153-W431 HydrophobicContact CE1-CH2 4.36Å; F153-W431 HydrophobicContact CE1-CZ2 4.45Å; F153-W431 HydrophobicContact CE2-CH2 4.14Å; F153-W431 HydrophobicContact CZ-CH2 4.01Å; F153-W431 HydrophobicContact CZ-CZ2 4.48Å; F153-A464 HydrophobicContact CB-CB 3.78Å; F153-A464 HydrophobicContact CD1-CB 3.63Å; F153-A464 HydrophobicContact CD2-CB 4.41Å; F153-A464 HydrophobicContact CE1-CB 4.29Å; F153-A464 HydrophobicContact CG-CB 3.7Å
154	G	84.4	Confident	90.2	Very high	58 Å²	58	23.4 Å²	23.4	60%	0.598	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	37.5	-176.4	0	0	0	0	0	112.9	I150 K151	I150-G154 PolarHBondContact O-N 2.8Å; I150-G154 VanDerWaalsContact O-N 3.09Å; K151-G154 PolarHBondContact O-N 3.34Å
155	W	89	Confident	90	Very high	5 Å²	5	23 Å²	23	2%	0.019	12%	0.122	C	C	.	.			trans	-89.6	121.9	-178.5	-71	-17	0	0	0	111.7	I150 F153 F185 V220 A248 I250 W431 A464 P465	I150-W155 HydrophobicContact CG1-CE3 4.25Å; I150-W155 HydrophobicContact CG2-CB 4.17Å; I150-W155 VanDerWaalsContact CG2-O 3.27Å; I150-W155 WeakPolarHBondContact CG2-O 3.28Å; I150-W155 PolarHBondContact O-N 2.95Å; F153-W155 HydrophobicContact CB-CD2 3.72Å; F153-W155 HydrophobicContact CB-CE3 4.28Å; F153-W155 HydrophobicContact CB-CG 3.94Å; F153-W155 HydrophobicContact CB-CZ2 4.24Å; F153-W155 HydrophobicContact CD2-CD2 4.09Å; F153-W155 AromaticContact CD2-CE2 3.99Å; F153-W155 AromaticContact CD2-CE3 3.89Å; F153-W155 HydrophobicContact CD2-CE3 3.89Å; F153-W155 AromaticContact CD2-CH2 3.54Å; F153-W155 HydrophobicContact CD2-CH2 3.54Å; F153-W155 AromaticContact CD2-CZ2 3.74Å; F153-W155 HydrophobicContact CD2-CZ2 3.74Å; F153-W155 AromaticContact CD2-CZ3 3.64Å; F153-W155 HydrophobicContact CD2-CZ3 3.64Å; F153-W155 AromaticContact CE2-CH2 3.93Å; F153-W155 HydrophobicContact CE2-CH2 3.93Å; F153-W155 HydrophobicContact CE2-CZ2 4.37Å; F153-W155 HydrophobicContact CE2-CZ3 4.21Å; F153-W155 HydrophobicContact CG-CD2 4.37Å; F153-W155 HydrophobicContact CG-CH2 4.42Å; F153-W155 HydrophobicContact CG-CZ2 4.18Å; W155-F185 WeakPolarHBondContact O-CB 3.13Å; W155-V220 HydrophobicContact CD2-CB 4.44Å; W155-V220 HydrophobicContact CD2-CG1 4.14Å; W155-V220 HydrophobicContact CD2-CG2 3.48Å; W155-V220 VanDerWaalsContact CD2-CG2 3.48Å; W155-V220 HydrophobicContact CE3-CB 4.27Å; W155-V220 HydrophobicContact CE3-CG1 3.49Å; W155-V220 VanDerWaalsContact CE3-CG1 3.49Å; W155-V220 HydrophobicContact CE3-CG2 3.74Å; W155-V220 HydrophobicContact CG-CG2 3.93Å; W155-V220 HydrophobicContact CH2-CG1 4.12Å; W155-V220 HydrophobicContact CH2-CG2 4.08Å; W155-V220 HydrophobicContact CZ2-CG2 3.85Å; W155-V220 HydrophobicContact CZ3-CB 4.42Å; W155-V220 HydrophobicContact CZ3-CG1 3.46Å; W155-V220 VanDerWaalsContact CZ3-CG1 3.46Å; W155-V220 HydrophobicContact CZ3-CG2 4.01Å; W155-A248 HydrophobicContact CH2-CB 3.72Å; W155-A248 HydrophobicContact CZ2-CB 3.6Å; W155-I250 HydrophobicContact CH2-CD1 4.19Å; W155-I250 HydrophobicContact CH2-CG1 4.35Å; W155-I250 HydrophobicContact CZ3-CD1 3.58Å; W155-I250 HydrophobicContact CZ3-CG1 4.08Å; W155-W431 HydrophobicContact CH2-CH2 4.13Å; W155-W431 HydrophobicContact CH2-CZ3 4.08Å; W155-W431 AromaticContact CZ2-CH2 3.89Å; W155-W431 HydrophobicContact CZ2-CH2 3.89Å; W155-W431 AromaticContact CZ2-CZ3 4Å; W155-W431 HydrophobicContact CZ2-CZ3 4Å; W155-A464 HydrophobicContact CZ2-CB 3.81Å; W155-P465 PolarHBondContact NE1-O 3.12Å
156	R	85.7	Confident	89.8	Confident	157 Å²	157	26.6 Å²	26.6	59%	0.592	14%	0.139	S	C	*	.			trans	-96	-21	-178.5	-64.4	-171.3	158.4	176.2	-11.4	114.1	D184 F185 K186 S467	R156-D184 WeakPolarHBondContact CA-O 3.44Å; R156-D184 WeakPolarHBondContact CG-O 3.16Å; R156-D184 IonicContact CZ-OD2 3.1Å; R156-D184 IonicContact NE-OD2 3.61Å; R156-D184 IonicContact NH2-OD2 2.76Å; R156-D184 PolarHBondContact NH2-OD2 3.47Å; R156-F185 CarbonylContact O-C 3.52Å; R156-F185 VanDerWaalsContact O-CA 3.31Å; R156-F185 WeakPolarHBondContact O-CA 3.11Å; R156-K186 PolarHBondContact O-N 3.38Å; R156-S467 PolarHBondContact N-OG 2.79Å
157	E	86.2	Confident	89.6	Confident	33 Å²	33	26.9 Å²	26.9	15%	0.154	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131	-177.1	-60.6	-168.1	147.7	0	0	110.9	T188 T218 S467 F468	E157-T188 HydrophobicContact CB-CG2 3.79Å; E157-T188 HydrophobicContact CG-CG2 4.01Å; E157-T218 HydrophobicContact CB-CG2 3.55Å; E157-T218 HydrophobicContact CG-CG2 4.45Å; E157-T218 WeakPolarHBondContact OE2-CG2 3.06Å; E157-S467 WeakPolarHBondContact O-CB 3.46Å; E157-F468 VanDerWaalsContact OE2-CB 3.26Å; E157-F468 WeakPolarHBondContact OE2-CB 3.15Å
158	V	91.9	Very high	89.6	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	150.8	177.3	-58.4	0	0	0	0	111.3	I150 F185 K186 I187 T188 V220 L222	I150-V158 HydrophobicContact CD1-CG1 4.14Å; I150-V158 HydrophobicContact CG1-CG1 4.27Å; V158-F185 HydrophobicContact CG2-CD2 4.04Å; V158-F185 HydrophobicContact CG2-CE2 4.37Å; V158-K186 PolarHBondContact N-O 3.2Å; V158-I187 HydrophobicContact CG2-CG1 4.13Å; V158-T188 PolarHBondContact O-N 3.07Å; V158-T188 PolarHBondContact O-OG1 3.48Å; V158-V220 HydrophobicContact CB-CG1 4.3Å; V158-V220 HydrophobicContact CG1-CB 4.33Å; V158-V220 HydrophobicContact CG1-CG1 3.78Å; V158-L222 HydrophobicContact CB-CD1 4.14Å; V158-L222 HydrophobicContact CB-CG 4.34Å; V158-L222 HydrophobicContact CG1-CD1 4.41Å; V158-L222 HydrophobicContact CG2-CD1 4.08Å
159	C	93.2	Very high	89.6	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	134.1	165.7	179.5	0	0	0	0	109	R189 V213 V220 I221 L222	C159-R189 WeakPolarHBondContact CA-O 3.38Å; C159-V213 HydrophobicContact CB-CG1 4.44Å; C159-V220 PolarHBondContact N-O 3.22Å; C159-I221 HydrophobicContact CB-CG1 4.43Å; C159-I221 WeakPolarHBondContact O-CA 3.44Å; C159-L222 PolarHBondContact O-N 2.99Å
160	V	94.2	Very high	89.6	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.4	178.7	-175.7	0	0	0	0	109.5	H162 L175 I187 R189 Q190 V191 L222	V160-H162 HydrophobicContact CG1-CB 4.29Å; V160-L175 HydrophobicContact CG2-CD1 4.08Å; V160-I187 HydrophobicContact CG2-CD1 4.31Å; V160-I187 HydrophobicContact CG2-CG1 4.36Å; V160-I187 HydrophobicContact CG2-CG2 3.99Å; V160-R189 PolarHBondContact N-O 2.96Å; V160-Q190 CarbonylContact O-C 3.58Å; V160-Q190 WeakPolarHBondContact O-CA 3.46Å; V160-V191 PolarHBondContact O-N 3.38Å; V160-L222 HydrophobicContact CG2-CB 4.45Å; V160-L222 HydrophobicContact CG2-CD1 4.21Å
161	I	94.3	Very high	89.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	118.1	171.4	-55.4	175.3	0	0	0	107.1	V191 I193 L210 I221 L222 L223 F224 L225	I161-V191 HydrophobicContact CG1-CB 4.2Å; I161-V191 HydrophobicContact CG2-CB 4.44Å; I161-V191 HydrophobicContact CG2-CG1 4.38Å; I161-I193 HydrophobicContact CG2-CD1 3.83Å; I161-L210 HydrophobicContact CD1-CD2 3.65Å; I161-I221 HydrophobicContact CD1-CG2 3.58Å; I161-I221 HydrophobicContact CG1-CG2 4.01Å; I161-L222 PolarHBondContact N-O 3.08Å; I161-L223 HydrophobicContact CB-CD1 3.73Å; I161-L223 HydrophobicContact CD1-CD1 4.44Å; I161-L223 HydrophobicContact CG2-CD1 3.71Å; I161-L223 WeakPolarHBondContact O-CA 3.43Å; I161-F224 PolarHBondContact O-N 3.1Å; I161-L225 HydrophobicContact CG2-CD1 4.37Å
162	H	93.5	Very high	90	Very high	10 Å²	10	32.3 Å²	32.3	5%	0.046	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	156.3	-171.6	68.8	87.5	0	0	0	112.7	V160 A168 V191 A192 I193 F224	V160-H162 HydrophobicContact CG1-CB 4.29Å; H162-A168 HydrophobicContact CB-CB 3.95Å; H162-V191 PolarHBondContact N-O 2.9Å; H162-A192 CarbonylContact O-C 3.58Å; H162-A192 WeakPolarHBondContact O-CA 3.45Å; H162-I193 PolarHBondContact O-N 3.41Å; H162-F224 CarbonylContact C-O 3.6Å; H162-F224 VanDerWaalsContact CA-O 3.28Å; H162-F224 WeakPolarHBondContact CA-O 3.35Å; H162-F224 HydrophobicContact CB-CB 4.13Å
163	S	90.9	Very high	90.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	157.9	167.2	34.1	0	0	0	0	111.4	D165 A168 I193 F224	S163-D165 WeakPolarHBondContact CB-OD1 3.38Å; S163-D165 PolarHBondContact O-N 3.39Å; S163-D165 VanDerWaalsContact OG-CG 3.28Å; S163-D165 PolarHBondContact OG-OD1 3.5Å; S163-A168 WeakPolarHBondContact O-CB 3.49Å; S163-I193 CarbonylContact C-O 3.58Å; S163-I193 WeakPolarHBondContact CA-O 3.37Å; S163-F224 PolarHBondContact N-O 2.92Å; S163-F224 VanDerWaalsContact N-O 3.1Å
164	D	87.9	Confident	90.5	Very high	74 Å²	74	37.6 Å²	37.6	40%	0.396	19%	0.188	S	C	.	.	S	Bend	trans	-83.1	28.1	171.9	-163.1	24.4	0	0	0	113.6	K169 I193	D164-K169 PolarHBondContact O-NZ 2.96Å; D164-K169 WeakPolarHBondContact OD1-CE 3.07Å; D164-K169 IonicContact OD1-NZ 3.34Å; D164-K169 PolarHBondContact OD1-NZ 3.23Å; D164-K169 IonicContact OD2-NZ 3.5Å; D164-I193 PolarHBondContact N-O 2.99Å
165	D	86.5	Confident	90.9	Very high	19 Å²	19	34.8 Å²	34.8	10%	0.102	16%	0.159	C	C	.	.	S	Bend	trans	-96.9	167	-179.3	64.3	4.8	0	0	0	113.9	S163 D167 A168 K169 R226	S163-D165 WeakPolarHBondContact CB-OD1 3.38Å; S163-D165 PolarHBondContact O-N 3.39Å; S163-D165 VanDerWaalsContact OG-CG 3.28Å; S163-D165 PolarHBondContact OG-OD1 3.5Å; D165-D167 PolarHBondContact O-N 3.15Å; D165-A168 PolarHBondContact O-N 2.91Å; D165-A168 WeakPolarHBondContact OD1-CB 3.36Å; D165-A168 PolarHBondContact OD1-N 3.16Å; D165-K169 WeakPolarHBondContact O-CG 3.5Å; D165-K169 PolarHBondContact O-N 2.78Å; D165-R226 IonicContact OD2-CZ 3.21Å; D165-R226 IonicContact OD2-NE 2.69Å; D165-R226 PolarHBondContact OD2-NE 3.23Å; D165-R226 IonicContact OD2-NH2 2.7Å; D165-R226 PolarHBondContact OD2-NH2 2.97Å
166	H	88.3	Confident	90.9	Very high	76 Å²	76	38.5 Å²	38.5	35%	0.352	18%	0.177	S	C	.	.	H	α-helix	trans	-61.9	-30.7	-176	177.5	-88.5	0	0	0	112.6	S121 I122 K170	S121-H166 PolarHBondContact O-CE1 3.49Å; I122-H166 PolarHBondContact N-ND1 2.95Å; H166-K170 VanDerWaalsContact CE1-CE 3.48Å; H166-K170 WeakPolarHBondContact CE1-CE 3.49Å; H166-K170 WeakPolarHBondContact O-CG 3.46Å; H166-K170 PolarHBondContact O-N 3.15Å
167	D	89.6	Confident	91.2	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.032	17%	0.167	C	C	.	.	H	α-helix	trans	-70.6	-44.9	179.6	-63.3	-4.6	0	0	0	110.7	H120 S121 D165 K170 V171 F224	H120-D167 WeakPolarHBondContact CA-OD2 3.35Å; H120-D167 IonicContact CE1-OD2 3.24Å; H120-D167 IonicContact CG-OD2 2.76Å; H120-D167 IonicContact ND1-OD2 3.19Å; H120-D167 PolarHBondContact ND1-OD2 3.42Å; S121-D167 WeakPolarHBondContact CA-OD1 3.31Å; S121-D167 VanDerWaalsContact CB-OD1 3.29Å; S121-D167 WeakPolarHBondContact CB-OD1 3.48Å; S121-D167 PolarHBondContact N-OD1 3.3Å; D165-D167 PolarHBondContact O-N 3.15Å; D167-K170 PolarHBondContact O-N 2.97Å; D167-V171 PolarHBondContact O-N 2.97Å; D167-F224 HydrophobicContact CB-CE1 3.85Å; D167-F224 HydrophobicContact CB-CZ 3.77Å
168	A	91.4	Very high	91.3	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.5	-44.8	171.3	0	0	0	0	0	112.8	H162 S163 D165 K170 V171 L172 F224	H162-A168 HydrophobicContact CB-CB 3.95Å; S163-A168 WeakPolarHBondContact O-CB 3.49Å; D165-A168 PolarHBondContact O-N 2.91Å; D165-A168 WeakPolarHBondContact OD1-CB 3.36Å; D165-A168 PolarHBondContact OD1-N 3.16Å; A168-K170 VanDerWaalsContact C-N 3.32Å; A168-K170 PolarHBondContact O-N 2.88Å; A168-V171 PolarHBondContact O-N 2.99Å; A168-V171 VanDerWaalsContact O-N 3.12Å; A168-L172 WeakPolarHBondContact O-CB 3.41Å; A168-L172 PolarHBondContact O-N 3.35Å; A168-F224 HydrophobicContact CB-CD1 3.68Å; A168-F224 HydrophobicContact CB-CE1 4.05Å; A168-F224 HydrophobicContact CB-CG 4.48Å
169	K	91.8	Very high	91	Very high	102 Å²	102	33.8 Å²	33.8	44%	0.443	17%	0.172	S	C	.	.	H	α-helix	trans	-60.1	-40	177	-75.9	164.1	175.7	147.4	0	112	D164 D165 S173	D164-K169 PolarHBondContact O-NZ 2.96Å; D164-K169 WeakPolarHBondContact OD1-CE 3.07Å; D164-K169 IonicContact OD1-NZ 3.34Å; D164-K169 PolarHBondContact OD1-NZ 3.23Å; D164-K169 IonicContact OD2-NZ 3.5Å; D165-K169 WeakPolarHBondContact O-CG 3.5Å; D165-K169 PolarHBondContact O-N 2.78Å; K169-S173 WeakPolarHBondContact O-CB 3.45Å; K169-S173 PolarHBondContact O-N 2.8Å; K169-S173 PolarHBondContact O-OG 3.03Å
170	K	91.8	Very high	90.4	Very high	82 Å²	82	41.7 Å²	41.7	36%	0.357	21%	0.208	S	C	.	.	H	α-helix	trans	-61.4	-46.1	171.6	-75.2	-80.3	-175.1	178.6	0	111.8	H166 D167 A168 S173 Y174	H166-K170 VanDerWaalsContact CE1-CE 3.48Å; H166-K170 WeakPolarHBondContact CE1-CE 3.49Å; H166-K170 WeakPolarHBondContact O-CG 3.46Å; H166-K170 PolarHBondContact O-N 3.15Å; D167-K170 PolarHBondContact O-N 2.97Å; A168-K170 VanDerWaalsContact C-N 3.32Å; A168-K170 PolarHBondContact O-N 2.88Å; K170-S173 PolarHBondContact O-OG 3.45Å; K170-Y174 PolarHBondContact O-N 2.96Å
171	V	93.2	Very high	89.7	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-48.7	176.4	167.9	0	0	0	0	112.2	A143 W146 D167 A168 S173 Y174 L175 F224	A143-V171 HydrophobicContact CB-CB 4.38Å; A143-V171 HydrophobicContact CB-CG1 4.01Å; A143-V171 HydrophobicContact CB-CG2 4.19Å; W146-V171 HydrophobicContact CE3-CG1 4.34Å; W146-V171 HydrophobicContact CZ3-CG1 4.04Å; D167-V171 PolarHBondContact O-N 2.97Å; A168-V171 PolarHBondContact O-N 2.99Å; A168-V171 VanDerWaalsContact O-N 3.12Å; V171-S173 PolarHBondContact O-N 3.23Å; V171-Y174 WeakPolarHBondContact O-CB 3.32Å; V171-Y174 PolarHBondContact O-N 3.38Å; V171-Y174 VanDerWaalsContact O-N 3.15Å; V171-L175 HydrophobicContact CG1-CD1 3.97Å; V171-L175 HydrophobicContact CG1-CG 4.36Å; V171-L175 WeakPolarHBondContact O-CG 3.29Å; V171-L175 PolarHBondContact O-N 2.95Å; V171-F224 HydrophobicContact CB-CD2 4.11Å; V171-F224 HydrophobicContact CB-CE2 4.36Å; V171-F224 HydrophobicContact CG1-CD2 4.17Å; V171-F224 HydrophobicContact CG2-CD2 3.61Å; V171-F224 HydrophobicContact CG2-CE2 3.43Å; V171-F224 VanDerWaalsContact CG2-CE2 3.43Å; V171-F224 HydrophobicContact CG2-CZ 4.22Å
172	L	92.6	Very high	88.3	Confident	19 Å²	19	52.3 Å²	52.3	10%	0.099	27%	0.27	C	S	.	.	H	α-helix	trans	-57.9	-50.5	179.5	-179.4	63.7	0	0	0	111	A168 Y174 L175 E176 I187	A168-L172 WeakPolarHBondContact O-CB 3.41Å; A168-L172 PolarHBondContact O-N 3.35Å; L172-Y174 PolarHBondContact O-N 2.75Å; L172-L175 PolarHBondContact O-N 2.92Å; L172-E176 HydrophobicContact CD1-CG 4.26Å; L172-E176 HydrophobicContact CG-CG 4.42Å; L172-E176 WeakPolarHBondContact O-CG 3.16Å; L172-E176 PolarHBondContact O-N 2.65Å; L172-I187 HydrophobicContact CD1-CD1 4.07Å
173	S	92.3	Very high	87.1	Confident	53 Å²	53	53 Å²	53	37%	0.371	27%	0.273	S	S	.	.	H	α-helix	trans	-58.3	-32.7	178	69.8	0	0	0	0	113.3	K169 K170 V171 S177	K169-S173 WeakPolarHBondContact O-CB 3.45Å; K169-S173 PolarHBondContact O-N 2.8Å; K169-S173 PolarHBondContact O-OG 3.03Å; K170-S173 PolarHBondContact O-OG 3.45Å; V171-S173 PolarHBondContact O-N 3.23Å; S173-S177 WeakPolarHBondContact O-CB 3.38Å; S173-S177 PolarHBondContact O-N 3.47Å; S173-S177 PolarHBondContact O-OG 3.5Å
174	Y	91.9	Very high	86.2	Confident	90 Å²	90	57.7 Å²	57.7	35%	0.353	30%	0.298	S	S	.	.	H	α-helix	trans	-72	-41.8	175.5	-174	-83	0	0	0	112.1	A143 S144 V147 K170 V171 L172 A178	A143-Y174 HydrophobicContact CB-CD1 3.58Å; A143-Y174 HydrophobicContact CB-CE1 4.33Å; A143-Y174 HydrophobicContact CB-CG 3.98Å; S144-Y174 WeakPolarHBondContact CB-OH 3.36Å; V147-Y174 HydrophobicContact CG2-CD1 4.33Å; V147-Y174 HydrophobicContact CG2-CE1 3.97Å; K170-Y174 PolarHBondContact O-N 2.96Å; V171-Y174 WeakPolarHBondContact O-CB 3.32Å; V171-Y174 PolarHBondContact O-N 3.38Å; V171-Y174 VanDerWaalsContact O-N 3.15Å; L172-Y174 PolarHBondContact O-N 2.75Å; Y174-A178 VanDerWaalsContact O-CB 3.26Å; Y174-A178 WeakPolarHBondContact O-CB 3.34Å; Y174-A178 PolarHBondContact O-N 2.87Å
175	L	92.2	Very high	86.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.3	-43.3	177	-65.9	173.9	0	0	0	111.7	W146 V147 V160 V171 L172 A178 S179 F185 I187 L222	W146-L175 HydrophobicContact CE3-CD1 4.23Å; V147-L175 HydrophobicContact CG2-CD2 3.76Å; V160-L175 HydrophobicContact CG2-CD1 4.08Å; V171-L175 HydrophobicContact CG1-CD1 3.97Å; V171-L175 HydrophobicContact CG1-CG 4.36Å; V171-L175 WeakPolarHBondContact O-CG 3.29Å; V171-L175 PolarHBondContact O-N 2.95Å; L172-L175 PolarHBondContact O-N 2.92Å; L175-A178 WeakPolarHBondContact O-CB 3.29Å; L175-A178 PolarHBondContact O-N 3.09Å; L175-S179 PolarHBondContact O-N 3.15Å; L175-F185 WeakPolarHBondContact O-CZ 3.22Å; L175-I187 HydrophobicContact CB-CD1 3.92Å; L175-L222 HydrophobicContact CD1-CD1 4.22Å
176	E	90.1	Very high	86	Confident	83 Å²	83	57.3 Å²	57.3	39%	0.388	29%	0.292	S	S	.	.	H	α-helix	trans	-62.1	-48.6	174.4	-68.8	175.2	148.8	0	0	111.1	L172 A178 S179 Q180 I187	L172-E176 HydrophobicContact CD1-CG 4.26Å; L172-E176 HydrophobicContact CG-CG 4.42Å; L172-E176 WeakPolarHBondContact O-CG 3.16Å; L172-E176 PolarHBondContact O-N 2.65Å; E176-A178 PolarHBondContact O-N 2.95Å; E176-S179 WeakPolarHBondContact O-CB 3.12Å; E176-S179 PolarHBondContact O-N 3.38Å; E176-Q180 WeakPolarHBondContact O-CG 3.34Å; E176-Q180 PolarHBondContact O-N 3.01Å; E176-I187 HydrophobicContact CG-CD1 3.88Å
177	S	91.1	Very high	85.9	Confident	54 Å²	54	55.2 Å²	55.2	38%	0.378	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-26.6	174.6	-60	0	0	0	0	112.7	S173 R181	S173-S177 WeakPolarHBondContact O-CB 3.38Å; S173-S177 PolarHBondContact O-N 3.47Å; S173-S177 PolarHBondContact O-OG 3.5Å; S177-R181 VanDerWaalsContact O-CG 3.29Å; S177-R181 WeakPolarHBondContact O-CG 3.08Å; S177-R181 PolarHBondContact O-NE 3.35Å
178	A	88	Confident	85.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-77.1	-42.6	174.9	0	0	0	0	0	111.7	V147 Y174 L175 E176 Q180 R181 I183 F185	V147-A178 HydrophobicContact CG1-CB 4.21Å; V147-A178 HydrophobicContact CG2-CB 3.68Å; Y174-A178 VanDerWaalsContact O-CB 3.26Å; Y174-A178 WeakPolarHBondContact O-CB 3.34Å; Y174-A178 PolarHBondContact O-N 2.87Å; L175-A178 WeakPolarHBondContact O-CB 3.29Å; L175-A178 PolarHBondContact O-N 3.09Å; E176-A178 PolarHBondContact O-N 2.95Å; A178-Q180 VanDerWaalsContact C-N 3.34Å; A178-Q180 PolarHBondContact O-N 3Å; A178-R181 PolarHBondContact O-N 3.37Å; A178-I183 HydrophobicContact CB-CD1 4.06Å; A178-I183 WeakPolarHBondContact O-CD1 3.13Å; A178-I183 WeakPolarHBondContact O-CG1 3.41Å; A178-F185 HydrophobicContact CB-CE1 4.01Å; A178-F185 HydrophobicContact CB-CZ 4.03Å
179	S	85.3	Confident	85.3	Confident	37 Å²	37	61.5 Å²	61.5	26%	0.259	31%	0.313	S	S	.	.	H	α-helix	trans	-58.7	-43.7	174.1	-176.8	0	0	0	0	111.7	L175 E176 R181 F185	L175-S179 PolarHBondContact O-N 3.15Å; E176-S179 WeakPolarHBondContact O-CB 3.12Å; E176-S179 PolarHBondContact O-N 3.38Å; S179-R181 VanDerWaalsContact C-N 3.34Å; S179-R181 PolarHBondContact O-N 2.85Å; S179-F185 WeakPolarHBondContact CB-O 3.37Å; S179-F185 PolarHBondContact OG-O 3.07Å
180	Q	82.4	Confident	85.2	Confident	165 Å²	165	61.7 Å²	61.7	77%	0.771	32%	0.315	S	S	*	.	H	α-helix	trans	-68.9	-24.9	178.7	-69.9	175.5	-3.5	0	0	114.6	E176 A178 G182	E176-Q180 WeakPolarHBondContact O-CG 3.34Å; E176-Q180 PolarHBondContact O-N 3.01Å; A178-Q180 VanDerWaalsContact C-N 3.34Å; A178-Q180 PolarHBondContact O-N 3Å; Q180-G182 PolarHBondContact O-N 3Å; Q180-G182 VanDerWaalsContact O-N 3.1Å
181	R	78.8	Confident	85.1	Confident	158 Å²	158	58.1 Å²	58.1	60%	0.596	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	25.8	-176.2	-81.9	-178.7	-67.7	143.5	0.7	114.1	S177 A178 S179	S177-R181 VanDerWaalsContact O-CG 3.29Å; S177-R181 WeakPolarHBondContact O-CG 3.08Å; S177-R181 PolarHBondContact O-NE 3.35Å; A178-R181 PolarHBondContact O-N 3.37Å; S179-R181 VanDerWaalsContact C-N 3.34Å; S179-R181 PolarHBondContact O-N 2.85Å
182	G	64.6	Low	84.9	Confident	68 Å²	68	60.6 Å²	60.6	70%	0.701	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	38.7	179.7	0	0	0	0	0	113.5	Q180	Q180-G182 PolarHBondContact O-N 3Å; Q180-G182 VanDerWaalsContact O-N 3.1Å
183	I	67.6	Low	84.7	Confident	25 Å²	25	60.1 Å²	60.1	13%	0.128	32%	0.318	C	S	.	.			trans	-104.7	127.8	165.6	-53.3	168.7	0	0	0	107	V147 K151 A178 F185	V147-I183 HydrophobicContact CG1-CD1 3.71Å; K151-I183 HydrophobicContact CD-CG2 4.25Å; K151-I183 VanDerWaalsContact CE-CD1 3.47Å; K151-I183 HydrophobicContact CG-CG2 3.83Å; A178-I183 HydrophobicContact CB-CD1 4.06Å; A178-I183 WeakPolarHBondContact O-CD1 3.13Å; A178-I183 WeakPolarHBondContact O-CG1 3.41Å; I183-F185 HydrophobicContact CB-CD1 4.05Å; I183-F185 HydrophobicContact CB-CE1 4.19Å; I183-F185 HydrophobicContact CG2-CD1 3.68Å; I183-F185 HydrophobicContact CG2-CE1 4.09Å; I183-F185 PolarHBondContact O-N 2.81Å
184	D	73.1	Confident	84.2	Confident	97 Å²	97	61.5 Å²	61.5	52%	0.519	32%	0.322	S	S	.	.	S	Bend	trans	-65.4	36.4	-171.5	-109.6	33.6	0	0	0	115.8	R156	R156-D184 WeakPolarHBondContact CA-O 3.44Å; R156-D184 WeakPolarHBondContact CG-O 3.16Å; R156-D184 IonicContact CZ-OD2 3.1Å; R156-D184 IonicContact NE-OD2 3.61Å; R156-D184 IonicContact NH2-OD2 2.76Å; R156-D184 PolarHBondContact NH2-OD2 3.47Å
185	F	85.1	Confident	83.4	Confident	7 Å²	7	57.5 Å²	57.5	3%	0.031	31%	0.306	C	S	.	.			trans	-127.7	146.8	174	85.9	-82.5	0	0	0	113.3	V147 I150 W155 R156 V158 L175 A178 S179 I183 I187	V147-F185 HydrophobicContact CG1-CE1 4.5Å; V147-F185 HydrophobicContact CG2-CE1 4.42Å; V147-F185 HydrophobicContact CG2-CZ 4.28Å; I150-F185 HydrophobicContact CD1-CD2 4.37Å; I150-F185 HydrophobicContact CD1-CE2 4.35Å; I150-F185 HydrophobicContact CG2-CB 3.69Å; I150-F185 HydrophobicContact CG2-CD1 4.11Å; I150-F185 HydrophobicContact CG2-CD2 4.32Å; I150-F185 HydrophobicContact CG2-CG 3.78Å; W155-F185 WeakPolarHBondContact O-CB 3.13Å; R156-F185 CarbonylContact O-C 3.52Å; R156-F185 VanDerWaalsContact O-CA 3.31Å; R156-F185 WeakPolarHBondContact O-CA 3.11Å; V158-F185 HydrophobicContact CG2-CD2 4.04Å; V158-F185 HydrophobicContact CG2-CE2 4.37Å; L175-F185 WeakPolarHBondContact O-CZ 3.22Å; A178-F185 HydrophobicContact CB-CE1 4.01Å; A178-F185 HydrophobicContact CB-CZ 4.03Å; S179-F185 WeakPolarHBondContact CB-O 3.37Å; S179-F185 PolarHBondContact OG-O 3.07Å; I183-F185 HydrophobicContact CB-CD1 4.05Å; I183-F185 HydrophobicContact CB-CE1 4.19Å; I183-F185 HydrophobicContact CG2-CD1 3.68Å; I183-F185 HydrophobicContact CG2-CE1 4.09Å; I183-F185 PolarHBondContact O-N 2.81Å; F185-I187 HydrophobicContact CE2-CG1 4.41Å
186	K	84.1	Confident	82.3	Confident	78 Å²	78	64.2 Å²	64.2	34%	0.339	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.4	178.8	-174.3	177	-177.4	-177.7	0	110.8	R156 V158 T188 N877	R156-K186 PolarHBondContact O-N 3.38Å; V158-K186 PolarHBondContact N-O 3.2Å; K186-T188 PolarHBondContact O-N 3.37Å; K186-N877 PolarHBondContact NZ-OD1 3.37Å
187	I	86.9	Confident	81.3	Confident	33 Å²	33	66.4 Å²	66.4	17%	0.169	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	112.7	166.2	-55.8	174.3	0	0	0	107.1	V158 V160 L172 L175 E176 F185	V158-I187 HydrophobicContact CG2-CG1 4.13Å; V160-I187 HydrophobicContact CG2-CD1 4.31Å; V160-I187 HydrophobicContact CG2-CG1 4.36Å; V160-I187 HydrophobicContact CG2-CG2 3.99Å; L172-I187 HydrophobicContact CD1-CD1 4.07Å; L175-I187 HydrophobicContact CB-CD1 3.92Å; E176-I187 HydrophobicContact CG-CD1 3.88Å; F185-I187 HydrophobicContact CE2-CG1 4.41Å
188	T	82	Confident	80	Confident	52 Å²	52	67.2 Å²	67.2	32%	0.319	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-36.7	-177.2	55	0	0	0	0	112.4	E157 V158 K186 T218	E157-T188 HydrophobicContact CB-CG2 3.79Å; E157-T188 HydrophobicContact CG-CG2 4.01Å; V158-T188 PolarHBondContact O-N 3.07Å; V158-T188 PolarHBondContact O-OG1 3.48Å; K186-T188 PolarHBondContact O-N 3.37Å; T188-T218 HydrophobicContact CG2-CG2 3.52Å; T188-T218 WeakPolarHBondContact OG1-CG2 3.42Å
189	R	85.8	Confident	78.7	Confident	86 Å²	86	75.4 Å²	75.4	33%	0.325	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	140.9	176.8	-174.5	165.3	-168.8	126.5	5.8	110.5	C159 V160 V191 E216	C159-R189 WeakPolarHBondContact CA-O 3.38Å; V160-R189 PolarHBondContact N-O 2.96Å; R189-V191 HydrophobicContact CG-CG2 4.18Å; R189-E216 WeakPolarHBondContact CB-OE2 3.31Å; R189-E216 VanDerWaalsContact CD-OE1 3.3Å; R189-E216 WeakPolarHBondContact CD-OE1 3.45Å; R189-E216 WeakPolarHBondContact CD-OE2 3.4Å; R189-E216 IonicContact CZ-OE1 3.49Å; R189-E216 IonicContact NE-OE1 2.7Å; R189-E216 IonicContact NH1-OE1 3.25Å; R189-E216 PolarHBondContact NH1-OE1 2.93Å
190	Q	89.9	Confident	77.6	Confident	106 Å²	106	76.4 Å²	76.4	50%	0.495	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	143	166.1	64.2	-172.8	1.4	0	0	109.6	V160	V160-Q190 CarbonylContact O-C 3.58Å; V160-Q190 WeakPolarHBondContact O-CA 3.46Å
191	V	89.8	Confident	76.9	Confident	7 Å²	7	70 Å²	70	4%	0.042	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	101.2	178	177.5	0	0	0	0	107.8	V160 I161 H162 R189 L209 V213	V160-V191 PolarHBondContact O-N 3.38Å; I161-V191 HydrophobicContact CG1-CB 4.2Å; I161-V191 HydrophobicContact CG2-CB 4.44Å; I161-V191 HydrophobicContact CG2-CG1 4.38Å; H162-V191 PolarHBondContact N-O 2.9Å; R189-V191 HydrophobicContact CG-CG2 4.18Å; V191-L209 HydrophobicContact CG1-CD1 3.88Å; V191-L209 HydrophobicContact CG1-CD2 3.53Å; V191-L209 HydrophobicContact CG1-CG 3.5Å; V191-V213 HydrophobicContact CG2-CG2 3.81Å
192	A	89.8	Confident	76.6	Confident	55 Å²	55	68.4 Å²	68.4	46%	0.455	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.7	173.2	0	0	0	0	0	110.1	H162	H162-A192 CarbonylContact O-C 3.58Å; H162-A192 WeakPolarHBondContact O-CA 3.45Å
193	I	87.2	Confident	77.3	Confident	8 Å²	8	67.3 Å²	67.3	4%	0.041	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	117	172.1	-66	172.3	0	0	0	107.5	I161 H162 S163 D164 T195 F206 L209 L225 F229 V233	I161-I193 HydrophobicContact CG2-CD1 3.83Å; H162-I193 PolarHBondContact O-N 3.41Å; S163-I193 CarbonylContact C-O 3.58Å; S163-I193 WeakPolarHBondContact CA-O 3.37Å; D164-I193 PolarHBondContact N-O 2.99Å; I193-T195 PolarHBondContact O-N 3.37Å; I193-F206 HydrophobicContact CD1-CD1 4.41Å; I193-F206 HydrophobicContact CD1-CE1 4.25Å; I193-F206 HydrophobicContact CG2-CE1 4.07Å; I193-L209 HydrophobicContact CD1-CD2 4.23Å; I193-L209 HydrophobicContact CG1-CD2 3.65Å; I193-L225 HydrophobicContact CB-CD2 4.35Å; I193-L225 HydrophobicContact CD1-CD1 3.86Å; I193-L225 HydrophobicContact CD1-CD2 4.14Å; I193-F229 HydrophobicContact CG2-CD1 4.15Å; I193-V233 HydrophobicContact CD1-CG2 3.73Å
194	N	82.3	Confident	77.9	Confident	83 Å²	83	73.7 Å²	73.7	44%	0.444	38%	0.383	S	S	.	.			trans	-64.4	126.8	172.8	-173.6	-1.3	0	0	0	109.4	D196	N194-D196 WeakPolarHBondContact OD1-CB 3.38Å; N194-D196 PolarHBondContact OD1-N 2.98Å
195	T	75.1	Confident	78.4	Confident	6 Å²	6	72.6 Å²	72.6	4%	0.037	38%	0.377	C	S	.	.			trans	-97	-9	-178.9	53.4	0	0	0	0	114.1	I193 E197 E198 F229	I193-T195 PolarHBondContact O-N 3.37Å; T195-E197 VanDerWaalsContact C-N 3.33Å; T195-E197 PolarHBondContact O-N 3.16Å; T195-E198 WeakPolarHBondContact O-CG 3.43Å; T195-F229 HydrophobicContact CG2-CD2 4.07Å; T195-F229 HydrophobicContact CG2-CE2 3.75Å; T195-F229 HydrophobicContact CG2-CZ 4.14Å
196	D	69.6	Low	78.4	Confident	141 Å²	141	72.8 Å²	72.8	75%	0.754	38%	0.378	S	S	*	.	S	Bend	trans	-75.8	-23.5	-170.3	-65.3	-11.5	0	0	0	112.7	N194 E198	N194-D196 WeakPolarHBondContact OD1-CB 3.38Å; N194-D196 PolarHBondContact OD1-N 2.98Å; D196-E198 PolarHBondContact O-N 2.92Å
197	E	68.9	Low	78.7	Confident	129 Å²	129	71.2 Å²	71.2	60%	0.603	37%	0.373	S	S	*	.			trans	-100.6	50.6	-179.7	-58.8	-172.5	170.5	0	0	112.3	T195 D199 A200	T195-E197 VanDerWaalsContact C-N 3.33Å; T195-E197 PolarHBondContact O-N 3.16Å; E197-D199 PolarHBondContact O-N 2.62Å; E197-D199 VanDerWaalsContact O-N 3.07Å; E197-A200 HydrophobicContact CB-CB 4.09Å; E197-A200 PolarHBondContact O-N 3.4Å
198	E	63	Low	78.7	Confident	71 Å²	71	73.1 Å²	73.1	33%	0.332	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-35.9	-175.6	-65.5	-155.5	168.9	0	0	113.8	T195 D196 K228 F229	T195-E198 WeakPolarHBondContact O-CG 3.43Å; D196-E198 PolarHBondContact O-N 2.92Å; E198-K228 IonicContact OE2-NZ 3.75Å; E198-K228 PolarHBondContact OE2-NZ 3.13Å; E198-F229 HydrophobicContact CG-CE2 4.2Å; E198-F229 HydrophobicContact CG-CZ 3.93Å
199	D	62.2	Low	78.9	Confident	171 Å²	171	73.6 Å²	73.6	91%	0.914	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-15	-176.1	-66.9	-34.6	0	0	0	114.2	E197	E197-D199 PolarHBondContact O-N 2.62Å; E197-D199 VanDerWaalsContact O-N 3.07Å
200	A	62.1	Low	79.1	Confident	58 Å²	58	69.6 Å²	69.6	48%	0.479	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-18.3	-175.8	0	0	0	0	0	113.7	E197 Q202	E197-A200 HydrophobicContact CB-CB 4.09Å; E197-A200 PolarHBondContact O-N 3.4Å; A200-Q202 WeakPolarHBondContact O-CG 3.5Å; A200-Q202 PolarHBondContact O-N 2.89Å; A200-Q202 VanDerWaalsContact O-N 3.16Å
201	A	66.7	Low	79.1	Confident	30 Å²	30	69.4 Å²	69.4	25%	0.248	37%	0.374	C	S	.	.			trans	-64.7	110.2	-166.6	0	0	0	0	0	113.5	F206	A201-F206 HydrophobicContact CB-CE2 3.83Å; A201-F206 HydrophobicContact CB-CZ 3.94Å
202	Q	73	Confident	78.9	Confident	125 Å²	125	71.2 Å²	71.2	58%	0.584	39%	0.385	S	S	*	.			trans	-94.7	147.6	178.6	-49.7	-172.1	17	0	0	111.8	A200 K204 D205 F206	A200-Q202 WeakPolarHBondContact O-CG 3.5Å; A200-Q202 PolarHBondContact O-N 2.89Å; A200-Q202 VanDerWaalsContact O-N 3.16Å; Q202-K204 PolarHBondContact O-N 2.85Å; Q202-D205 WeakPolarHBondContact CA-OD2 3.38Å; Q202-D205 VanDerWaalsContact CB-OD2 3.26Å; Q202-D205 WeakPolarHBondContact CB-OD2 3.41Å; Q202-D205 PolarHBondContact N-OD2 3.47Å; Q202-D205 WeakPolarHBondContact O-CB 3.36Å; Q202-D205 PolarHBondContact O-N 3.23Å; Q202-F206 WeakPolarHBondContact O-CD2 3.27Å
203	M	78.2	Confident	78.9	Confident	46 Å²	46	68.6 Å²	68.6	23%	0.227	36%	0.364	C	S	.	.	H	α-helix	trans	-53.9	-28.3	174	-178.6	59.9	54.3	0	0	113.5	D205 I207 Y232 L235 A236	M203-D205 VanDerWaalsContact C-N 3.33Å; M203-I207 HydrophobicContact CG-CD1 4.15Å; M203-I207 WeakPolarHBondContact O-CD1 3.36Å; M203-I207 VanDerWaalsContact O-CG1 3.29Å; M203-I207 WeakPolarHBondContact O-CG1 3.24Å; M203-I207 PolarHBondContact O-N 3.44Å; M203-Y232 HydrophobicContact CE-CD1 4.08Å; M203-L235 HydrophobicContact CE-CB 3.6Å; M203-L235 HydrophobicContact CE-CD1 3.7Å; M203-L235 HydrophobicContact CE-CG 4.3Å; M203-L235 HydrophobicContact SD-CB 4.15Å; M203-A236 HydrophobicContact SD-CB 4.26Å
204	K	81.5	Confident	79	Confident	159 Å²	159	73.6 Å²	73.6	69%	0.691	38%	0.382	S	S	*	.	H	α-helix	trans	-65.9	-37.4	177.7	-171.7	-175.7	176.3	-168.7	0	111.7	Q202 I207 S208	Q202-K204 PolarHBondContact O-N 2.85Å; K204-I207 PolarHBondContact O-N 2.04Å; K204-S208 PolarHBondContact O-N 2.94Å
205	D	83.1	Confident	79	Confident	74 Å²	74	74.6 Å²	74.6	40%	0.396	39%	0.388	S	S	.	.	H	α-helix	trans	-69.6	-48	-173.9	-46.8	-34.3	0	0	0	109.2	Q202 M203 I207 S208 L209	Q202-D205 WeakPolarHBondContact CA-OD2 3.38Å; Q202-D205 VanDerWaalsContact CB-OD2 3.26Å; Q202-D205 WeakPolarHBondContact CB-OD2 3.41Å; Q202-D205 PolarHBondContact N-OD2 3.47Å; Q202-D205 WeakPolarHBondContact O-CB 3.36Å; Q202-D205 PolarHBondContact O-N 3.23Å; M203-D205 VanDerWaalsContact C-N 3.33Å; D205-I207 VanDerWaalsContact C-N 3.31Å; D205-I207 PolarHBondContact O-N 2.77Å; D205-S208 PolarHBondContact O-N 2.84Å; D205-S208 VanDerWaalsContact O-N 3.11Å; D205-S208 PolarHBondContact O-OG 2.95Å; D205-L209 WeakPolarHBondContact O-CB 3.33Å; D205-L209 PolarHBondContact O-N 2.99Å
206	F	86.3	Confident	79.3	Confident	11 Å²	11	76.6 Å²	76.6	5%	0.048	40%	0.396	C	S	.	.	H	α-helix	trans	-58.8	-37.1	172.8	-62.3	-74.3	0	0	0	113.3	I193 A201 Q202 L209 L210 F229 Y232 V233 A236	I193-F206 HydrophobicContact CD1-CD1 4.41Å; I193-F206 HydrophobicContact CD1-CE1 4.25Å; I193-F206 HydrophobicContact CG2-CE1 4.07Å; A201-F206 HydrophobicContact CB-CE2 3.83Å; A201-F206 HydrophobicContact CB-CZ 3.94Å; Q202-F206 WeakPolarHBondContact O-CD2 3.27Å; F206-L209 PolarHBondContact O-N 3.26Å; F206-L210 WeakPolarHBondContact O-CB 3.48Å; F206-L210 VanDerWaalsContact O-CG 3.31Å; F206-L210 WeakPolarHBondContact O-CG 3.44Å; F206-L210 PolarHBondContact O-N 3.33Å; F206-F229 HydrophobicContact CZ-CD1 4.2Å; F206-Y232 HydrophobicContact CD2-CG 4.46Å; F206-Y232 HydrophobicContact CE2-CD1 4.41Å; F206-Y232 HydrophobicContact CE2-CD2 4.31Å; F206-Y232 AromaticContact CE2-CG 3.9Å; F206-Y232 HydrophobicContact CE2-CG 3.9Å; F206-Y232 HydrophobicContact CZ-CD2 4.4Å; F206-Y232 HydrophobicContact CZ-CG 4.31Å; F206-V233 HydrophobicContact CD1-CG2 4.15Å; F206-V233 HydrophobicContact CE1-CG2 4.49Å; F206-A236 HydrophobicContact CB-CB 3.87Å
207	I	88.5	Confident	79.9	Confident	44 Å²	44	71.1 Å²	71.1	23%	0.226	37%	0.366	C	S	.	.	H	α-helix	trans	-65.5	-45.3	174.9	-68.8	166.3	0	0	0	110.4	M203 K204 D205 L209 L210 Q211 A236 K239 L240	M203-I207 HydrophobicContact CG-CD1 4.15Å; M203-I207 WeakPolarHBondContact O-CD1 3.36Å; M203-I207 VanDerWaalsContact O-CG1 3.29Å; M203-I207 WeakPolarHBondContact O-CG1 3.24Å; M203-I207 PolarHBondContact O-N 3.44Å; K204-I207 PolarHBondContact O-N 2.04Å; D205-I207 VanDerWaalsContact C-N 3.31Å; D205-I207 PolarHBondContact O-N 2.77Å; I207-L209 VanDerWaalsContact C-N 3.26Å; I207-L209 PolarHBondContact O-N 2.86Å; I207-L210 PolarHBondContact O-N 3.46Å; I207-Q211 VanDerWaalsContact O-CB 3.29Å; I207-Q211 WeakPolarHBondContact O-CB 3.32Å; I207-Q211 PolarHBondContact O-N 3.32Å; I207-A236 HydrophobicContact CG1-CB 4.05Å; I207-K239 HydrophobicContact CD1-CD 3.87Å; I207-L240 HydrophobicContact CG2-CD2 4.3Å
208	S	86.8	Confident	80.8	Confident	74 Å²	74	65.2 Å²	65.2	52%	0.517	34%	0.339	S	S	.	.	H	α-helix	trans	-64.2	-31.4	177.7	72.7	0	0	0	0	113	K204 D205 P212	K204-S208 PolarHBondContact O-N 2.94Å; D205-S208 PolarHBondContact O-N 2.84Å; D205-S208 VanDerWaalsContact O-N 3.11Å; D205-S208 PolarHBondContact O-OG 2.95Å; S208-P212 WeakPolarHBondContact O-CD 3.36Å
209	L	87.4	Confident	82.1	Confident	62 Å²	62	63.1 Å²	63.1	33%	0.325	33%	0.328	S	S	.	.	H	α-helix	trans	-74	-37.9	178	-168.3	68.7	0	0	0	112.8	V191 I193 D205 F206 I207	V191-L209 HydrophobicContact CG1-CD1 3.88Å; V191-L209 HydrophobicContact CG1-CD2 3.53Å; V191-L209 HydrophobicContact CG1-CG 3.5Å; I193-L209 HydrophobicContact CD1-CD2 4.23Å; I193-L209 HydrophobicContact CG1-CD2 3.65Å; D205-L209 WeakPolarHBondContact O-CB 3.33Å; D205-L209 PolarHBondContact O-N 2.99Å; F206-L209 PolarHBondContact O-N 3.26Å; I207-L209 VanDerWaalsContact C-N 3.26Å; I207-L209 PolarHBondContact O-N 2.86Å
210	L	90.8	Very high	83.6	Confident	2 Å²	2	55 Å²	55	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-87.5	-20.9	-179.7	-66.6	178.8	0	0	0	113.9	I161 F206 I207 V213 R214 V233 A236 L240 M242	I161-L210 HydrophobicContact CD1-CD2 3.65Å; F206-L210 WeakPolarHBondContact O-CB 3.48Å; F206-L210 VanDerWaalsContact O-CG 3.31Å; F206-L210 WeakPolarHBondContact O-CG 3.44Å; F206-L210 PolarHBondContact O-N 3.33Å; I207-L210 PolarHBondContact O-N 3.46Å; L210-V213 WeakPolarHBondContact O-CB 3.33Å; L210-V213 PolarHBondContact O-N 3.03Å; L210-R214 PolarHBondContact O-N 2.97Å; L210-V233 HydrophobicContact CD1-CG1 4.29Å; L210-A236 HydrophobicContact CD1-CB 3.72Å; L210-L240 HydrophobicContact CB-CD1 3.4Å; L210-L240 HydrophobicContact CD1-CD1 4.44Å; L210-M242 HydrophobicContact CB-SD 4.14Å
211	Q	89.6	Confident	85.2	Confident	102 Å²	102	52.2 Å²	52.2	48%	0.477	26%	0.262	S	S	.	.	H	α-helix	trans	-57.8	-40.5	178.8	175.7	174.7	-15.7	0	0	113.4	I207 R214 N215	I207-Q211 VanDerWaalsContact O-CB 3.29Å; I207-Q211 WeakPolarHBondContact O-CB 3.32Å; I207-Q211 PolarHBondContact O-N 3.32Å; Q211-R214 PolarHBondContact O-N 3.11Å; Q211-N215 PolarHBondContact O-N 2.88Å
212	P	85.8	Confident	86.5	Confident	44 Å²	44	50.8 Å²	50.8	29%	0.286	25%	0.25	S	S	.	.	H	α-helix	trans	-59.1	-44.7	168.8	-26.7	35.4	0	0	0	113.5	S208 R214 N215 E216	S208-P212 WeakPolarHBondContact O-CD 3.36Å; P212-R214 VanDerWaalsContact C-N 3.29Å; P212-R214 PolarHBondContact O-N 2.95Å; P212-N215 PolarHBondContact O-N 3.44Å; P212-E216 PolarHBondContact O-N 2.88Å
213	V	88.7	Confident	87.6	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-38.5	179.6	-173.8	0	0	0	0	111.2	C159 V191 L210 N215 E216 I221 M242	C159-V213 HydrophobicContact CB-CG1 4.44Å; V191-V213 HydrophobicContact CG2-CG2 3.81Å; L210-V213 WeakPolarHBondContact O-CB 3.33Å; L210-V213 PolarHBondContact O-N 3.03Å; V213-N215 VanDerWaalsContact C-N 3.3Å; V213-N215 PolarHBondContact O-N 3.48Å; V213-E216 PolarHBondContact O-N 3.49Å; V213-I221 HydrophobicContact CG1-CD1 4.44Å; V213-M242 HydrophobicContact CB-CE 4.09Å; V213-M242 HydrophobicContact CG1-CE 3.82Å
214	R	88.5	Confident	88.3	Confident	114 Å²	114	42.7 Å²	42.7	43%	0.43	21%	0.212	S	C	.	.	H	α-helix	trans	-60.7	-38.4	174	-174	-171.2	-179.7	166.7	9.1	112.6	L210 Q211 P212 E216 L240 M242	L210-R214 PolarHBondContact O-N 2.97Å; Q211-R214 PolarHBondContact O-N 3.11Å; P212-R214 VanDerWaalsContact C-N 3.29Å; P212-R214 PolarHBondContact O-N 2.95Å; R214-E216 VanDerWaalsContact C-N 3.35Å; R214-L240 WeakPolarHBondContact CD-O 3.41Å; R214-L240 PolarHBondContact NE-O 3.02Å; R214-L240 PolarHBondContact NH1-O 3.18Å; R214-L240 PolarHBondContact NH2-O 3.22Å; R214-M242 HydrophobicContact CB-CG 4.37Å; R214-M242 HydrophobicContact CB-SD 4.14Å; R214-M242 HydrophobicContact CG-CG 4.39Å
215	N	83	Confident	88.8	Confident	104 Å²	104	35.1 Å²	35.1	56%	0.556	18%	0.179	S	C	*	.	H	α-helix	trans	-80.6	-15.6	-174.8	-68.9	-12.3	0	0	0	113.5	Q211 P212 V213	Q211-N215 PolarHBondContact O-N 2.88Å; P212-N215 PolarHBondContact O-N 3.44Å; V213-N215 VanDerWaalsContact C-N 3.3Å; V213-N215 PolarHBondContact O-N 3.48Å
216	E	80.8	Confident	89	Confident	47 Å²	47	35.3 Å²	35.3	22%	0.22	17%	0.174	C	C	.	.	S	Bend	trans	-74.2	171.3	175.2	-76.3	172.1	174.4	0	0	112	R189 P212 V213 R214 R219	R189-E216 WeakPolarHBondContact CB-OE2 3.31Å; R189-E216 VanDerWaalsContact CD-OE1 3.3Å; R189-E216 WeakPolarHBondContact CD-OE1 3.45Å; R189-E216 WeakPolarHBondContact CD-OE2 3.4Å; R189-E216 IonicContact CZ-OE1 3.49Å; R189-E216 IonicContact NE-OE1 2.7Å; R189-E216 IonicContact NH1-OE1 3.25Å; R189-E216 PolarHBondContact NH1-OE1 2.93Å; P212-E216 PolarHBondContact O-N 2.88Å; V213-E216 PolarHBondContact O-N 3.49Å; R214-E216 VanDerWaalsContact C-N 3.35Å; E216-R219 VanDerWaalsContact O-CZ 3.28Å; E216-R219 PolarHBondContact O-NH1 3.12Å; E216-R219 PolarHBondContact O-NH2 3.27Å
217	Q	82.3	Confident	89.1	Confident	27 Å²	27	41.3 Å²	41.3	13%	0.126	20%	0.196	C	C	.	.	S	Bend	trans	-81.5	-22.2	-179	-65.2	-169.1	4.3	0	0	112.7	F468 K469 K471	Q217-F468 CarbonylContact O-C 3.45Å; Q217-F468 WeakPolarHBondContact O-CA 3.3Å; Q217-K469 WeakPolarHBondContact CB-O 3.46Å; Q217-K469 WeakPolarHBondContact CG-O 3.4Å; Q217-K469 PolarHBondContact O-N 3.22Å; Q217-K471 HydrophobicContact CG-CG 4Å
218	T	88.2	Confident	88.9	Confident	4 Å²	4	44.4 Å²	44.4	3%	0.025	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-74.1	137.6	-174.5	49	0	0	0	0	113.7	E157 T188 S467	E157-T218 HydrophobicContact CB-CG2 3.55Å; E157-T218 HydrophobicContact CG-CG2 4.45Å; E157-T218 WeakPolarHBondContact OE2-CG2 3.06Å; T188-T218 HydrophobicContact CG2-CG2 3.52Å; T188-T218 WeakPolarHBondContact OG1-CG2 3.42Å; T218-S467 WeakPolarHBondContact CA-O 3.4Å
219	R	91.3	Very high	89	Confident	27 Å²	27	41.1 Å²	41.1	10%	0.102	18%	0.184	C	C	.	.			trans	-118.9	-4.2	-177.8	-59.9	-65.8	166.8	-100.3	-2.9	113.6	E216 E246 W247 A248 S467 K469	E216-R219 VanDerWaalsContact O-CZ 3.28Å; E216-R219 PolarHBondContact O-NH1 3.12Å; E216-R219 PolarHBondContact O-NH2 3.27Å; R219-E246 WeakPolarHBondContact CB-O 3.46Å; R219-W247 HydrophobicContact CB-CE3 4.47Å; R219-A248 PolarHBondContact O-N 2.71Å; R219-S467 PolarHBondContact N-O 3.33Å; R219-K469 HydrophobicContact CG-CB 4.1Å
220	V	93.8	Very high	89.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.1	173.2	174.2	0	0	0	0	109.9	W155 V158 C159 L222 A248	W155-V220 HydrophobicContact CD2-CB 4.44Å; W155-V220 HydrophobicContact CD2-CG1 4.14Å; W155-V220 HydrophobicContact CD2-CG2 3.48Å; W155-V220 VanDerWaalsContact CD2-CG2 3.48Å; W155-V220 HydrophobicContact CE3-CB 4.27Å; W155-V220 HydrophobicContact CE3-CG1 3.49Å; W155-V220 VanDerWaalsContact CE3-CG1 3.49Å; W155-V220 HydrophobicContact CE3-CG2 3.74Å; W155-V220 HydrophobicContact CG-CG2 3.93Å; W155-V220 HydrophobicContact CH2-CG1 4.12Å; W155-V220 HydrophobicContact CH2-CG2 4.08Å; W155-V220 HydrophobicContact CZ2-CG2 3.85Å; W155-V220 HydrophobicContact CZ3-CB 4.42Å; W155-V220 HydrophobicContact CZ3-CG1 3.46Å; W155-V220 VanDerWaalsContact CZ3-CG1 3.46Å; W155-V220 HydrophobicContact CZ3-CG2 4.01Å; V158-V220 HydrophobicContact CB-CG1 4.3Å; V158-V220 HydrophobicContact CG1-CB 4.33Å; V158-V220 HydrophobicContact CG1-CG1 3.78Å; C159-V220 PolarHBondContact N-O 3.22Å; V220-L222 HydrophobicContact CG1-CD2 4.22Å; V220-A248 WeakPolarHBondContact CA-O 3.15Å; V220-A248 HydrophobicContact CG2-CB 4.1Å
221	I	94.7	Very high	89.1	Confident	1 Å²	1	40 Å²	40	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.7	177.1	-64.8	170	0	0	0	109.5	C159 I161 V213 M242 W247 A248 W249 I250	C159-I221 HydrophobicContact CB-CG1 4.43Å; C159-I221 WeakPolarHBondContact O-CA 3.44Å; I161-I221 HydrophobicContact CD1-CG2 3.58Å; I161-I221 HydrophobicContact CG1-CG2 4.01Å; V213-I221 HydrophobicContact CG1-CD1 4.44Å; I221-M242 HydrophobicContact CD1-CE 3.57Å; I221-W247 HydrophobicContact CD1-CE3 3.8Å; I221-W247 HydrophobicContact CD1-CZ3 3.7Å; I221-W247 HydrophobicContact CG1-CE3 4.41Å; I221-W247 HydrophobicContact CG1-CZ3 4.31Å; I221-A248 PolarHBondContact N-O 3.49Å; I221-W249 HydrophobicContact CB-CD2 4.06Å; I221-W249 HydrophobicContact CB-CE3 4.03Å; I221-W249 HydrophobicContact CB-CZ3 4.29Å; I221-W249 HydrophobicContact CD1-CD2 4.37Å; I221-W249 HydrophobicContact CD1-CH2 3.76Å; I221-W249 HydrophobicContact CD1-CZ2 3.45Å; I221-W249 VanDerWaalsContact CD1-CZ2 3.45Å; I221-W249 HydrophobicContact CD1-CZ3 4.33Å; I221-W249 HydrophobicContact CG2-CD2 4.2Å; I221-W249 HydrophobicContact CG2-CE3 3.64Å; I221-W249 HydrophobicContact CG2-CH2 4.08Å; I221-W249 HydrophobicContact CG2-CZ3 3.58Å; I221-W249 WeakPolarHBondContact O-CA 3.06Å; I221-I250 PolarHBondContact O-N 3.23Å
222	L	95.2	Very high	89.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.6	170.7	-50.4	-178.4	0	0	0	108	W146 I150 V158 C159 V160 I161 L175 V220 I250	W146-L222 HydrophobicContact CE3-CB 3.92Å; W146-L222 HydrophobicContact CE3-CD1 4.06Å; W146-L222 HydrophobicContact CE3-CG 4.41Å; W146-L222 HydrophobicContact CH2-CB 4.28Å; W146-L222 HydrophobicContact CZ3-CB 3.69Å; I150-L222 HydrophobicContact CD1-CD1 3.91Å; V158-L222 HydrophobicContact CB-CD1 4.14Å; V158-L222 HydrophobicContact CB-CG 4.34Å; V158-L222 HydrophobicContact CG1-CD1 4.41Å; V158-L222 HydrophobicContact CG2-CD1 4.08Å; C159-L222 PolarHBondContact O-N 2.99Å; V160-L222 HydrophobicContact CG2-CB 4.45Å; V160-L222 HydrophobicContact CG2-CD1 4.21Å; I161-L222 PolarHBondContact N-O 3.08Å; L175-L222 HydrophobicContact CD1-CD1 4.22Å; V220-L222 HydrophobicContact CG1-CD2 4.22Å; L222-I250 WeakPolarHBondContact CA-O 3.19Å; L222-I250 HydrophobicContact CD2-CB 3.83Å; L222-I250 HydrophobicContact CD2-CD1 4.14Å; L222-I250 HydrophobicContact CD2-CG1 4.24Å
223	L	95.1	Very high	89.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	108	-173.3	-169.4	68.8	0	0	0	111.4	I161 L225 A230 V233 F234 W249 I250 V251 T252 A255	I161-L223 HydrophobicContact CB-CD1 3.73Å; I161-L223 HydrophobicContact CD1-CD1 4.44Å; I161-L223 HydrophobicContact CG2-CD1 3.71Å; I161-L223 WeakPolarHBondContact O-CA 3.43Å; L223-L225 HydrophobicContact CD1-CD1 3.54Å; L223-L225 HydrophobicContact CD1-CG 3.97Å; L223-L225 HydrophobicContact CG-CD1 4.2Å; L223-L225 HydrophobicContact CG-CG 4.34Å; L223-A230 HydrophobicContact CD2-CB 4.34Å; L223-V233 HydrophobicContact CD1-CG1 4.03Å; L223-F234 HydrophobicContact CD2-CE1 3.64Å; L223-F234 HydrophobicContact CD2-CE2 4.4Å; L223-F234 HydrophobicContact CD2-CZ 3.56Å; L223-W249 HydrophobicContact CD1-CZ3 4.42Å; L223-W249 HydrophobicContact CD2-CE3 4.48Å; L223-W249 HydrophobicContact CD2-CZ3 4.29Å; L223-I250 PolarHBondContact N-O 3.26Å; L223-V251 HydrophobicContact CB-CB 4.3Å; L223-V251 HydrophobicContact CB-CG1 3.92Å; L223-V251 HydrophobicContact CD2-CG1 4.1Å; L223-T252 PolarHBondContact O-N 3.44Å; L223-A255 HydrophobicContact CD2-CB 4.36Å
224	F	94	Very high	89.7	Confident	1 Å²	1	37.6 Å²	37.6	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	89.3	172.8	-166.1	-78.3	0	0	0	109.5	F139 W146 I161 H162 S163 D167 A168 V171 T252	F139-F224 HydrophobicContact CB-CE2 4.2Å; F139-F224 HydrophobicContact CB-CZ 3.98Å; W146-F224 HydrophobicContact CH2-CB 4Å; W146-F224 HydrophobicContact CH2-CD2 4.29Å; I161-F224 PolarHBondContact O-N 3.1Å; H162-F224 CarbonylContact C-O 3.6Å; H162-F224 VanDerWaalsContact CA-O 3.28Å; H162-F224 WeakPolarHBondContact CA-O 3.35Å; H162-F224 HydrophobicContact CB-CB 4.13Å; S163-F224 PolarHBondContact N-O 2.92Å; S163-F224 VanDerWaalsContact N-O 3.1Å; D167-F224 HydrophobicContact CB-CE1 3.85Å; D167-F224 HydrophobicContact CB-CZ 3.77Å; A168-F224 HydrophobicContact CB-CD1 3.68Å; A168-F224 HydrophobicContact CB-CE1 4.05Å; A168-F224 HydrophobicContact CB-CG 4.48Å; V171-F224 HydrophobicContact CB-CD2 4.11Å; V171-F224 HydrophobicContact CB-CE2 4.36Å; V171-F224 HydrophobicContact CG1-CD2 4.17Å; V171-F224 HydrophobicContact CG2-CD2 3.61Å; V171-F224 HydrophobicContact CG2-CE2 3.43Å; V171-F224 VanDerWaalsContact CG2-CE2 3.43Å; V171-F224 HydrophobicContact CG2-CZ 4.22Å; F224-T252 HydrophobicContact CB-CG2 4.21Å; F224-T252 HydrophobicContact CD2-CG2 3.21Å; F224-T252 HydrophobicContact CE2-CG2 3.58Å; F224-T252 HydrophobicContact CG-CG2 3.88Å
225	L	91	Very high	89.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.158	C	C	.	.			trans	-144.5	150.5	-179.2	-70.1	177.6	0	0	0	112.2	I161 I193 L223 F229 A230 V233	I161-L225 HydrophobicContact CG2-CD1 4.37Å; I193-L225 HydrophobicContact CB-CD2 4.35Å; I193-L225 HydrophobicContact CD1-CD1 3.86Å; I193-L225 HydrophobicContact CD1-CD2 4.14Å; L223-L225 HydrophobicContact CD1-CD1 3.54Å; L223-L225 HydrophobicContact CD1-CG 3.97Å; L223-L225 HydrophobicContact CG-CD1 4.2Å; L223-L225 HydrophobicContact CG-CG 4.34Å; L225-F229 HydrophobicContact CB-CB 4.33Å; L225-F229 HydrophobicContact CD1-CB 4.2Å; L225-F229 HydrophobicContact CD2-CB 4.25Å; L225-A230 HydrophobicContact CB-CB 4.3Å; L225-V233 HydrophobicContact CD1-CB 4.27Å; L225-V233 HydrophobicContact CD1-CG2 3.66Å
226	R	87.1	Confident	90.2	Very high	78 Å²	78	30.9 Å²	30.9	29%	0.294	13%	0.131	S	C	.	.			trans	-66.1	150.4	166.9	-54	180	-166.7	162.7	6.7	110.5	D165 K228 F229 A230	D165-R226 IonicContact OD2-CZ 3.21Å; D165-R226 IonicContact OD2-NE 2.69Å; D165-R226 PolarHBondContact OD2-NE 3.23Å; D165-R226 IonicContact OD2-NH2 2.7Å; D165-R226 PolarHBondContact OD2-NH2 2.97Å; R226-K228 PolarHBondContact O-N 3.27Å; R226-K228 VanDerWaalsContact O-N 3.12Å; R226-F229 HydrophobicContact CB-CD2 4.48Å; R226-F229 PolarHBondContact O-N 2.8Å; R226-A230 PolarHBondContact O-N 2.8Å
227	R	87.9	Confident	90.7	Very high	137 Å²	137	28.7 Å²	28.7	52%	0.517	12%	0.121	S	C	.	.	H	α-helix	trans	-39.5	-54.4	-177.3	-162.2	-173.8	79.4	-170.1	2.2	114.9	F229 A230 E231 Q254 D257	R227-F229 PolarHBondContact O-N 3.03Å; R227-A230 PolarHBondContact O-N 3.19Å; R227-E231 WeakPolarHBondContact O-CG 3.28Å; R227-E231 PolarHBondContact O-N 3.2Å; R227-Q254 VanDerWaalsContact CA-O 3.3Å; R227-Q254 WeakPolarHBondContact CA-O 3.4Å; R227-Q254 PolarHBondContact N-O 2.83Å; R227-D257 WeakPolarHBondContact CD-O 3.44Å; R227-D257 HydrophobicContact CG-CB 4.04Å
228	K	85	Confident	91.2	Very high	109 Å²	109	34.9 Å²	34.9	47%	0.474	14%	0.143	S	C	.	.	H	α-helix	trans	-55.8	-47.5	-178.9	-66.5	-174.8	-178.3	-179.4	0	112.5	E198 R226 E231 Y232	E198-K228 IonicContact OE2-NZ 3.75Å; E198-K228 PolarHBondContact OE2-NZ 3.13Å; R226-K228 PolarHBondContact O-N 3.27Å; R226-K228 VanDerWaalsContact O-N 3.12Å; K228-E231 WeakPolarHBondContact O-CB 3.48Å; K228-E231 PolarHBondContact O-N 2.91Å; K228-Y232 WeakPolarHBondContact O-CD2 3.42Å; K228-Y232 PolarHBondContact O-N 3.48Å
229	F	88.6	Confident	91.3	Very high	5 Å²	5	41.2 Å²	41.2	2%	0.022	17%	0.17	C	C	.	.	H	α-helix	trans	-73.4	-36	-177.3	-69.7	-75.8	0	0	0	111.9	I193 T195 E198 F206 L225 R226 R227 E231 Y232 V233	I193-F229 HydrophobicContact CG2-CD1 4.15Å; T195-F229 HydrophobicContact CG2-CD2 4.07Å; T195-F229 HydrophobicContact CG2-CE2 3.75Å; T195-F229 HydrophobicContact CG2-CZ 4.14Å; E198-F229 HydrophobicContact CG-CE2 4.2Å; E198-F229 HydrophobicContact CG-CZ 3.93Å; F206-F229 HydrophobicContact CZ-CD1 4.2Å; L225-F229 HydrophobicContact CB-CB 4.33Å; L225-F229 HydrophobicContact CD1-CB 4.2Å; L225-F229 HydrophobicContact CD2-CB 4.25Å; R226-F229 HydrophobicContact CB-CD2 4.48Å; R226-F229 PolarHBondContact O-N 2.8Å; R227-F229 PolarHBondContact O-N 3.03Å; F229-E231 VanDerWaalsContact C-N 3.27Å; F229-E231 PolarHBondContact O-N 2.88Å; F229-Y232 PolarHBondContact O-N 3.04Å; F229-V233 WeakPolarHBondContact O-CG2 3.33Å; F229-V233 PolarHBondContact O-N 2.93Å
230	A	91.3	Very high	91.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.1	-40.3	171.4	0	0	0	0	0	111.5	L223 L225 R226 R227 Y232 V233 F234 A255 A258	L223-A230 HydrophobicContact CD2-CB 4.34Å; L225-A230 HydrophobicContact CB-CB 4.3Å; R226-A230 PolarHBondContact O-N 2.8Å; R227-A230 PolarHBondContact O-N 3.19Å; A230-Y232 PolarHBondContact O-N 3.24Å; A230-V233 PolarHBondContact O-N 3.39Å; A230-F234 HydrophobicContact CB-CD2 4.45Å; A230-F234 HydrophobicContact CB-CE2 3.99Å; A230-F234 WeakPolarHBondContact O-CD2 3.25Å; A230-F234 WeakPolarHBondContact O-CG 3.2Å; A230-F234 PolarHBondContact O-N 2.86Å; A230-A255 HydrophobicContact CB-CB 3.84Å; A230-A258 HydrophobicContact CB-CB 4.33Å
231	E	90.4	Very high	91.1	Very high	39 Å²	39	41.1 Å²	41.1	18%	0.182	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-45	177.1	-69.1	169.2	153.5	0	0	112.5	R227 K228 F229 L235 A258 S259 N260	R227-E231 WeakPolarHBondContact O-CG 3.28Å; R227-E231 PolarHBondContact O-N 3.2Å; K228-E231 WeakPolarHBondContact O-CB 3.48Å; K228-E231 PolarHBondContact O-N 2.91Å; F229-E231 VanDerWaalsContact C-N 3.27Å; F229-E231 PolarHBondContact O-N 2.88Å; E231-L235 WeakPolarHBondContact O-CG 3.06Å; E231-L235 PolarHBondContact O-N 3.43Å; E231-A258 HydrophobicContact CG-CB 3.74Å; E231-S259 VanDerWaalsContact OE1-CB 3.26Å; E231-S259 WeakPolarHBondContact OE1-CB 3.41Å; E231-S259 PolarHBondContact OE1-N 3.36Å; E231-S259 PolarHBondContact OE1-OG 2.66Å; E231-N260 WeakPolarHBondContact CA-OD1 3.47Å; E231-N260 WeakPolarHBondContact CG-OD1 3.27Å; E231-N260 PolarHBondContact O-ND2 2.66Å
232	Y	89.8	Confident	91	Very high	94 Å²	94	41 Å²	41	37%	0.369	17%	0.174	S	C	.	.	H	α-helix	trans	-64.4	-42.2	174.6	-68.7	-66	0	0	0	112.8	M203 F206 K228 F229 A230 L235 A236	M203-Y232 HydrophobicContact CE-CD1 4.08Å; F206-Y232 HydrophobicContact CD2-CG 4.46Å; F206-Y232 HydrophobicContact CE2-CD1 4.41Å; F206-Y232 HydrophobicContact CE2-CD2 4.31Å; F206-Y232 AromaticContact CE2-CG 3.9Å; F206-Y232 HydrophobicContact CE2-CG 3.9Å; F206-Y232 HydrophobicContact CZ-CD2 4.4Å; F206-Y232 HydrophobicContact CZ-CG 4.31Å; K228-Y232 WeakPolarHBondContact O-CD2 3.42Å; K228-Y232 PolarHBondContact O-N 3.48Å; F229-Y232 PolarHBondContact O-N 3.04Å; A230-Y232 PolarHBondContact O-N 3.24Å; Y232-L235 PolarHBondContact O-N 2.85Å; Y232-A236 PolarHBondContact O-N 3.2Å
233	V	92.2	Very high	90.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.8	-42.8	178.3	168.9	0	0	0	0	111.5	I193 F206 L210 L223 L225 F229 A230 L235 A236 A237 W249	I193-V233 HydrophobicContact CD1-CG2 3.73Å; F206-V233 HydrophobicContact CD1-CG2 4.15Å; F206-V233 HydrophobicContact CE1-CG2 4.49Å; L210-V233 HydrophobicContact CD1-CG1 4.29Å; L223-V233 HydrophobicContact CD1-CG1 4.03Å; L225-V233 HydrophobicContact CD1-CB 4.27Å; L225-V233 HydrophobicContact CD1-CG2 3.66Å; F229-V233 WeakPolarHBondContact O-CG2 3.33Å; F229-V233 PolarHBondContact O-N 2.93Å; A230-V233 PolarHBondContact O-N 3.39Å; V233-L235 PolarHBondContact O-N 3.19Å; V233-A236 PolarHBondContact O-N 3.5Å; V233-A237 VanDerWaalsContact O-CB 3.23Å; V233-A237 WeakPolarHBondContact O-CB 3.44Å; V233-A237 PolarHBondContact O-N 3.26Å; V233-W249 HydrophobicContact CG1-CH2 4.28Å; V233-W249 HydrophobicContact CG1-CZ3 4.24Å
234	F	92.7	Very high	90.2	Very high	3 Å²	3	48.4 Å²	48.4	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-35.9	176.4	-64.4	-44.6	0	0	0	112.7	L223 A230 R238 W249 V251 A258 P262	L223-F234 HydrophobicContact CD2-CE1 3.64Å; L223-F234 HydrophobicContact CD2-CE2 4.4Å; L223-F234 HydrophobicContact CD2-CZ 3.56Å; A230-F234 HydrophobicContact CB-CD2 4.45Å; A230-F234 HydrophobicContact CB-CE2 3.99Å; A230-F234 WeakPolarHBondContact O-CD2 3.25Å; A230-F234 WeakPolarHBondContact O-CG 3.2Å; A230-F234 PolarHBondContact O-N 2.86Å; F234-R238 WeakPolarHBondContact O-CB 2.83Å; F234-R238 PolarHBondContact O-N 2.96Å; F234-W249 HydrophobicContact CE1-CE3 4.14Å; F234-W249 HydrophobicContact CE1-CZ3 4.28Å; F234-V251 HydrophobicContact CE1-CG1 4.49Å; F234-V251 HydrophobicContact CZ-CG1 4.16Å; F234-A258 HydrophobicContact CD2-CB 4.09Å; F234-A258 HydrophobicContact CE2-CB 3.84Å; F234-P262 HydrophobicContact CB-CG 4.35Å; F234-P262 HydrophobicContact CD1-CG 3.67Å; F234-P262 HydrophobicContact CE1-CG 4.13Å; F234-P262 HydrophobicContact CG-CG 4.03Å
235	L	90.7	Very high	89.4	Confident	77 Å²	77	50.7 Å²	50.7	40%	0.403	23%	0.228	S	C	.	.	H	α-helix	trans	-65.1	-42.3	172.9	-72.1	176.3	0	0	0	112.4	M203 E231 Y232 V233 K239 N260	M203-L235 HydrophobicContact CE-CB 3.6Å; M203-L235 HydrophobicContact CE-CD1 3.7Å; M203-L235 HydrophobicContact CE-CG 4.3Å; M203-L235 HydrophobicContact SD-CB 4.15Å; E231-L235 WeakPolarHBondContact O-CG 3.06Å; E231-L235 PolarHBondContact O-N 3.43Å; Y232-L235 PolarHBondContact O-N 2.85Å; V233-L235 PolarHBondContact O-N 3.19Å; L235-K239 PolarHBondContact O-N 3.25Å; L235-N260 WeakPolarHBondContact CG-ND2 3.42Å
236	A	91.5	Very high	89.2	Confident	0 Å²	0	55 Å²	55	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.7	-44.4	177.4	0	0	0	0	0	111.6	M203 F206 I207 L210 Y232 V233 R238 K239 L240	M203-A236 HydrophobicContact SD-CB 4.26Å; F206-A236 HydrophobicContact CB-CB 3.87Å; I207-A236 HydrophobicContact CG1-CB 4.05Å; L210-A236 HydrophobicContact CD1-CB 3.72Å; Y232-A236 PolarHBondContact O-N 3.2Å; V233-A236 PolarHBondContact O-N 3.5Å; A236-R238 VanDerWaalsContact C-N 3.31Å; A236-R238 PolarHBondContact O-N 3.17Å; A236-K239 PolarHBondContact O-N 2.64Å; A236-K239 VanDerWaalsContact O-N 3.13Å; A236-L240 PolarHBondContact O-N 3.28Å
237	A	92.7	Very high	89.4	Confident	0 Å²	0	52 Å²	52	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-57.7	-41.1	174	0	0	0	0	0	112.1	V233 L240 G241 M242 L243 W249	V233-A237 VanDerWaalsContact O-CB 3.23Å; V233-A237 WeakPolarHBondContact O-CB 3.44Å; V233-A237 PolarHBondContact O-N 3.26Å; A237-L240 CarbonylContact O-C 3.58Å; A237-L240 PolarHBondContact O-N 3.09Å; A237-G241 PolarHBondContact O-N 2.88Å; A237-G241 VanDerWaalsContact O-N 3.09Å; A237-M242 HydrophobicContact CB-CB 4.1Å; A237-M242 PolarHBondContact O-N 2.68Å; A237-L243 HydrophobicContact CB-CD2 4.19Å; A237-L243 HydrophobicContact CB-CG 4.16Å; A237-W249 HydrophobicContact CB-CH2 3.85Å; A237-W249 HydrophobicContact CB-CZ2 3.79Å
238	R	91.2	Very high	89.6	Confident	157 Å²	157	45.5 Å²	45.5	59%	0.592	21%	0.213	S	C	*	.	H	α-helix	trans	-61.4	-42.4	174.3	-171.9	173.9	177.3	166.6	-0.4	112.4	F234 A236 L240 G241 L243	F234-R238 WeakPolarHBondContact O-CB 2.83Å; F234-R238 PolarHBondContact O-N 2.96Å; A236-R238 VanDerWaalsContact C-N 3.31Å; A236-R238 PolarHBondContact O-N 3.17Å; R238-L240 VanDerWaalsContact C-N 3.27Å; R238-L240 PolarHBondContact O-N 3.26Å; R238-G241 PolarHBondContact O-N 2.87Å; R238-L243 HydrophobicContact CB-CD1 3.73Å; R238-L243 HydrophobicContact CG-CD1 4.35Å
239	K	90.7	Very high	90.1	Very high	137 Å²	137	40.3 Å²	40.3	60%	0.596	19%	0.19	S	C	*	.	H	α-helix	trans	-67.5	-28.1	176	-72.5	176.4	176.6	178.6	0	112.9	I207 L235 A236	I207-K239 HydrophobicContact CD1-CD 3.87Å; L235-K239 PolarHBondContact O-N 3.25Å; A236-K239 PolarHBondContact O-N 2.64Å; A236-K239 VanDerWaalsContact O-N 3.13Å
240	L	91	Very high	90.4	Very high	14 Å²	14	40.1 Å²	40.1	7%	0.073	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	2.1	178.4	-71.9	172.4	0	0	0	114	I207 L210 R214 A236 A237 R238 M242	I207-L240 HydrophobicContact CG2-CD2 4.3Å; L210-L240 HydrophobicContact CB-CD1 3.4Å; L210-L240 HydrophobicContact CD1-CD1 4.44Å; R214-L240 WeakPolarHBondContact CD-O 3.41Å; R214-L240 PolarHBondContact NE-O 3.02Å; R214-L240 PolarHBondContact NH1-O 3.18Å; R214-L240 PolarHBondContact NH2-O 3.22Å; A236-L240 PolarHBondContact O-N 3.28Å; A237-L240 CarbonylContact O-C 3.58Å; A237-L240 PolarHBondContact O-N 3.09Å; R238-L240 VanDerWaalsContact C-N 3.27Å; R238-L240 PolarHBondContact O-N 3.26Å; L240-M242 HydrophobicContact CB-CG 3.91Å; L240-M242 HydrophobicContact CB-SD 3.86Å; L240-M242 HydrophobicContact CD1-SD 3.96Å; L240-M242 PolarHBondContact O-N 3.27Å
241	G	90.6	Very high	90.6	Very high	11 Å²	11	40.1 Å²	40.1	11%	0.113	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	17.7	-178.2	0	0	0	0	0	114.1	A237 R238 L243 E244 W247	A237-G241 PolarHBondContact O-N 2.88Å; A237-G241 VanDerWaalsContact O-N 3.09Å; R238-G241 PolarHBondContact O-N 2.87Å; G241-L243 PolarHBondContact O-N 3.1Å; G241-E244 WeakPolarHBondContact O-CG 3.41Å; G241-W247 PolarHBondContact O-NE1 3.12Å
242	M	91.5	Very high	90.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	12	-177.7	-60.6	171.2	68.5	0	0	113.4	L210 V213 R214 I221 A237 L240 W247 W249	L210-M242 HydrophobicContact CB-SD 4.14Å; V213-M242 HydrophobicContact CB-CE 4.09Å; V213-M242 HydrophobicContact CG1-CE 3.82Å; R214-M242 HydrophobicContact CB-CG 4.37Å; R214-M242 HydrophobicContact CB-SD 4.14Å; R214-M242 HydrophobicContact CG-CG 4.39Å; I221-M242 HydrophobicContact CD1-CE 3.57Å; A237-M242 HydrophobicContact CB-CB 4.1Å; A237-M242 PolarHBondContact O-N 2.68Å; L240-M242 HydrophobicContact CB-CG 3.91Å; L240-M242 HydrophobicContact CB-SD 3.86Å; L240-M242 HydrophobicContact CD1-SD 3.96Å; L240-M242 PolarHBondContact O-N 3.27Å; M242-W247 HydrophobicContact CB-CD2 4.22Å; M242-W247 HydrophobicContact CB-CE3 4.49Å; M242-W247 HydrophobicContact CB-CZ2 4.34Å; M242-W247 HydrophobicContact CE-CH2 3.99Å; M242-W247 HydrophobicContact CE-CZ3 3.97Å; M242-W247 HydrophobicContact CG-CH2 4.17Å; M242-W247 HydrophobicContact CG-CZ2 3.94Å; M242-W247 WeakPolarHBondContact O-CB 3.33Å; M242-W247 VanDerWaalsContact O-CG 3.28Å; M242-W249 HydrophobicContact CB-CZ2 4.18Å; M242-W249 PolarHBondContact O-NE1 3Å
243	L	89.7	Confident	90.8	Very high	31 Å²	31	35.9 Å²	35.9	16%	0.162	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	11.8	179.7	-57	178	0	0	0	112	A237 R238 G241 W249 P262 P432 G433	A237-L243 HydrophobicContact CB-CD2 4.19Å; A237-L243 HydrophobicContact CB-CG 4.16Å; R238-L243 HydrophobicContact CB-CD1 3.73Å; R238-L243 HydrophobicContact CG-CD1 4.35Å; G241-L243 PolarHBondContact O-N 3.1Å; L243-W249 HydrophobicContact CD2-CZ2 4.08Å; L243-P262 HydrophobicContact CD1-CB 4.05Å; L243-P262 HydrophobicContact CD1-CG 3.77Å; L243-P262 HydrophobicContact CD2-CB 3.94Å; L243-P262 HydrophobicContact CD2-CG 3.56Å; L243-P262 HydrophobicContact CG-CB 4.48Å; L243-P262 HydrophobicContact CG-CG 4.3Å; L243-P432 WeakPolarHBondContact O-CB 3.49Å; L243-G433 PolarHBondContact O-N 2.68Å; L243-G433 VanDerWaalsContact O-N 3.13Å
244	E	85.3	Confident	90.7	Very high	124 Å²	124	37.2 Å²	37.2	58%	0.579	18%	0.179	S	C	*	.	S	Bend	trans	-82	175.3	176.3	-66.8	176.1	-161.1	0	0	110.9	G241 W247	G241-E244 WeakPolarHBondContact O-CG 3.41Å; E244-W247 PolarHBondContact O-N 2.85Å
245	A	77.4	Confident	90.6	Very high	48 Å²	48	37.1 Å²	37.1	40%	0.397	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	154.6	168.2	0	0	0	0	0	110.6	P432	A245-P432 WeakPolarHBondContact CA-O 3.35Å
246	E	85	Confident	90.6	Very high	90 Å²	90	33.6 Å²	33.6	42%	0.421	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-35.1	-165.3	-52.9	174.7	170.5	0	0	115.4	R219 P465 K469	R219-E246 WeakPolarHBondContact CB-O 3.46Å; E246-P465 WeakPolarHBondContact O-CB 3.12Å; E246-K469 IonicContact OE1-NZ 3.78Å; E246-K469 PolarHBondContact OE1-NZ 3.17Å; E246-K469 WeakPolarHBondContact OE2-CD 3.42Å; E246-K469 WeakPolarHBondContact OE2-CE 3.36Å; E246-K469 IonicContact OE2-NZ 2.68Å; E246-K469 PolarHBondContact OE2-NZ 3.06Å
247	W	91.7	Very high	90.4	Very high	16 Å²	16	38 Å²	38	6%	0.061	18%	0.183	C	C	.	.			trans	-78.6	143	-177.9	-66.3	90.2	0	0	0	112.5	R219 I221 G241 M242 E244 P432	R219-W247 HydrophobicContact CB-CE3 4.47Å; I221-W247 HydrophobicContact CD1-CE3 3.8Å; I221-W247 HydrophobicContact CD1-CZ3 3.7Å; I221-W247 HydrophobicContact CG1-CE3 4.41Å; I221-W247 HydrophobicContact CG1-CZ3 4.31Å; G241-W247 PolarHBondContact O-NE1 3.12Å; M242-W247 HydrophobicContact CB-CD2 4.22Å; M242-W247 HydrophobicContact CB-CE3 4.49Å; M242-W247 HydrophobicContact CB-CZ2 4.34Å; M242-W247 HydrophobicContact CE-CH2 3.99Å; M242-W247 HydrophobicContact CE-CZ3 3.97Å; M242-W247 HydrophobicContact CG-CH2 4.17Å; M242-W247 HydrophobicContact CG-CZ2 3.94Å; M242-W247 WeakPolarHBondContact O-CB 3.33Å; M242-W247 VanDerWaalsContact O-CG 3.28Å; E244-W247 PolarHBondContact O-N 2.85Å; W247-P432 VanDerWaalsContact O-CD 3.27Å; W247-P432 WeakPolarHBondContact O-CD 3.37Å; W247-P432 WeakPolarHBondContact O-CG 3.38Å
248	A	93.5	Very high	90.3	Very high	1 Å²	1	38 Å²	38	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131	174.1	0	0	0	0	0	109.9	W155 R219 V220 I221 W431 P465	W155-A248 HydrophobicContact CH2-CB 3.72Å; W155-A248 HydrophobicContact CZ2-CB 3.6Å; R219-A248 PolarHBondContact O-N 2.71Å; V220-A248 WeakPolarHBondContact CA-O 3.15Å; V220-A248 HydrophobicContact CG2-CB 4.1Å; I221-A248 PolarHBondContact N-O 3.49Å; A248-W431 HydrophobicContact CB-CE3 3.97Å; A248-W431 HydrophobicContact CB-CZ3 3.77Å; A248-P465 HydrophobicContact CB-CG 4.32Å
249	W	94.9	Very high	90.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.8	-177.4	-70.5	74.5	0	0	0	109.7	I221 L223 V233 F234 A237 M242 L243 V265 I266	I221-W249 HydrophobicContact CB-CD2 4.06Å; I221-W249 HydrophobicContact CB-CE3 4.03Å; I221-W249 HydrophobicContact CB-CZ3 4.29Å; I221-W249 HydrophobicContact CD1-CD2 4.37Å; I221-W249 HydrophobicContact CD1-CH2 3.76Å; I221-W249 HydrophobicContact CD1-CZ2 3.45Å; I221-W249 VanDerWaalsContact CD1-CZ2 3.45Å; I221-W249 HydrophobicContact CD1-CZ3 4.33Å; I221-W249 HydrophobicContact CG2-CD2 4.2Å; I221-W249 HydrophobicContact CG2-CE3 3.64Å; I221-W249 HydrophobicContact CG2-CH2 4.08Å; I221-W249 HydrophobicContact CG2-CZ3 3.58Å; I221-W249 WeakPolarHBondContact O-CA 3.06Å; L223-W249 HydrophobicContact CD1-CZ3 4.42Å; L223-W249 HydrophobicContact CD2-CE3 4.48Å; L223-W249 HydrophobicContact CD2-CZ3 4.29Å; V233-W249 HydrophobicContact CG1-CH2 4.28Å; V233-W249 HydrophobicContact CG1-CZ3 4.24Å; F234-W249 HydrophobicContact CE1-CE3 4.14Å; F234-W249 HydrophobicContact CE1-CZ3 4.28Å; A237-W249 HydrophobicContact CB-CH2 3.85Å; A237-W249 HydrophobicContact CB-CZ2 3.79Å; M242-W249 HydrophobicContact CB-CZ2 4.18Å; M242-W249 PolarHBondContact O-NE1 3Å; L243-W249 HydrophobicContact CD2-CZ2 4.08Å; W249-V265 HydrophobicContact CB-CG1 4.27Å; W249-V265 HydrophobicContact CB-CG2 4.1Å; W249-I266 PolarHBondContact O-N 3.48Å
250	I	95.3	Very high	90.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.8	165.3	-59.7	-176.3	0	0	0	107.9	W146 L149 F153 W155 I221 L222 L223 I266	W146-I250 HydrophobicContact CD2-CG2 4.3Å; W146-I250 HydrophobicContact CG-CG2 4.14Å; W146-I250 HydrophobicContact CZ2-CG2 4.48Å; L149-I250 HydrophobicContact CB-CD1 4.07Å; L149-I250 HydrophobicContact CD1-CD1 4.1Å; F153-I250 HydrophobicContact CE2-CD1 4.36Å; W155-I250 HydrophobicContact CH2-CD1 4.19Å; W155-I250 HydrophobicContact CH2-CG1 4.35Å; W155-I250 HydrophobicContact CZ3-CD1 3.58Å; W155-I250 HydrophobicContact CZ3-CG1 4.08Å; I221-I250 PolarHBondContact O-N 3.23Å; L222-I250 WeakPolarHBondContact CA-O 3.19Å; L222-I250 HydrophobicContact CD2-CB 3.83Å; L222-I250 HydrophobicContact CD2-CD1 4.14Å; L222-I250 HydrophobicContact CD2-CG1 4.24Å; L223-I250 PolarHBondContact N-O 3.26Å; I250-I266 CarbonylContact C-O 3.53Å; I250-I266 VanDerWaalsContact CA-O 3.29Å; I250-I266 WeakPolarHBondContact CA-O 3.36Å; I250-I266 HydrophobicContact CG1-CB 4.44Å
251	V	95.1	Very high	90	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	151.3	-175.1	-46	0	0	0	0	112	L223 F234 A255 L256 V265 I266 G267 V268	L223-V251 HydrophobicContact CB-CB 4.3Å; L223-V251 HydrophobicContact CB-CG1 3.92Å; L223-V251 HydrophobicContact CD2-CG1 4.1Å; F234-V251 HydrophobicContact CE1-CG1 4.49Å; F234-V251 HydrophobicContact CZ-CG1 4.16Å; V251-A255 HydrophobicContact CB-CB 3.93Å; V251-A255 HydrophobicContact CG2-CB 4.25Å; V251-L256 HydrophobicContact CG2-CD2 3.74Å; V251-L256 HydrophobicContact CG2-CG 3.89Å; V251-V265 HydrophobicContact CB-CG1 4.27Å; V251-V265 HydrophobicContact CG1-CG1 3.46Å; V251-V265 VanDerWaalsContact CG1-CG1 3.46Å; V251-V265 HydrophobicContact CG2-CG1 3.75Å; V251-I266 PolarHBondContact N-O 2.04Å; V251-G267 WeakPolarHBondContact O-CA 3.06Å; V251-V268 PolarHBondContact O-N 2.95Å
252	T	93.2	Very high	90	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.148	C	C	.	.			trans	-68.6	163.4	172.7	48.9	0	0	0	0	112.8	E142 W146 L223 F224 Q254 A255 L256	E142-T252 VanDerWaalsContact OE2-CA 3.31Å; E142-T252 WeakPolarHBondContact OE2-CA 3.4Å; E142-T252 WeakPolarHBondContact OE2-CB 3.03Å; W146-T252 HydrophobicContact CH2-CG2 3.93Å; W146-T252 HydrophobicContact CZ2-CG2 3.62Å; L223-T252 PolarHBondContact O-N 3.44Å; F224-T252 HydrophobicContact CB-CG2 4.21Å; F224-T252 HydrophobicContact CD2-CG2 3.21Å; F224-T252 HydrophobicContact CE2-CG2 3.58Å; F224-T252 HydrophobicContact CG-CG2 3.88Å; T252-Q254 VanDerWaalsContact C-N 3.26Å; T252-Q254 PolarHBondContact O-N 2.65Å; T252-A255 PolarHBondContact O-N 3.05Å; T252-L256 PolarHBondContact O-N 2.84Å
253	E	91.3	Very high	90	Very high	45 Å²	45	28.8 Å²	28.8	21%	0.21	16%	0.156	C	C	.	.	H	α-helix	trans	-51.6	-43.5	171.3	-172.2	175.1	114.1	0	0	112.7	R119 E142 A255 L256 D257 V268 R269 L270	R119-E253 IonicContact CZ-OE2 2.84Å; R119-E253 IonicContact NH1-OE1 3.71Å; R119-E253 PolarHBondContact NH1-OE1 3.02Å; R119-E253 IonicContact NH1-OE2 2.62Å; R119-E253 PolarHBondContact NH1-OE2 3.01Å; E142-E253 PolarHBondContact OE2-N 3.28Å; E142-E253 VanDerWaalsContact OE2-N 3.14Å; E253-A255 PolarHBondContact O-N 2.86Å; E253-A255 VanDerWaalsContact O-N 3.16Å; E253-L256 WeakPolarHBondContact O-CB 3.43Å; E253-L256 PolarHBondContact O-N 2.98Å; E253-L256 VanDerWaalsContact O-N 3.11Å; E253-D257 PolarHBondContact O-N 2.8Å; E253-V268 VanDerWaalsContact CA-O 3.32Å; E253-V268 WeakPolarHBondContact CA-O 3.35Å; E253-V268 WeakPolarHBondContact CB-O 3.39Å; E253-V268 PolarHBondContact N-O 2.87Å; E253-R269 HydrophobicContact CG-CB 4.12Å; E253-R269 WeakPolarHBondContact OE2-CA 3.44Å; E253-L270 PolarHBondContact OE2-N 2.79Å
254	Q	88.8	Confident	90	Very high	28 Å²	28	27.3 Å²	27.3	13%	0.131	15%	0.148	C	C	.	.	H	α-helix	trans	-63.4	-23.3	179.7	-58.7	-172.9	-56.4	0	0	114	F139 R227 T252	F139-Q254 HydrophobicContact CD1-CG 4.01Å; F139-Q254 HydrophobicContact CE1-CG 3.55Å; F139-Q254 HydrophobicContact CE2-CG 4.11Å; F139-Q254 VanDerWaalsContact CE2-NE2 3.28Å; F139-Q254 HydrophobicContact CG-CG 4.49Å; F139-Q254 HydrophobicContact CZ-CG 3.6Å; R227-Q254 VanDerWaalsContact CA-O 3.3Å; R227-Q254 WeakPolarHBondContact CA-O 3.4Å; R227-Q254 PolarHBondContact N-O 2.83Å; T252-Q254 VanDerWaalsContact C-N 3.26Å; T252-Q254 PolarHBondContact O-N 2.65Å
255	A	91.8	Very high	90.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-93.8	-24.9	177.9	0	0	0	0	0	111.8	L223 A230 V251 T252 E253 D257 A258	L223-A255 HydrophobicContact CD2-CB 4.36Å; A230-A255 HydrophobicContact CB-CB 3.84Å; V251-A255 HydrophobicContact CB-CB 3.93Å; V251-A255 HydrophobicContact CG2-CB 4.25Å; T252-A255 PolarHBondContact O-N 3.05Å; E253-A255 PolarHBondContact O-N 2.86Å; E253-A255 VanDerWaalsContact O-N 3.16Å; A255-D257 PolarHBondContact O-N 3.1Å; A255-A258 VanDerWaalsContact O-CB 3.25Å; A255-A258 WeakPolarHBondContact O-CB 3.47Å; A255-A258 PolarHBondContact O-N 3.23Å
256	L	90.9	Very high	91.2	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.016	10%	0.102	C	C	.	.	H	α-helix	trans	-59.2	-30.7	168.9	-77.3	177.6	0	0	0	112.4	V251 T252 E253 A258 I261 R269 V371 R393 L396	V251-L256 HydrophobicContact CG2-CD2 3.74Å; V251-L256 HydrophobicContact CG2-CG 3.89Å; T252-L256 PolarHBondContact O-N 2.84Å; E253-L256 WeakPolarHBondContact O-CB 3.43Å; E253-L256 PolarHBondContact O-N 2.98Å; E253-L256 VanDerWaalsContact O-N 3.11Å; L256-A258 PolarHBondContact O-N 3.44Å; L256-I261 HydrophobicContact CD2-CD1 3.66Å; L256-R269 HydrophobicContact CD1-CB 4.14Å; L256-V371 HydrophobicContact CD1-CG2 3.45Å; L256-V371 VanDerWaalsContact CD1-CG2 3.45Å; L256-V371 HydrophobicContact CD2-CG2 3.97Å; L256-V371 HydrophobicContact CG-CG2 4.38Å; L256-R393 PolarHBondContact O-NH2 3.48Å; L256-L396 HydrophobicContact CD2-CD2 4.17Å
257	D	87.8	Confident	91.7	Very high	92 Å²	92	14.9 Å²	14.9	49%	0.492	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-11.7	179	-81	-15.2	0	0	0	114.4	R227 E253 A255 S259 R393	R227-D257 WeakPolarHBondContact CD-O 3.44Å; R227-D257 HydrophobicContact CG-CB 4.04Å; E253-D257 PolarHBondContact O-N 2.8Å; A255-D257 PolarHBondContact O-N 3.1Å; D257-S259 PolarHBondContact O-N 2.85Å; D257-R393 PolarHBondContact O-NH1 2.7Å
258	A	89.1	Confident	91.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.			trans	-54.8	133.2	-178.9	0	0	0	0	0	112.1	A230 E231 F234 A255 L256 N260 I261 R393	A230-A258 HydrophobicContact CB-CB 4.33Å; E231-A258 HydrophobicContact CG-CB 3.74Å; F234-A258 HydrophobicContact CD2-CB 4.09Å; F234-A258 HydrophobicContact CE2-CB 3.84Å; A255-A258 VanDerWaalsContact O-CB 3.25Å; A255-A258 WeakPolarHBondContact O-CB 3.47Å; A255-A258 PolarHBondContact O-N 3.23Å; L256-A258 PolarHBondContact O-N 3.44Å; A258-N260 PolarHBondContact O-N 2.75Å; A258-I261 PolarHBondContact O-N 2.99Å; A258-R393 PolarHBondContact O-NH1 3.17Å; A258-R393 VanDerWaalsContact O-NH1 3.1Å
259	S	87.4	Confident	91.6	Very high	67 Å²	67	16.4 Å²	16.4	47%	0.469	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-31.3	-179.3	54.2	0	0	0	0	113.2	E231 D257	E231-S259 VanDerWaalsContact OE1-CB 3.26Å; E231-S259 WeakPolarHBondContact OE1-CB 3.41Å; E231-S259 PolarHBondContact OE1-N 3.36Å; E231-S259 PolarHBondContact OE1-OG 2.66Å; D257-S259 PolarHBondContact O-N 2.85Å
260	N	90	Very high	91.4	Very high	17 Å²	17	17.7 Å²	17.7	9%	0.091	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	26.7	-173.7	70.8	-17.8	0	0	0	114.4	E231 L235 A258 F391	E231-N260 WeakPolarHBondContact CA-OD1 3.47Å; E231-N260 WeakPolarHBondContact CG-OD1 3.27Å; E231-N260 PolarHBondContact O-ND2 2.66Å; L235-N260 WeakPolarHBondContact CG-ND2 3.42Å; A258-N260 PolarHBondContact O-N 2.75Å; N260-F391 HydrophobicContact CB-CD1 4.44Å; N260-F391 HydrophobicContact CB-CD2 4.39Å; N260-F391 HydrophobicContact CB-CE1 4.32Å; N260-F391 HydrophobicContact CB-CE2 4.24Å; N260-F391 HydrophobicContact CB-CG 4.5Å; N260-F391 HydrophobicContact CB-CZ 4.22Å; N260-F391 WeakPolarHBondContact O-CZ 3.36Å
261	I	90.7	Very high	91	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-56.2	125.6	-176.9	179.6	166.9	0	0	0	112.6	L256 A258 V265 A373 F391 R393 P394 L396	L256-I261 HydrophobicContact CD2-CD1 3.66Å; A258-I261 PolarHBondContact O-N 2.99Å; I261-V265 HydrophobicContact CD1-CB 4.45Å; I261-V265 HydrophobicContact CD1-CG1 4.32Å; I261-V265 HydrophobicContact CG1-CB 4.34Å; I261-A373 HydrophobicContact CD1-CB 4.12Å; I261-A373 HydrophobicContact CG1-CB 4.24Å; I261-F391 WeakPolarHBondContact O-CZ 3.27Å; I261-R393 HydrophobicContact CG2-CG 4.14Å; I261-P394 HydrophobicContact CG2-CG 4Å; I261-P394 VanDerWaalsContact O-CD 3.26Å; I261-P394 WeakPolarHBondContact O-CD 3.36Å; I261-P394 VanDerWaalsContact O-CG 3.25Å; I261-P394 WeakPolarHBondContact O-CG 3.18Å; I261-L396 HydrophobicContact CD1-CD2 4.4Å
262	P	90.4	Very high	89.9	Confident	11 Å²	11	29.1 Å²	29.1	7%	0.071	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-66	153.1	-179.4	-13.4	20.7	0	0	0	114.6	F234 L243 V265 A373	F234-P262 HydrophobicContact CB-CG 4.35Å; F234-P262 HydrophobicContact CD1-CG 3.67Å; F234-P262 HydrophobicContact CE1-CG 4.13Å; F234-P262 HydrophobicContact CG-CG 4.03Å; L243-P262 HydrophobicContact CD1-CB 4.05Å; L243-P262 HydrophobicContact CD1-CG 3.77Å; L243-P262 HydrophobicContact CD2-CB 3.94Å; L243-P262 HydrophobicContact CD2-CG 3.56Å; L243-P262 HydrophobicContact CG-CB 4.48Å; L243-P262 HydrophobicContact CG-CG 4.3Å; P262-V265 HydrophobicContact CB-CG2 3.77Å; P262-V265 HydrophobicContact CG-CG2 3.86Å; P262-V265 WeakPolarHBondContact O-CG2 3.34Å; P262-A373 WeakPolarHBondContact O-CB 3.42Å
263	N	90.2	Very high	89.1	Confident	32 Å²	32	31.5 Å²	31.5	17%	0.171	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	140.8	168.4	-172.4	35.7	0	0	0	111.1	V265 A373 Q374 I375	N263-V265 VanDerWaalsContact C-N 3.32Å; N263-A373 PolarHBondContact OD1-O 3.32Å; N263-A373 VanDerWaalsContact OD1-O 3.09Å; N263-Q374 WeakPolarHBondContact OD1-CA 3.46Å; N263-I375 HydrophobicContact CB-CD1 3.98Å; N263-I375 HydrophobicContact CB-CG1 4.14Å; N263-I375 PolarHBondContact OD1-N 3.44Å
264	G	90.5	Very high	88.9	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	1.6	178.8	0	0	0	0	0	115.9	N372 A373 I430 P432	G264-N372 PolarHBondContact O-ND2 3.08Å; G264-N372 VanDerWaalsContact O-ND2 3.16Å; G264-A373 PolarHBondContact N-O 2.87Å; G264-I430 CarbonylContact C-O 3.23Å; G264-I430 WeakPolarHBondContact CA-O 3.32Å; G264-P432 WeakPolarHBondContact O-CD 3.43Å
265	V	93.5	Very high	88.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.182	C	C	.	.			trans	-67.7	136.5	173.7	175	0	0	0	0	110.1	W249 V251 I261 P262 N263 N372 A373	W249-V265 HydrophobicContact CB-CG1 4.27Å; W249-V265 HydrophobicContact CB-CG2 4.1Å; V251-V265 HydrophobicContact CB-CG1 4.27Å; V251-V265 HydrophobicContact CG1-CG1 3.46Å; V251-V265 VanDerWaalsContact CG1-CG1 3.46Å; V251-V265 HydrophobicContact CG2-CG1 3.75Å; I261-V265 HydrophobicContact CD1-CB 4.45Å; I261-V265 HydrophobicContact CD1-CG1 4.32Å; I261-V265 HydrophobicContact CG1-CB 4.34Å; P262-V265 HydrophobicContact CB-CG2 3.77Å; P262-V265 HydrophobicContact CG-CG2 3.86Å; P262-V265 WeakPolarHBondContact O-CG2 3.34Å; N263-V265 VanDerWaalsContact C-N 3.32Å; V265-N372 WeakPolarHBondContact O-CA 3.07Å; V265-N372 PolarHBondContact O-ND2 2.99Å; V265-N372 VanDerWaalsContact O-ND2 3.17Å; V265-A373 HydrophobicContact CB-CB 4.41Å; V265-A373 PolarHBondContact O-N 2.86Å
266	I	94.8	Very high	88.9	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	139.8	169.3	-62	176.4	0	0	0	108.1	F153 W249 I250 V251 I370 V371 L429 W431	F153-I266 HydrophobicContact CE2-CD1 4.11Å; F153-I266 HydrophobicContact CZ-CD1 3.86Å; W249-I266 PolarHBondContact O-N 3.48Å; I250-I266 CarbonylContact C-O 3.53Å; I250-I266 VanDerWaalsContact CA-O 3.29Å; I250-I266 WeakPolarHBondContact CA-O 3.36Å; I250-I266 HydrophobicContact CG1-CB 4.44Å; V251-I266 PolarHBondContact N-O 2.04Å; I266-I370 HydrophobicContact CG2-CG2 3.97Å; I266-V371 WeakPolarHBondContact CA-O 3.33Å; I266-L429 HydrophobicContact CD1-CD1 4.44Å; I266-L429 HydrophobicContact CD1-CD2 3.89Å; I266-L429 HydrophobicContact CG1-CD2 4.23Å; I266-W431 HydrophobicContact CD1-CH2 3.47Å; I266-W431 VanDerWaalsContact CD1-CH2 3.47Å; I266-W431 HydrophobicContact CD1-CZ2 4.25Å; I266-W431 HydrophobicContact CD1-CZ3 3.64Å; I266-W431 HydrophobicContact CG1-CZ3 4.42Å
267	G	94	Very high	88.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	163.8	167.6	0	0	0	0	0	112.9	V251 V371	V251-G267 WeakPolarHBondContact O-CA 3.06Å; G267-V371 PolarHBondContact N-O 3.14Å; G267-V371 WeakPolarHBondContact O-CG2 3.34Å; G267-V371 PolarHBondContact O-N 2.7Å
268	V	92.9	Very high	89.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	134	178.7	-177.5	0	0	0	0	108	E142 I145 L149 V251 E253 Y368	E142-V268 HydrophobicContact CG-CG1 4.18Å; I145-V268 HydrophobicContact CB-CG2 4.35Å; I145-V268 HydrophobicContact CD1-CG1 3.65Å; I145-V268 HydrophobicContact CG2-CG1 4.28Å; I145-V268 HydrophobicContact CG2-CG2 3.77Å; L149-V268 HydrophobicContact CD1-CG2 4.47Å; V251-V268 PolarHBondContact O-N 2.95Å; E253-V268 VanDerWaalsContact CA-O 3.32Å; E253-V268 WeakPolarHBondContact CA-O 3.35Å; E253-V268 WeakPolarHBondContact CB-O 3.39Å; E253-V268 PolarHBondContact N-O 2.87Å; V268-Y368 HydrophobicContact CG1-CD1 3.73Å; V268-Y368 HydrophobicContact CG1-CE1 4.44Å; V268-Y368 HydrophobicContact CG1-CG 4.05Å
269	R	91.5	Very high	89.4	Confident	50 Å²	50	34.9 Å²	34.9	19%	0.189	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	146.4	170.1	65.8	178.6	-177.1	165.7	-1.1	110.8	E253 L256 Y368 D369 V371	E253-R269 HydrophobicContact CG-CB 4.12Å; E253-R269 WeakPolarHBondContact OE2-CA 3.44Å; L256-R269 HydrophobicContact CD1-CB 4.14Å; R269-Y368 CarbonylContact O-C 3.58Å; R269-Y368 WeakPolarHBondContact O-CA 3.42Å; R269-Y368 WeakPolarHBondContact O-CB 3.46Å; R269-D369 HydrophobicContact CG-CB 4.03Å; R269-D369 IonicContact CZ-OD2 2.93Å; R269-D369 PolarHBondContact N-O 2.81Å; R269-D369 IonicContact NE-OD2 3.65Å; R269-D369 PolarHBondContact NE-OD2 3.23Å; R269-D369 IonicContact NH2-OD2 3.62Å; R269-D369 PolarHBondContact NH2-OD2 2.68Å; R269-D369 PolarHBondContact O-N 2.84Å; R269-V371 HydrophobicContact CG-CG1 4.32Å
270	L	91	Very high	89.7	Confident	26 Å²	26	32.3 Å²	32.3	14%	0.136	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	141.5	169.8	-171.2	64.2	0	0	0	108.8	V136 P137 E253 Q272 P366 Y368	V136-L270 HydrophobicContact CG1-CD2 4.17Å; P137-L270 HydrophobicContact CG-CD1 3.74Å; P137-L270 HydrophobicContact CG-CD2 4.43Å; E253-L270 PolarHBondContact OE2-N 2.79Å; L270-Q272 PolarHBondContact O-N 3.25Å; L270-P366 HydrophobicContact CD1-CB 4.21Å; L270-Y368 HydrophobicContact CB-CD1 4.27Å; L270-Y368 HydrophobicContact CB-CE1 4.3Å; L270-Y368 HydrophobicContact CD1-CD1 4.19Å; L270-Y368 HydrophobicContact CD1-CE1 4.02Å
271	L	86.5	Confident	89.8	Confident	84 Å²	84	31.8 Å²	31.8	44%	0.44	17%	0.165	S	C	.	.			trans	-57.1	127.1	175.6	-176.5	65.3	0	0	0	109.3	V273 I367	L271-V273 PolarHBondContact O-N 2.84Å; L271-I367 HydrophobicContact CB-CG2 4.4Å; L271-I367 WeakPolarHBondContact CB-O 3.26Å; L271-I367 HydrophobicContact CD2-CB 4.41Å; L271-I367 HydrophobicContact CD2-CG2 4.09Å; L271-I367 PolarHBondContact N-O 3.18Å; L271-I367 VanDerWaalsContact N-O 3.13Å
272	Q	72	Confident	90	Very high	157 Å²	157	31.8 Å²	31.8	73%	0.734	17%	0.165	S	C	*	.			trans	-70.4	91.2	-171	-69.1	-177.5	-46.3	0	0	111.4	L270	L270-Q272 PolarHBondContact O-N 3.25Å
273	V	75.8	Confident	90.2	Very high	50 Å²	50	31.5 Å²	31.5	30%	0.303	16%	0.163	S	C	.	.			trans	-106.3	147.9	173.8	-179.7	0	0	0	0	109.1	L271 D277 T352	L271-V273 PolarHBondContact O-N 2.84Å; V273-D277 HydrophobicContact CG1-CB 3.66Å; V273-T352 HydrophobicContact CG1-CG2 3.78Å
274	T	87.3	Confident	90.3	Very high	75 Å²	75	33.7 Å²	33.7	46%	0.46	17%	0.169	S	C	.	.			trans	-73.2	150.8	-175.1	78	0	0	0	0	111.9	L276 D277 H278	T274-L276 PolarHBondContact O-N 3.35Å; T274-L276 PolarHBondContact OG1-N 3.29Å; T274-D277 PolarHBondContact O-N 3.25Å; T274-D277 VanDerWaalsContact O-N 3.12Å; T274-D277 VanDerWaalsContact OG1-CG 3.29Å; T274-D277 PolarHBondContact OG1-N 3.34Å; T274-D277 PolarHBondContact OG1-OD2 2.88Å; T274-H278 PolarHBondContact O-CD2 2.77Å; T274-H278 PolarHBondContact O-N 2.92Å
275	E	88.4	Confident	90.4	Very high	54 Å²	54	33.7 Å²	33.7	25%	0.252	17%	0.169	S	C	.	.	H	α-helix	trans	-54	-38.6	172	-174.3	-174.2	165.8	0	0	111	S28 S89 V116 D277 H278 V279	S28-E275 WeakPolarHBondContact CB-OE2 3.33Å; S28-E275 PolarHBondContact OG-OE1 3.05Å; S28-E275 VanDerWaalsContact OG-OE1 3.09Å; S28-E275 PolarHBondContact OG-OE2 3.2Å; S89-E275 WeakPolarHBondContact CB-OE1 3.36Å; S89-E275 PolarHBondContact OG-OE1 2.83Å; V116-E275 HydrophobicContact CG1-CG 3.75Å; E275-D277 VanDerWaalsContact C-N 3.28Å; E275-D277 PolarHBondContact O-N 3.34Å; E275-H278 PolarHBondContact O-N 2.75Å; E275-V279 HydrophobicContact CG-CG2 4.34Å; E275-V279 WeakPolarHBondContact O-CG2 3.36Å; E275-V279 PolarHBondContact O-N 3.34Å
276	L	92.1	Very high	90.4	Very high	58 Å²	58	33.7 Å²	33.7	30%	0.304	17%	0.169	S	C	.	.	H	α-helix	trans	-59.9	-35.8	-179.9	-179.3	61.7	0	0	0	113	S35 M39 T274 V279 A280	S35-L276 VanDerWaalsContact CB-CD1 3.45Å; M39-L276 HydrophobicContact CE-CD1 3.64Å; M39-L276 HydrophobicContact SD-CD1 4.36Å; T274-L276 PolarHBondContact O-N 3.35Å; T274-L276 PolarHBondContact OG1-N 3.29Å; L276-V279 PolarHBondContact O-N 3.12Å; L276-A280 WeakPolarHBondContact O-CB 3.1Å; L276-A280 PolarHBondContact O-N 2.03Å
277	D	92.1	Very high	90.3	Very high	39 Å²	39	33.9 Å²	33.9	21%	0.209	17%	0.17	C	C	.	.	H	α-helix	trans	-72.4	-38.8	177.4	-64.1	-51.7	0	0	0	111.7	V273 T274 E275 V279 A280 D281 R351 T352	V273-D277 HydrophobicContact CG1-CB 3.66Å; T274-D277 PolarHBondContact O-N 3.25Å; T274-D277 VanDerWaalsContact O-N 3.12Å; T274-D277 VanDerWaalsContact OG1-CG 3.29Å; T274-D277 PolarHBondContact OG1-N 3.34Å; T274-D277 PolarHBondContact OG1-OD2 2.88Å; E275-D277 VanDerWaalsContact C-N 3.28Å; E275-D277 PolarHBondContact O-N 3.34Å; D277-V279 VanDerWaalsContact C-N 3.34Å; D277-A280 WeakPolarHBondContact O-CB 3.46Å; D277-A280 PolarHBondContact O-N 2.81Å; D277-D281 PolarHBondContact O-N 3.45Å; D277-R351 HydrophobicContact CB-CB 3.91Å; D277-R351 VanDerWaalsContact OD1-CD 3.29Å; D277-R351 WeakPolarHBondContact OD1-CD 3.39Å; D277-R351 IonicContact OD1-NH1 3.98Å; D277-T352 HydrophobicContact CB-CG2 4.07Å
278	H	92.4	Very high	90.1	Very high	13 Å²	13	36.9 Å²	36.9	6%	0.06	18%	0.184	C	C	.	.	H	α-helix	trans	-64.1	-37.3	170.8	-74.7	-80.1	0	0	0	112.1	V116 T135 V136 T274 E275 A282 T352	V116-H278 HydrophobicContact CG1-CB 3.48Å; V116-H278 VanDerWaalsContact CG1-CB 3.48Å; T135-H278 PolarHBondContact O-CE1 2.82Å; T135-H278 PolarHBondContact O-ND1 3.28Å; T135-H278 PolarHBondContact OG1-ND1 3.5Å; V136-H278 VanDerWaalsContact CG1-CE1 3.46Å; V136-H278 WeakPolarHBondContact CG1-CE1 3.32Å; T274-H278 PolarHBondContact O-CD2 2.77Å; T274-H278 PolarHBondContact O-N 2.92Å; E275-H278 PolarHBondContact O-N 2.75Å; H278-A282 VanDerWaalsContact O-CB 3.28Å; H278-A282 WeakPolarHBondContact O-CB 3.16Å; H278-A282 PolarHBondContact O-N 2.86Å; H278-T352 HydrophobicContact CB-CG2 4.24Å; H278-T352 WeakPolarHBondContact ND1-CG2 3.46Å
279	V	93.8	Very high	90.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-39.9	172.3	176.7	0	0	0	0	111.2	L27 V32 F36 M39 V116 E275 L276 D277 A282 V283	L27-V279 HydrophobicContact CD1-CG1 4.45Å; L27-V279 HydrophobicContact CD1-CG2 4.4Å; L27-V279 HydrophobicContact CD2-CG2 3.91Å; V32-V279 HydrophobicContact CG1-CG2 4.1Å; F36-V279 HydrophobicContact CB-CG1 4.07Å; F36-V279 HydrophobicContact CD2-CG1 4.06Å; M39-V279 HydrophobicContact CE-CB 4.23Å; M39-V279 HydrophobicContact CE-CG1 3.69Å; V116-V279 HydrophobicContact CG1-CG2 3.79Å; V116-V279 HydrophobicContact CG2-CG2 4.11Å; E275-V279 HydrophobicContact CG-CG2 4.34Å; E275-V279 WeakPolarHBondContact O-CG2 3.36Å; E275-V279 PolarHBondContact O-N 3.34Å; L276-V279 PolarHBondContact O-N 3.12Å; D277-V279 VanDerWaalsContact C-N 3.34Å; V279-A282 PolarHBondContact O-N 3.45Å; V279-V283 HydrophobicContact CG1-CG2 4.43Å; V279-V283 WeakPolarHBondContact O-CG2 3.41Å; V279-V283 PolarHBondContact O-N 3.43Å
280	A	93.3	Very high	90	Very high	13 Å²	13	34.5 Å²	34.5	11%	0.107	18%	0.175	C	C	.	.	H	α-helix	trans	-62.1	-46.4	177.3	0	0	0	0	0	111.8	M39 L276 D277 V283 R284	M39-A280 HydrophobicContact CE-CB 4.29Å; M39-A280 HydrophobicContact SD-CB 3.55Å; M39-A280 VanDerWaalsContact SD-CB 3.55Å; L276-A280 WeakPolarHBondContact O-CB 3.1Å; L276-A280 PolarHBondContact O-N 2.03Å; D277-A280 WeakPolarHBondContact O-CB 3.46Å; D277-A280 PolarHBondContact O-N 2.81Å; A280-V283 PolarHBondContact O-N 2.94Å; A280-R284 PolarHBondContact O-N 2.89Å
281	D	93.1	Very high	89.9	Confident	5 Å²	5	33.9 Å²	33.9	3%	0.027	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-40.1	175.7	-74.8	-12.9	0	0	0	111.4	D277 R284 I285 R351 T352 L355	D277-D281 PolarHBondContact O-N 3.45Å; D281-R284 WeakPolarHBondContact O-CB 3.32Å; D281-R284 PolarHBondContact O-N 2.99Å; D281-I285 WeakPolarHBondContact O-CG1 3.42Å; D281-I285 PolarHBondContact O-N 2.92Å; D281-R351 PolarHBondContact OD1-N 2.92Å; D281-R351 PolarHBondContact OD2-N 3.01Å; D281-T352 VanDerWaalsContact OD2-CB 3.3Å; D281-T352 WeakPolarHBondContact OD2-CB 3.46Å; D281-T352 VanDerWaalsContact OD2-CG2 3.24Å; D281-T352 WeakPolarHBondContact OD2-CG2 3.19Å; D281-T352 PolarHBondContact OD2-N 3.33Å; D281-T352 PolarHBondContact OD2-OG1 2.97Å; D281-L355 HydrophobicContact CB-CD2 3.82Å
282	A	94.3	Very high	90.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-41.2	174.6	0	0	0	0	0	113.2	I87 I114 V116 T135 H278 V279 R284 I285 A286	I87-A282 HydrophobicContact CD1-CB 3.88Å; I87-A282 HydrophobicContact CG1-CB 4.29Å; I87-A282 HydrophobicContact CG2-CB 4.16Å; I114-A282 HydrophobicContact CB-CB 4.32Å; I114-A282 HydrophobicContact CD1-CB 4.43Å; I114-A282 HydrophobicContact CG2-CB 3.62Å; V116-A282 HydrophobicContact CG2-CB 4.49Å; T135-A282 HydrophobicContact CG2-CB 4.34Å; H278-A282 VanDerWaalsContact O-CB 3.28Å; H278-A282 WeakPolarHBondContact O-CB 3.16Å; H278-A282 PolarHBondContact O-N 2.86Å; V279-A282 PolarHBondContact O-N 3.45Å; A282-R284 VanDerWaalsContact C-N 3.34Å; A282-I285 PolarHBondContact O-N 3.03Å; A282-A286 WeakPolarHBondContact O-CB 3.21Å; A282-A286 PolarHBondContact O-N 2.92Å
283	V	94	Very high	90.8	Very high	6 Å²	6	27 Å²	27	4%	0.036	14%	0.137	C	C	.	.	H	α-helix	trans	-63.1	-40.8	173.1	169.5	0	0	0	0	110.9	F36 V40 V43 I87 V279 A280 A286 T287	F36-V283 HydrophobicContact CD2-CG2 3.61Å; F36-V283 HydrophobicContact CE2-CG2 3.72Å; V40-V283 HydrophobicContact CG2-CG1 3.93Å; V40-V283 HydrophobicContact CG2-CG2 3.99Å; V43-V283 HydrophobicContact CG2-CG1 4.46Å; I87-V283 HydrophobicContact CD1-CG2 3.63Å; V279-V283 HydrophobicContact CG1-CG2 4.43Å; V279-V283 WeakPolarHBondContact O-CG2 3.41Å; V279-V283 PolarHBondContact O-N 3.43Å; A280-V283 PolarHBondContact O-N 2.94Å; V283-A286 PolarHBondContact O-N 2.79Å; V283-T287 HydrophobicContact CG1-CG2 4.31Å; V283-T287 WeakPolarHBondContact O-CB 3.39Å; V283-T287 WeakPolarHBondContact O-CG2 3.37Å; V283-T287 PolarHBondContact O-N 3.04Å; V283-T287 PolarHBondContact O-OG1 3.4Å
284	R	92.6	Very high	91.4	Very high	77 Å²	77	25 Å²	25	29%	0.291	13%	0.126	S	C	.	.	H	α-helix	trans	-63.1	-45.3	177.1	-177	172.3	171.9	161.1	-4.7	111.8	A280 D281 A282 T287 Q288 F347 D349	A280-R284 PolarHBondContact O-N 2.89Å; D281-R284 WeakPolarHBondContact O-CB 3.32Å; D281-R284 PolarHBondContact O-N 2.99Å; A282-R284 VanDerWaalsContact C-N 3.34Å; R284-T287 PolarHBondContact O-OG1 3.34Å; R284-Q288 WeakPolarHBondContact O-CB 3.31Å; R284-Q288 VanDerWaalsContact O-CG 3.32Å; R284-Q288 WeakPolarHBondContact O-CG 3.46Å; R284-Q288 PolarHBondContact O-N 3.47Å; R284-F347 HydrophobicContact CG-CE2 4.36Å; R284-F347 HydrophobicContact CG-CZ 4.22Å; R284-D349 IonicContact CZ-OD1 2.62Å; R284-D349 IonicContact CZ-OD2 2.62Å; R284-D349 VanDerWaalsContact CZ-OD2 3.22Å; R284-D349 IonicContact NH1-OD1 2.79Å; R284-D349 IonicContact NH1-OD2 3.49Å; R284-D349 PolarHBondContact NH1-OD2 3.1Å; R284-D349 IonicContact NH2-OD1 2.85Å; R284-D349 PolarHBondContact NH2-OD1 3.46Å; R284-D349 IonicContact NH2-OD2 2.8Å; R284-D349 PolarHBondContact NH2-OD2 3.33Å
285	I	93.7	Very high	91.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-57.4	-56.5	173.5	-66.9	156.4	0	0	0	110.3	I114 T135 D281 A282 T287 Q288 S289 M342 F347 L355 F357	I114-I285 HydrophobicContact CD1-CB 4.31Å; I114-I285 HydrophobicContact CD1-CG2 4.12Å; T135-I285 HydrophobicContact CG2-CD1 4.06Å; D281-I285 WeakPolarHBondContact O-CG1 3.42Å; D281-I285 PolarHBondContact O-N 2.92Å; A282-I285 PolarHBondContact O-N 3.03Å; I285-T287 PolarHBondContact O-N 3.02Å; I285-Q288 PolarHBondContact O-N 3Å; I285-S289 PolarHBondContact O-N 3.08Å; I285-S289 PolarHBondContact O-OG 2.98Å; I285-M342 HydrophobicContact CG2-CB 4.03Å; I285-M342 HydrophobicContact CG2-CG 3.96Å; I285-F347 HydrophobicContact CG1-CD2 4.47Å; I285-F347 HydrophobicContact CG1-CE2 3.89Å; I285-L355 HydrophobicContact CD1-CD2 3.68Å; I285-L355 HydrophobicContact CD1-CG 4.46Å; I285-L355 HydrophobicContact CG1-CD2 4.24Å; I285-F357 HydrophobicContact CD1-CE2 3.74Å; I285-F357 HydrophobicContact CD1-CZ 3.53Å; I285-F357 HydrophobicContact CG1-CE2 4.35Å
286	A	93.7	Very high	91.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.9	-44.6	-174.1	0	0	0	0	0	112.4	I23 A85 I114 A282 V283 I290 M342	I23-A286 HydrophobicContact CD1-CB 4Å; A85-A286 HydrophobicContact CB-CB 3.97Å; I114-A286 HydrophobicContact CD1-CB 4.11Å; A282-A286 WeakPolarHBondContact O-CB 3.21Å; A282-A286 PolarHBondContact O-N 2.92Å; V283-A286 PolarHBondContact O-N 2.79Å; A286-I290 WeakPolarHBondContact O-CB 3.48Å; A286-I290 WeakPolarHBondContact O-CD1 3.37Å; A286-I290 WeakPolarHBondContact O-CG1 3.39Å; A286-I290 PolarHBondContact O-N 2.77Å; A286-I290 VanDerWaalsContact O-N 3.11Å; A286-M342 HydrophobicContact CB-CE 4.47Å
287	T	91.9	Very high	90.9	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-68.4	-41.2	179.1	51.4	0	0	0	0	112.6	I23 V43 F54 V283 R284 I285 I290 L291	I23-T287 HydrophobicContact CD1-CG2 3.5Å; I23-T287 VanDerWaalsContact CD1-CG2 3.5Å; V43-T287 HydrophobicContact CG1-CG2 4.26Å; V43-T287 HydrophobicContact CG2-CG2 4.2Å; F54-T287 HydrophobicContact CD1-CG2 4.05Å; F54-T287 HydrophobicContact CD2-CG2 4.22Å; F54-T287 HydrophobicContact CE1-CG2 3.99Å; F54-T287 HydrophobicContact CE2-CG2 4.17Å; F54-T287 HydrophobicContact CG-CG2 4.16Å; F54-T287 HydrophobicContact CZ-CG2 4.05Å; V283-T287 HydrophobicContact CG1-CG2 4.31Å; V283-T287 WeakPolarHBondContact O-CB 3.39Å; V283-T287 WeakPolarHBondContact O-CG2 3.37Å; V283-T287 PolarHBondContact O-N 3.04Å; V283-T287 PolarHBondContact O-OG1 3.4Å; R284-T287 PolarHBondContact O-OG1 3.34Å; I285-T287 PolarHBondContact O-N 3.02Å; T287-I290 PolarHBondContact O-N 3.34Å; T287-L291 WeakPolarHBondContact O-CB 3.46Å; T287-L291 VanDerWaalsContact O-CG 3.26Å; T287-L291 WeakPolarHBondContact O-CG 3.43Å; T287-L291 PolarHBondContact O-N 3.09Å
288	Q	90.5	Very high	90.5	Very high	63 Å²	63	32.4 Å²	32.4	29%	0.294	15%	0.15	S	C	.	.	H	α-helix	trans	-69	-40.3	178.6	-70.1	-163.8	19.9	0	0	113	R284 I285 L291 H292 M345 F347	R284-Q288 WeakPolarHBondContact O-CB 3.31Å; R284-Q288 VanDerWaalsContact O-CG 3.32Å; R284-Q288 WeakPolarHBondContact O-CG 3.46Å; R284-Q288 PolarHBondContact O-N 3.47Å; I285-Q288 PolarHBondContact O-N 3Å; Q288-L291 PolarHBondContact O-N 3.41Å; Q288-H292 WeakPolarHBondContact O-CB 3.47Å; Q288-H292 PolarHBondContact O-N 2.88Å; Q288-M345 HydrophobicContact CB-CE 4.17Å; Q288-M345 HydrophobicContact CB-SD 4.27Å; Q288-F347 VanDerWaalsContact OE1-CZ 3.29Å
289	S	91.4	Very high	90	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.9	-38.1	175.2	-55.8	0	0	0	0	112	I285 H292 L293 D341 M342 M345	I285-S289 PolarHBondContact O-N 3.08Å; I285-S289 PolarHBondContact O-OG 2.98Å; S289-H292 PolarHBondContact O-N 3.42Å; S289-L293 PolarHBondContact O-N 2.8Å; S289-D341 PolarHBondContact OG-O 2.84Å; S289-D341 VanDerWaalsContact OG-O 3.1Å; S289-M342 WeakPolarHBondContact OG-CA 3.47Å; S289-M342 VanDerWaalsContact OG-CG 3.28Å; S289-M342 WeakPolarHBondContact OG-CG 3.08Å; S289-M342 PolarHBondContact OG-N 2.9Å; S289-M345 WeakPolarHBondContact OG-CE 3.34Å
290	I	90.6	Very high	89.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64	-45.6	173.1	-67.9	165.5	0	0	0	110.7	F21 I23 F54 F84 A286 T287 H292 L293 V294 M301 L338	F21-I290 HydrophobicContact CB-CG2 4.34Å; F21-I290 HydrophobicContact CD1-CG2 4.24Å; F21-I290 HydrophobicContact CD2-CG2 3.88Å; F21-I290 HydrophobicContact CE2-CG2 4.25Å; F21-I290 HydrophobicContact CG-CG2 3.89Å; I23-I290 HydrophobicContact CG1-CD1 4.41Å; F54-I290 HydrophobicContact CE1-CB 4.16Å; F54-I290 HydrophobicContact CE1-CD1 4.08Å; F54-I290 HydrophobicContact CE1-CG2 3.87Å; F54-I290 HydrophobicContact CZ-CB 4.4Å; F54-I290 HydrophobicContact CZ-CG2 4.15Å; F84-I290 HydrophobicContact CB-CD1 3.74Å; F84-I290 HydrophobicContact CB-CG1 4.23Å; A286-I290 WeakPolarHBondContact O-CB 3.48Å; A286-I290 WeakPolarHBondContact O-CD1 3.37Å; A286-I290 WeakPolarHBondContact O-CG1 3.39Å; A286-I290 PolarHBondContact O-N 2.77Å; A286-I290 VanDerWaalsContact O-N 3.11Å; T287-I290 PolarHBondContact O-N 3.34Å; I290-H292 VanDerWaalsContact C-N 3.34Å; I290-H292 PolarHBondContact O-N 3.17Å; I290-L293 PolarHBondContact O-N 3.37Å; I290-V294 HydrophobicContact CG2-CG2 4.28Å; I290-V294 WeakPolarHBondContact O-CB 3.23Å; I290-V294 VanDerWaalsContact O-CG2 3.23Å; I290-V294 WeakPolarHBondContact O-CG2 3.28Å; I290-V294 PolarHBondContact O-N 3.34Å; I290-M301 HydrophobicContact CG2-CE 4.05Å; I290-L338 HydrophobicContact CG1-CD1 3.98Å; I290-L338 HydrophobicContact CG1-CD2 4.42Å
291	L	89.2	Confident	89.1	Confident	13 Å²	13	34.7 Å²	34.7	7%	0.068	16%	0.161	C	C	.	.	H	α-helix	trans	-64.9	-35.7	178	-72.5	170	0	0	0	112.9	F47 V52 F54 T287 Q288 R295	F47-L291 HydrophobicContact CD1-CD1 4.32Å; F47-L291 HydrophobicContact CD2-CD1 3.77Å; F47-L291 HydrophobicContact CE1-CD1 3.96Å; F47-L291 HydrophobicContact CE2-CD1 3.34Å; F47-L291 HydrophobicContact CG-CD1 4.25Å; F47-L291 HydrophobicContact CZ-CD1 3.45Å; F47-L291 VanDerWaalsContact CZ-CD1 3.45Å; V52-L291 HydrophobicContact CB-CD2 4.33Å; V52-L291 HydrophobicContact CG1-CD2 4.03Å; V52-L291 HydrophobicContact CG2-CD2 4.46Å; F54-L291 HydrophobicContact CE2-CD1 4.34Å; F54-L291 HydrophobicContact CE2-CD2 4.21Å; F54-L291 HydrophobicContact CE2-CG 4.2Å; F54-L291 HydrophobicContact CZ-CD2 4.21Å; F54-L291 HydrophobicContact CZ-CG 3.99Å; T287-L291 WeakPolarHBondContact O-CB 3.46Å; T287-L291 VanDerWaalsContact O-CG 3.26Å; T287-L291 WeakPolarHBondContact O-CG 3.43Å; T287-L291 PolarHBondContact O-N 3.09Å; Q288-L291 PolarHBondContact O-N 3.41Å; L291-R295 VanDerWaalsContact O-CG 3.27Å; L291-R295 WeakPolarHBondContact O-CG 3.37Å; L291-R295 PolarHBondContact O-N 3.08Å
292	H	89.5	Confident	88.5	Confident	88 Å²	88	37.3 Å²	37.3	41%	0.407	17%	0.172	S	C	.	.	H	α-helix	trans	-59.7	-54	172.5	-178.1	-102.8	0	0	0	110.3	Q288 S289 I290 V294 R295 T296 D341	Q288-H292 WeakPolarHBondContact O-CB 3.47Å; Q288-H292 PolarHBondContact O-N 2.88Å; S289-H292 PolarHBondContact O-N 3.42Å; I290-H292 VanDerWaalsContact C-N 3.34Å; I290-H292 PolarHBondContact O-N 3.17Å; H292-V294 VanDerWaalsContact C-N 3.32Å; H292-V294 PolarHBondContact O-N 2.94Å; H292-R295 WeakPolarHBondContact O-CB 3.37Å; H292-R295 PolarHBondContact O-N 2.83Å; H292-T296 PolarHBondContact O-N 2.79Å; H292-T296 PolarHBondContact O-OG1 2.96Å; H292-T296 VanDerWaalsContact O-OG1 3.1Å; H292-D341 IonicContact CE1-OD1 2.76Å; H292-D341 IonicContact CE1-OD2 3.78Å; H292-D341 IonicContact CG-OD2 3.58Å; H292-D341 IonicContact ND1-OD1 3.74Å; H292-D341 IonicContact ND1-OD2 3.22Å; H292-D341 PolarHBondContact ND1-OD2 2.84Å
293	L	88	Confident	87.9	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.037	18%	0.183	C	C	.	.	H	α-helix	trans	-63.3	-34.6	-179.4	-169.1	59.5	0	0	0	113.1	S289 I290 T296 D297 M301 Y334 K337 L338	S289-L293 PolarHBondContact O-N 2.8Å; I290-L293 PolarHBondContact O-N 3.37Å; L293-T296 PolarHBondContact O-N 2.83Å; L293-D297 PolarHBondContact O-N 3.16Å; L293-M301 HydrophobicContact CB-CE 4.39Å; L293-M301 HydrophobicContact CB-SD 4.46Å; L293-M301 HydrophobicContact CD2-CE 4.09Å; L293-M301 HydrophobicContact CD2-SD 3.62Å; L293-M301 HydrophobicContact CG-CE 4.31Å; L293-M301 HydrophobicContact CG-CG 4.09Å; L293-M301 HydrophobicContact CG-SD 3.78Å; L293-Y334 HydrophobicContact CD1-CD1 4.4Å; L293-Y334 HydrophobicContact CD2-CD1 4.41Å; L293-K337 HydrophobicContact CD1-CB 4.3Å; L293-L338 HydrophobicContact CD2-CB 3.97Å; L293-L338 HydrophobicContact CD2-CD1 4.24Å
294	V	87.8	Confident	87.4	Confident	9 Å²	9	39.6 Å²	39.6	6%	0.055	18%	0.182	C	C	.	.	H	α-helix	trans	-65.7	-35.5	172.8	171.1	0	0	0	0	112.2	L19 F21 V52 I290 H292 Y298 M301	L19-V294 HydrophobicContact CD1-CG1 4.31Å; F21-V294 HydrophobicContact CE1-CG2 4.49Å; F21-V294 HydrophobicContact CE2-CG2 3.62Å; F21-V294 HydrophobicContact CZ-CG2 3.53Å; V52-V294 HydrophobicContact CG2-CG1 4.03Å; I290-V294 HydrophobicContact CG2-CG2 4.28Å; I290-V294 WeakPolarHBondContact O-CB 3.23Å; I290-V294 VanDerWaalsContact O-CG2 3.23Å; I290-V294 WeakPolarHBondContact O-CG2 3.28Å; I290-V294 PolarHBondContact O-N 3.34Å; H292-V294 VanDerWaalsContact C-N 3.32Å; H292-V294 PolarHBondContact O-N 2.94Å; V294-Y298 HydrophobicContact CG1-CD2 4.02Å; V294-Y298 VanDerWaalsContact O-CA 3.26Å; V294-Y298 WeakPolarHBondContact O-CA 3.44Å; V294-Y298 WeakPolarHBondContact O-CB 3.12Å; V294-Y298 PolarHBondContact O-N 3.01Å; V294-M301 HydrophobicContact CG2-CB 3.83Å; V294-M301 HydrophobicContact CG2-CE 3.86Å; V294-M301 HydrophobicContact CG2-CG 3.93Å
295	R	86.2	Confident	86.9	Confident	171 Å²	171	38.8 Å²	38.8	65%	0.645	18%	0.181	S	C	*	.	H	α-helix	trans	-72	-34.9	174.5	-71.4	166.9	-177.6	157.9	3.8	112.1	L291 H292	L291-R295 VanDerWaalsContact O-CG 3.27Å; L291-R295 WeakPolarHBondContact O-CG 3.37Å; L291-R295 PolarHBondContact O-N 3.08Å; H292-R295 WeakPolarHBondContact O-CB 3.37Å; H292-R295 PolarHBondContact O-N 2.83Å
296	T	86.5	Confident	86.3	Confident	98 Å²	98	38.9 Å²	38.9	60%	0.601	18%	0.182	S	C	*	.	H	α-helix	trans	-76.1	-40.7	179.6	-49.4	0	0	0	0	113	H292 L293	H292-T296 PolarHBondContact O-N 2.79Å; H292-T296 PolarHBondContact O-OG1 2.96Å; H292-T296 VanDerWaalsContact O-OG1 3.1Å; L293-T296 PolarHBondContact O-N 2.83Å
297	D	85.1	Confident	85.9	Confident	32 Å²	32	38.9 Å²	38.9	17%	0.171	18%	0.182	C	C	.	.			trans	-145.5	68.4	-176	-162.9	-7.7	0	0	0	111.9	L293 D299 A300 M301 Y334	L293-D297 PolarHBondContact O-N 3.16Å; D297-D299 VanDerWaalsContact C-N 3.32Å; D297-D299 PolarHBondContact O-N 3.31Å; D297-A300 HydrophobicContact CB-CB 4.15Å; D297-A300 PolarHBondContact O-N 2.91Å; D297-A300 WeakPolarHBondContact OD1-CB 3.41Å; D297-A300 PolarHBondContact OD1-N 3.4Å; D297-A300 WeakPolarHBondContact OD2-CB 3.29Å; D297-M301 PolarHBondContact O-N 3.29Å; D297-M301 VanDerWaalsContact O-N 3.07Å; D297-Y334 HydrophobicContact CB-CE1 4.27Å; D297-Y334 WeakPolarHBondContact OD2-CE1 3.45Å; D297-Y334 PolarHBondContact OD2-OH 2.78Å
298	Y	83.7	Confident	85.5	Confident	80 Å²	80	43.1 Å²	43.1	31%	0.314	20%	0.2	S	C	.	.	H	α-helix	trans	-53.6	-44.5	-178.8	180	-90.2	0	0	0	113.1	L19 V294 A300 M301 K302	L19-Y298 HydrophobicContact CD1-CD2 4Å; L19-Y298 HydrophobicContact CD1-CE2 3.46Å; L19-Y298 VanDerWaalsContact CD1-CE2 3.46Å; L19-Y298 HydrophobicContact CG-CE2 4.35Å; V294-Y298 HydrophobicContact CG1-CD2 4.02Å; V294-Y298 VanDerWaalsContact O-CA 3.26Å; V294-Y298 WeakPolarHBondContact O-CA 3.44Å; V294-Y298 WeakPolarHBondContact O-CB 3.12Å; V294-Y298 PolarHBondContact O-N 3.01Å; Y298-A300 PolarHBondContact O-N 3.19Å; Y298-M301 PolarHBondContact O-N 2.84Å; Y298-K302 HydrophobicContact CE1-CD 3.89Å; Y298-K302 VanDerWaalsContact O-CB 3.3Å; Y298-K302 WeakPolarHBondContact O-CB 3.28Å; Y298-K302 PolarHBondContact O-N 2.64Å
299	D	81	Confident	85.2	Confident	75 Å²	75	41 Å²	41	40%	0.401	19%	0.194	S	C	.	.	H	α-helix	trans	-64.6	-38.9	-178.7	-80.2	-19.7	0	0	0	112.2	D297 H303	D297-D299 VanDerWaalsContact C-N 3.32Å; D297-D299 PolarHBondContact O-N 3.31Å; D299-H303 PolarHBondContact O-CD2 3.43Å; D299-H303 PolarHBondContact O-N 3Å
300	A	82.9	Confident	84.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-54.3	173.7	0	0	0	0	0	111	D297 Y298 K302 H303 L304 Y329 Y334	D297-A300 HydrophobicContact CB-CB 4.15Å; D297-A300 PolarHBondContact O-N 2.91Å; D297-A300 WeakPolarHBondContact OD1-CB 3.41Å; D297-A300 PolarHBondContact OD1-N 3.4Å; D297-A300 WeakPolarHBondContact OD2-CB 3.29Å; Y298-A300 PolarHBondContact O-N 3.19Å; A300-K302 PolarHBondContact O-N 3.5Å; A300-K302 VanDerWaalsContact O-N 3.15Å; A300-H303 CarbonylContact O-C 3.57Å; A300-H303 PolarHBondContact O-N 2.96Å; A300-L304 VanDerWaalsContact O-CB 3.22Å; A300-L304 WeakPolarHBondContact O-CB 3.34Å; A300-L304 PolarHBondContact O-N 3.06Å; A300-Y329 HydrophobicContact CB-CD1 3.78Å; A300-Y329 HydrophobicContact CB-CD2 4.07Å; A300-Y329 HydrophobicContact CB-CE1 3.66Å; A300-Y329 HydrophobicContact CB-CE2 4.03Å; A300-Y329 HydrophobicContact CB-CG 3.96Å; A300-Y334 HydrophobicContact CB-CD1 4.19Å; A300-Y334 HydrophobicContact CB-CE1 3.34Å; A300-Y334 HydrophobicContact CB-CE2 4.28Å; A300-Y334 WeakPolarHBondContact CB-OH 3.47Å
301	M	84.3	Confident	84.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.4	-29	-176.9	-71	-64.1	-79.7	0	0	113.4	F21 F84 I290 L293 V294 D297 Y298 L304	F21-M301 HydrophobicContact CD1-CE 4.45Å; F21-M301 HydrophobicContact CE1-CB 4.44Å; F21-M301 HydrophobicContact CE1-CE 3.82Å; F21-M301 HydrophobicContact CZ-CB 4.17Å; F21-M301 HydrophobicContact CZ-CE 4.16Å; F84-M301 HydrophobicContact CD1-CE 4.06Å; F84-M301 HydrophobicContact CE1-CE 3.84Å; F84-M301 HydrophobicContact CE1-SD 4.16Å; I290-M301 HydrophobicContact CG2-CE 4.05Å; L293-M301 HydrophobicContact CB-CE 4.39Å; L293-M301 HydrophobicContact CB-SD 4.46Å; L293-M301 HydrophobicContact CD2-CE 4.09Å; L293-M301 HydrophobicContact CD2-SD 3.62Å; L293-M301 HydrophobicContact CG-CE 4.31Å; L293-M301 HydrophobicContact CG-CG 4.09Å; L293-M301 HydrophobicContact CG-SD 3.78Å; V294-M301 HydrophobicContact CG2-CB 3.83Å; V294-M301 HydrophobicContact CG2-CE 3.86Å; V294-M301 HydrophobicContact CG2-CG 3.93Å; D297-M301 PolarHBondContact O-N 3.29Å; D297-M301 VanDerWaalsContact O-N 3.07Å; Y298-M301 PolarHBondContact O-N 2.84Å; M301-L304 HydrophobicContact SD-CD2 4.04Å
302	K	82.1	Confident	84.2	Confident	60 Å²	60	49.6 Å²	49.6	26%	0.261	25%	0.25	S	C	.	.	H	α-helix	trans	-63.7	-42.6	172.5	179.8	165.4	-176.7	174.2	0	113.6	L19 R82 Y298 A300	L19-K302 HydrophobicContact CD2-CB 3.81Å; L19-K302 HydrophobicContact CD2-CD 4.4Å; L19-K302 HydrophobicContact CD2-CG 3.78Å; R82-K302 PolarHBondContact NH2-O 2.76Å; Y298-K302 HydrophobicContact CE1-CD 3.89Å; Y298-K302 VanDerWaalsContact O-CB 3.3Å; Y298-K302 WeakPolarHBondContact O-CB 3.28Å; Y298-K302 PolarHBondContact O-N 2.64Å; A300-K302 PolarHBondContact O-N 3.5Å; A300-K302 VanDerWaalsContact O-N 3.15Å
303	H	81.3	Confident	83.8	Confident	52 Å²	52	49.9 Å²	49.9	24%	0.241	26%	0.255	C	S	.	.	H	α-helix	trans	-98.9	-12.1	-175.1	-69.3	-54	0	0	0	114.6	D299 A300 S319	D299-H303 PolarHBondContact O-CD2 3.43Å; D299-H303 PolarHBondContact O-N 3Å; A300-H303 CarbonylContact O-C 3.57Å; A300-H303 PolarHBondContact O-N 2.96Å; H303-S319 WeakPolarHBondContact O-CB 3.43Å
304	L	83.3	Confident	83.3	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.26	C	S	.	.			trans	-70.3	132.5	177.3	-168.9	61.9	0	0	0	110.8	R82 F84 A300 M301 W331 Y334	R82-L304 PolarHBondContact NH1-O 2.78Å; F84-L304 HydrophobicContact CE1-CD2 4.04Å; F84-L304 HydrophobicContact CE1-CG 4.44Å; A300-L304 VanDerWaalsContact O-CB 3.22Å; A300-L304 WeakPolarHBondContact O-CB 3.34Å; A300-L304 PolarHBondContact O-N 3.06Å; M301-L304 HydrophobicContact SD-CD2 4.04Å; L304-W331 HydrophobicContact CD1-CE3 4.23Å; L304-W331 HydrophobicContact CD2-CE3 4Å; L304-W331 HydrophobicContact CD2-CZ3 4.13Å; L304-W331 HydrophobicContact CG-CE3 4.05Å; L304-W331 HydrophobicContact CG-CZ3 4.46Å; L304-Y334 HydrophobicContact CD2-CD1 4.25Å; L304-Y334 HydrophobicContact CD2-CD2 4.46Å; L304-Y334 HydrophobicContact CD2-CG 3.78Å
305	H	82.6	Confident	82.7	Confident	60 Å²	60	54.5 Å²	54.5	28%	0.278	29%	0.287	S	S	.	.			trans	-120.3	145.8	164.6	-73.7	-96.3	0	0	0	107.4	E80 G81	E80-H305 PolarHBondContact O-ND1 3.37Å; G81-H305 CarbonylContact O-C 3.53Å; G81-H305 VanDerWaalsContact O-CA 3.26Å; G81-H305 WeakPolarHBondContact O-CA 3.37Å; G81-H305 WeakPolarHBondContact O-CB 3.49Å; G81-H305 PolarHBondContact O-ND1 2.98Å
306	S	81.5	Confident	82.2	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.014	29%	0.285	C	S	.	.			trans	-87.4	-145.7	170.4	62.3	0	0	0	0	110	G81 I83	G81-S306 PolarHBondContact O-N 2.77Å; G81-S306 PolarHBondContact O-OG 3.5Å; I83-S306 PolarHBondContact N-OG 3.43Å; I83-S306 WeakPolarHBondContact O-CB 3.32Å; I83-S306 PolarHBondContact O-OG 2.9Å
307	V	84.4	Confident	81.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.261	C	S	.	.			trans	-73.4	127.4	-179.7	-167.9	0	0	0	0	110.4	F76 G81 Y109 A309 I317	F76-V307 HydrophobicContact CB-CG1 4.5Å; F76-V307 HydrophobicContact CD2-CB 3.78Å; F76-V307 HydrophobicContact CD2-CG1 3.49Å; F76-V307 VanDerWaalsContact CD2-CG1 3.49Å; F76-V307 HydrophobicContact CD2-CG2 4.43Å; F76-V307 HydrophobicContact CE2-CB 4.06Å; F76-V307 HydrophobicContact CE2-CG1 3.94Å; F76-V307 HydrophobicContact CE2-CG2 4.21Å; F76-V307 HydrophobicContact CG-CB 4.18Å; F76-V307 HydrophobicContact CG-CG1 4.22Å; G81-V307 VanDerWaalsContact CA-O 3.25Å; G81-V307 WeakPolarHBondContact CA-O 3.38Å; Y109-V307 VanDerWaalsContact CB-CG2 3.42Å; Y109-V307 HydrophobicContact CD1-CG1 4.05Å; Y109-V307 HydrophobicContact CD1-CG2 3.84Å; Y109-V307 HydrophobicContact CD2-CG2 4.34Å; Y109-V307 HydrophobicContact CE1-CG1 4.21Å; Y109-V307 HydrophobicContact CG-CG1 4.31Å; Y109-V307 HydrophobicContact CG-CG2 3.62Å; V307-A309 WeakPolarHBondContact CG1-O 3.14Å; V307-I317 HydrophobicContact CG2-CD1 4.04Å
308	K	83.8	Confident	81.5	Confident	95 Å²	95	52.7 Å²	52.7	41%	0.413	28%	0.279	S	S	.	.	S	Bend	trans	-91.1	-42.9	173.6	-66.5	-172.4	173.1	-166.1	0	111.5	F76 N77 D312	F76-K308 CarbonylContact C-O 3.56Å; N77-K308 VanDerWaalsContact CA-O 3.32Å; N77-K308 WeakPolarHBondContact CA-O 3.35Å; N77-K308 PolarHBondContact N-O 3.36Å; N77-K308 PolarHBondContact OD1-O 3.47Å; N77-K308 VanDerWaalsContact OD1-O 3.11Å; K308-D312 WeakPolarHBondContact CA-OD2 3.47Å; K308-D312 WeakPolarHBondContact CB-OD2 3.49Å; K308-D312 PolarHBondContact N-OD2 3.03Å
309	A	84.3	Confident	80.9	Confident	19 Å²	19	49.1 Å²	49.1	16%	0.157	27%	0.265	C	S	.	.			trans	-141.7	151.4	177.5	0	0	0	0	0	110.3	N77 V307 S311 D312	N77-A309 WeakPolarHBondContact OD1-CA 3.45Å; N77-A309 WeakPolarHBondContact OD1-CB 3.38Å; V307-A309 WeakPolarHBondContact CG1-O 3.14Å; A309-S311 WeakPolarHBondContact CB-OG 3.45Å; A309-S311 PolarHBondContact O-N 3.37Å; A309-D312 PolarHBondContact N-OD2 3.15Å; A309-D312 VanDerWaalsContact O-CB 3.31Å; A309-D312 WeakPolarHBondContact O-CB 3.32Å; A309-D312 PolarHBondContact O-N 2.83Å
310	C	85.6	Confident	80.2	Confident	38 Å²	38	54 Å²	54	26%	0.257	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-5.8	173.2	-69.9	0	0	0	0	113.8	C73 Y109 D312	C73-C310 WeakPolarHBondContact CA-SG 3.38Å; C73-C310 HydrophobicContact CB-CB 3.92Å; C73-C310 WeakPolarHBondContact CB-SG 3.37Å; C73-C310 WeakPolarHBondContact SG-CB 3.34Å; C73-C310 CovalentContact SG-SG 2.04Å; C73-C310 PolarHBondContact SG-SG 2.9Å; Y109-C310 VanDerWaalsContact OH-CA 3.25Å; Y109-C310 WeakPolarHBondContact OH-CA 3.19Å; Y109-C310 WeakPolarHBondContact OH-CB 3.42Å; Y109-C310 PolarHBondContact OH-O 3.38Å; C310-D312 VanDerWaalsContact C-N 3.33Å
311	S	83.3	Confident	79.2	Confident	102 Å²	102	56.9 Å²	56.9	71%	0.713	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-11.2	168.6	53.7	0	0	0	0	114.2	A309	A309-S311 WeakPolarHBondContact CB-OG 3.45Å; A309-S311 PolarHBondContact O-N 3.37Å
312	D	81.3	Confident	77.9	Confident	52 Å²	52	64.9 Å²	64.9	28%	0.278	34%	0.338	S	S	.	.	S	Bend	trans	-74	131.9	-176.6	-60.4	-23.4	0	0	0	110.8	Y109 K308 A309 C310 I317	Y109-D312 WeakPolarHBondContact CE1-O 3.16Å; K308-D312 WeakPolarHBondContact CA-OD2 3.47Å; K308-D312 WeakPolarHBondContact CB-OD2 3.49Å; K308-D312 PolarHBondContact N-OD2 3.03Å; A309-D312 PolarHBondContact N-OD2 3.15Å; A309-D312 VanDerWaalsContact O-CB 3.31Å; A309-D312 WeakPolarHBondContact O-CB 3.32Å; A309-D312 PolarHBondContact O-N 2.83Å; C310-D312 VanDerWaalsContact C-N 3.33Å; D312-I317 HydrophobicContact CB-CD1 4.35Å; D312-I317 HydrophobicContact CB-CG1 4.38Å
313	N	81.8	Confident	76.9	Confident	95 Å²	95	65.4 Å²	65.4	51%	0.508	34%	0.344	S	S	.	.			trans	-68.6	121.9	172.9	-76.6	-37.3	0	0	0	110	S315 E316 I317	N313-S315 PolarHBondContact O-N 3.24Å; N313-S315 VanDerWaalsContact O-N 3.1Å; N313-E316 HydrophobicContact CB-CB 4.08Å; N313-E316 HydrophobicContact CB-CG 3.9Å; N313-E316 WeakPolarHBondContact CB-OE2 3.44Å; N313-E316 PolarHBondContact ND2-OE2 2.86Å; N313-E316 PolarHBondContact O-N 2.9Å; N313-I317 WeakPolarHBondContact O-CG1 3.38Å; N313-I317 PolarHBondContact O-N 2.66Å
314	P	76.8	Confident	75.9	Confident	24 Å²	24	69.4 Å²	69.4	16%	0.156	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.4	-172.6	25	-35.6	0	0	0	113.8	F108 Y109	F108-P314 HydrophobicContact CD1-CG 4.21Å; F108-P314 HydrophobicContact CE1-CG 3.68Å; F108-P314 HydrophobicContact CE2-CG 4.23Å; F108-P314 HydrophobicContact CZ-CG 3.69Å; F108-P314 WeakPolarHBondContact O-CB 3.34Å; Y109-P314 HydrophobicContact CD1-CB 4.16Å
315	S	75	Confident	75	Confident	89 Å²	89	73.7 Å²	73.7	62%	0.622	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-17.7	176.1	-60.2	0	0	0	0	114.2	N313	N313-S315 PolarHBondContact O-N 3.24Å; N313-S315 VanDerWaalsContact O-N 3.1Å
316	E	75.5	Confident	74.3	Confident	129 Å²	129	76.3 Å²	76.3	60%	0.603	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-3.8	-176.2	-60.1	-177.6	147.5	0	0	112.7	N313 Q318	N313-E316 HydrophobicContact CB-CB 4.08Å; N313-E316 HydrophobicContact CB-CG 3.9Å; N313-E316 WeakPolarHBondContact CB-OE2 3.44Å; N313-E316 PolarHBondContact ND2-OE2 2.86Å; N313-E316 PolarHBondContact O-N 2.9Å; E316-Q318 PolarHBondContact O-N 2.93Å
317	I	78.7	Confident	73.8	Confident	18 Å²	18	80.6 Å²	80.6	9%	0.092	46%	0.456	C	S	.	.			trans	-70.1	97.2	177.7	-51.1	-179.3	0	0	0	109.4	Y109 V307 D312 N313 W331	Y109-I317 HydrophobicContact CD1-CD1 4.44Å; V307-I317 HydrophobicContact CG2-CD1 4.04Å; D312-I317 HydrophobicContact CB-CD1 4.35Å; D312-I317 HydrophobicContact CB-CG1 4.38Å; N313-I317 WeakPolarHBondContact O-CG1 3.38Å; N313-I317 PolarHBondContact O-N 2.66Å; I317-W331 HydrophobicContact CB-CB 3.9Å; I317-W331 HydrophobicContact CG2-CB 3.54Å; I317-W331 HydrophobicContact CG2-CG 4.07Å; I317-W331 WeakPolarHBondContact O-CB 3.47Å; I317-W331 PolarHBondContact O-N 3.34Å
318	Q	77.8	Confident	73.4	Confident	115 Å²	115	82.8 Å²	82.8	54%	0.537	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-132.4	149.7	-177.5	68.9	-174.2	-28.1	0	0	111.5	E316 P328 Y329	E316-Q318 PolarHBondContact O-N 2.93Å; Q318-P328 HydrophobicContact CB-CB 4.15Å; Q318-P328 HydrophobicContact CB-CG 4.47Å; Q318-P328 HydrophobicContact CG-CB 4.34Å; Q318-Y329 CarbonylContact C-O 3.54Å; Q318-Y329 WeakPolarHBondContact CA-O 3.35Å
319	S	72.3	Confident	73.3	Confident	5 Å²	5	79.4 Å²	79.4	4%	0.035	46%	0.455	C	S	.	.			trans	-64	149.4	174.6	74.8	0	0	0	0	111.5	H303 S321 P328 Y329	H303-S319 WeakPolarHBondContact O-CB 3.43Å; S319-S321 PolarHBondContact O-N 3.39Å; S319-P328 WeakPolarHBondContact O-CB 3.36Å; S319-Y329 PolarHBondContact N-O 2.74Å; S319-Y329 WeakPolarHBondContact OG-CB 3.43Å; S319-Y329 VanDerWaalsContact OG-CD2 3.31Å; S319-Y329 WeakPolarHBondContact OG-CD2 3.49Å; S319-Y329 PolarHBondContact OG-N 3.46Å
320	K	66	Low	73.3	Confident	177 Å²	177	82 Å²	82	77%	0.77	47%	0.465	S	S	*	.			trans	-71.8	97	168	-71.1	-173.2	176.4	-175.5	0	108.7	K322	K320-K322 PolarHBondContact O-N 2.96Å; K320-K322 VanDerWaalsContact O-N 3.11Å
321	S	61.3	Low	73.4	Confident	62 Å²	62	80.3 Å²	80.3	43%	0.434	45%	0.453	S	S	.	.			trans	-56.4	117.2	174.2	-176.2	0	0	0	0	110.1	S319 L323 R326	S319-S321 PolarHBondContact O-N 3.39Å; S321-L323 PolarHBondContact OG-O 2.85Å; S321-R326 PolarHBondContact OG-O 3.46Å; S321-R326 VanDerWaalsContact OG-O 3.11Å
322	K	56.6	Low	73.6	Confident	167 Å²	167	79.8 Å²	79.8	73%	0.726	44%	0.438	S	S	*	.			trans	-102.5	-7.9	172.6	-82.6	-170.8	172.2	-174	0	112.8	K320	K320-K322 PolarHBondContact O-N 2.96Å; K320-K322 VanDerWaalsContact O-N 3.11Å
323	L	62.8	Low	73.9	Confident	72 Å²	72	81 Å²	81	38%	0.377	45%	0.445	S	S	.	.	S	Bend	trans	-104.7	112	-173.7	-73.4	76	0	0	0	108.7	S321 G325 R326	S321-L323 PolarHBondContact OG-O 2.85Å; L323-G325 PolarHBondContact O-N 3.5Å; L323-R326 HydrophobicContact CB-CB 4.31Å; L323-R326 PolarHBondContact O-N 3.27Å
324	P	59.8	Low	74.2	Confident	135 Å²	135	77.3 Å²	77.3	88%	0.877	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	125.6	178.7	25.1	-32.8	0	0	0	110
325	G	64.5	Low	74.9	Confident	92 Å²	92	76.2 Å²	76.2	95%	0.948	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.3	-3.2	179.6	0	0	0	0	0	116.3	L323	L323-G325 PolarHBondContact O-N 3.5Å
326	R	67.5	Low	75.6	Confident	115 Å²	115	74.5 Å²	74.5	43%	0.434	40%	0.402	S	S	.	.			trans	-107	134	174.5	-157	170.7	-172.4	172.6	-2.1	111.1	S321 L323 Y329	S321-R326 PolarHBondContact OG-O 3.46Å; S321-R326 VanDerWaalsContact OG-O 3.11Å; L323-R326 HydrophobicContact CB-CB 4.31Å; L323-R326 PolarHBondContact O-N 3.27Å; R326-Y329 PolarHBondContact NE-OH 3.42Å; R326-Y329 PolarHBondContact NH1-OH 2.95Å; R326-Y329 PolarHBondContact NH2-OH 2.94Å
327	S	71.7	Confident	76.3	Confident	92 Å²	92	72.6 Å²	72.6	64%	0.643	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-59.6	147.7	172.5	46.2	0	0	0	0	110.8
328	P	75.5	Confident	77	Confident	46 Å²	46	71.8 Å²	71.8	30%	0.299	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-67.7	143.7	175.3	30.2	-34.2	0	0	0	110.3	Q318 S319 M330	Q318-P328 HydrophobicContact CB-CB 4.15Å; Q318-P328 HydrophobicContact CB-CG 4.47Å; Q318-P328 HydrophobicContact CG-CB 4.34Å; S319-P328 WeakPolarHBondContact O-CB 3.36Å; P328-M330 PolarHBondContact O-N 3Å
329	Y	80.9	Confident	77.7	Confident	23 Å²	23	67.4 Å²	67.4	9%	0.09	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-75.1	118.1	178.6	-56.8	-70.3	0	0	0	109.1	A300 Q318 S319 R326 Y334	A300-Y329 HydrophobicContact CB-CD1 3.78Å; A300-Y329 HydrophobicContact CB-CD2 4.07Å; A300-Y329 HydrophobicContact CB-CE1 3.66Å; A300-Y329 HydrophobicContact CB-CE2 4.03Å; A300-Y329 HydrophobicContact CB-CG 3.96Å; Q318-Y329 CarbonylContact C-O 3.54Å; Q318-Y329 WeakPolarHBondContact CA-O 3.35Å; S319-Y329 PolarHBondContact N-O 2.74Å; S319-Y329 WeakPolarHBondContact OG-CB 3.43Å; S319-Y329 VanDerWaalsContact OG-CD2 3.31Å; S319-Y329 WeakPolarHBondContact OG-CD2 3.49Å; S319-Y329 PolarHBondContact OG-N 3.46Å; R326-Y329 PolarHBondContact NE-OH 3.42Å; R326-Y329 PolarHBondContact NH1-OH 2.95Å; R326-Y329 PolarHBondContact NH2-OH 2.94Å; Y329-Y334 AromaticContact CD1-CE2 3.73Å; Y329-Y334 HydrophobicContact CD1-CE2 3.73Å; Y329-Y334 AromaticContact CD1-CZ 3.75Å; Y329-Y334 VanDerWaalsContact CD1-OH 3.24Å; Y329-Y334 WeakPolarHBondContact CD1-OH 3.47Å; Y329-Y334 WeakPolarHBondContact CE1-OH 3.39Å; Y329-Y334 HydrophobicContact CG-CE2 4.16Å
330	M	85	Confident	78.7	Confident	73 Å²	73	75.3 Å²	75.3	36%	0.36	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-81	133.1	178.4	-64.1	-174.2	70.9	0	0	110.9	P328 K332 D333 Y334	P328-M330 PolarHBondContact O-N 3Å; M330-K332 VanDerWaalsContact C-N 3.3Å; M330-K332 PolarHBondContact O-N 3.42Å; M330-D333 PolarHBondContact O-N 3.35Å; M330-Y334 WeakPolarHBondContact O-CD2 3.41Å; M330-Y334 PolarHBondContact O-N 3.1Å
331	W	88.3	Confident	79.9	Confident	3 Å²	3	68.4 Å²	68.4	1%	0.011	37%	0.368	C	S	.	.	H	α-helix	trans	-56.8	-43.4	178.8	168.3	-113.7	0	0	0	112.3	F84 Y109 L111 L304 I317 D333 Y334 A335	F84-W331 HydrophobicContact CD1-CH2 4.09Å; F84-W331 AromaticContact CD1-CZ3 3.85Å; F84-W331 HydrophobicContact CD1-CZ3 3.85Å; F84-W331 AromaticContact CE1-CZ3 3.82Å; F84-W331 HydrophobicContact CE1-CZ3 3.82Å; Y109-W331 PolarHBondContact O-NE1 3.36Å; L111-W331 HydrophobicContact CD1-CH2 4.32Å; L111-W331 HydrophobicContact CD1-CZ2 3.88Å; L304-W331 HydrophobicContact CD1-CE3 4.23Å; L304-W331 HydrophobicContact CD2-CE3 4Å; L304-W331 HydrophobicContact CD2-CZ3 4.13Å; L304-W331 HydrophobicContact CG-CE3 4.05Å; L304-W331 HydrophobicContact CG-CZ3 4.46Å; I317-W331 HydrophobicContact CB-CB 3.9Å; I317-W331 HydrophobicContact CG2-CB 3.54Å; I317-W331 HydrophobicContact CG2-CG 4.07Å; I317-W331 WeakPolarHBondContact O-CB 3.47Å; I317-W331 PolarHBondContact O-N 3.34Å; W331-D333 VanDerWaalsContact C-N 3.28Å; W331-D333 PolarHBondContact O-N 3.07Å; W331-Y334 PolarHBondContact O-N 3.44Å; W331-Y334 VanDerWaalsContact O-N 3.16Å; W331-A335 HydrophobicContact CD2-CB 4.09Å; W331-A335 HydrophobicContact CH2-CB 4.21Å; W331-A335 HydrophobicContact CZ2-CB 3.77Å; W331-A335 VanDerWaalsContact O-CB 3.23Å; W331-A335 WeakPolarHBondContact O-CB 3.43Å; W331-A335 PolarHBondContact O-N 2.98Å
332	K	87.2	Confident	81.5	Confident	91 Å²	91	65.5 Å²	65.5	40%	0.396	35%	0.347	S	S	.	.	H	α-helix	trans	-50.8	-42.9	177.8	179.5	166.7	-175.4	166.4	0	113.8	H110 M330 T336	H110-K332 WeakPolarHBondContact NE2-CD 3.48Å; H110-K332 VanDerWaalsContact NE2-CE 3.3Å; H110-K332 WeakPolarHBondContact NE2-CE 3.15Å; M330-K332 VanDerWaalsContact C-N 3.3Å; M330-K332 PolarHBondContact O-N 3.42Å; K332-T336 WeakPolarHBondContact O-CB 3.46Å; K332-T336 WeakPolarHBondContact O-CG2 3.07Å; K332-T336 PolarHBondContact O-N 3.41Å; K332-T336 PolarHBondContact O-OG1 3.27Å
333	D	87.2	Confident	83.3	Confident	79 Å²	79	59.3 Å²	59.3	42%	0.422	32%	0.322	S	S	.	.	H	α-helix	trans	-73.4	-35.9	-176.7	-63	-14.1	0	0	0	111.9	M330 W331 T336 K337	M330-D333 PolarHBondContact O-N 3.35Å; W331-D333 VanDerWaalsContact C-N 3.28Å; W331-D333 PolarHBondContact O-N 3.07Å; D333-T336 PolarHBondContact O-OG1 3.32Å; D333-T336 VanDerWaalsContact O-OG1 3.13Å; D333-K337 VanDerWaalsContact O-CG 3.24Å; D333-K337 WeakPolarHBondContact O-CG 3.44Å; D333-K337 PolarHBondContact O-N 3.45Å
334	Y	88.7	Confident	84.7	Confident	17 Å²	17	59.8 Å²	59.8	7%	0.067	34%	0.336	C	S	.	.	H	α-helix	trans	-81.1	-31.6	177.3	-75.2	-93.6	0	0	0	112.4	L293 D297 A300 L304 Y329 M330 W331 K337 L338	L293-Y334 HydrophobicContact CD1-CD1 4.4Å; L293-Y334 HydrophobicContact CD2-CD1 4.41Å; D297-Y334 HydrophobicContact CB-CE1 4.27Å; D297-Y334 WeakPolarHBondContact OD2-CE1 3.45Å; D297-Y334 PolarHBondContact OD2-OH 2.78Å; A300-Y334 HydrophobicContact CB-CD1 4.19Å; A300-Y334 HydrophobicContact CB-CE1 3.34Å; A300-Y334 HydrophobicContact CB-CE2 4.28Å; A300-Y334 WeakPolarHBondContact CB-OH 3.47Å; L304-Y334 HydrophobicContact CD2-CD1 4.25Å; L304-Y334 HydrophobicContact CD2-CD2 4.46Å; L304-Y334 HydrophobicContact CD2-CG 3.78Å; Y329-Y334 AromaticContact CD1-CE2 3.73Å; Y329-Y334 HydrophobicContact CD1-CE2 3.73Å; Y329-Y334 AromaticContact CD1-CZ 3.75Å; Y329-Y334 VanDerWaalsContact CD1-OH 3.24Å; Y329-Y334 WeakPolarHBondContact CD1-OH 3.47Å; Y329-Y334 WeakPolarHBondContact CE1-OH 3.39Å; Y329-Y334 HydrophobicContact CG-CE2 4.16Å; M330-Y334 WeakPolarHBondContact O-CD2 3.41Å; M330-Y334 PolarHBondContact O-N 3.1Å; W331-Y334 PolarHBondContact O-N 3.44Å; W331-Y334 VanDerWaalsContact O-N 3.16Å; Y334-K337 PolarHBondContact O-N 3.12Å; Y334-L338 VanDerWaalsContact O-CB 3.25Å; Y334-L338 WeakPolarHBondContact O-CB 3.39Å; Y334-L338 PolarHBondContact O-N 3.07Å
335	A	90.2	Very high	86.2	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-67.6	-40.9	173.5	0	0	0	0	0	111.8	H110 W331 L338 F339	H110-A335 HydrophobicContact CB-CB 4.1Å; H110-A335 WeakPolarHBondContact O-CB 3.37Å; W331-A335 HydrophobicContact CD2-CB 4.09Å; W331-A335 HydrophobicContact CH2-CB 4.21Å; W331-A335 HydrophobicContact CZ2-CB 3.77Å; W331-A335 VanDerWaalsContact O-CB 3.23Å; W331-A335 WeakPolarHBondContact O-CB 3.43Å; W331-A335 PolarHBondContact O-N 2.98Å; A335-L338 PolarHBondContact O-N 3.49Å; A335-F339 WeakPolarHBondContact O-CB 3.49Å; A335-F339 PolarHBondContact O-N 3.25Å
336	T	89.6	Confident	87.5	Confident	52 Å²	52	54.8 Å²	54.8	32%	0.319	28%	0.28	S	S	.	.	H	α-helix	trans	-69.4	-35.4	173.9	50.7	0	0	0	0	112.8	K332 D333 R340	K332-T336 WeakPolarHBondContact O-CB 3.46Å; K332-T336 WeakPolarHBondContact O-CG2 3.07Å; K332-T336 PolarHBondContact O-N 3.41Å; K332-T336 PolarHBondContact O-OG1 3.27Å; D333-T336 PolarHBondContact O-OG1 3.32Å; D333-T336 VanDerWaalsContact O-OG1 3.13Å; T336-R340 VanDerWaalsContact O-CG 3.31Å; T336-R340 WeakPolarHBondContact O-CG 3.49Å; T336-R340 PolarHBondContact O-N 3.03Å; T336-R340 VanDerWaalsContact O-N 3.09Å
337	K	91.3	Very high	88.5	Confident	89 Å²	89	50 Å²	50	39%	0.387	26%	0.262	S	S	.	.	H	α-helix	trans	-61.8	-50.6	167.6	-74.3	170.5	-175.4	176.5	0	111.6	L293 D333 Y334 F339 R340 D341	L293-K337 HydrophobicContact CD1-CB 4.3Å; D333-K337 VanDerWaalsContact O-CG 3.24Å; D333-K337 WeakPolarHBondContact O-CG 3.44Å; D333-K337 PolarHBondContact O-N 3.45Å; Y334-K337 PolarHBondContact O-N 3.12Å; K337-F339 VanDerWaalsContact C-N 3.29Å; K337-F339 PolarHBondContact O-N 2.94Å; K337-R340 WeakPolarHBondContact O-CB 3.1Å; K337-R340 PolarHBondContact O-N 3.45Å; K337-R340 VanDerWaalsContact O-N 3.11Å; K337-D341 PolarHBondContact O-N 2.75Å
338	L	92.3	Very high	89.3	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-58.3	-40.6	179.4	-177.2	62	0	0	0	111.9	F84 P112 I290 L293 Y334 A335 D341 M342	F84-L338 HydrophobicContact CB-CD2 4.24Å; F84-L338 HydrophobicContact CD1-CD2 4.31Å; F84-L338 WeakPolarHBondContact O-CD2 3.41Å; P112-L338 HydrophobicContact CG-CD2 4.23Å; P112-L338 HydrophobicContact CG-CG 4.38Å; I290-L338 HydrophobicContact CG1-CD1 3.98Å; I290-L338 HydrophobicContact CG1-CD2 4.42Å; L293-L338 HydrophobicContact CD2-CB 3.97Å; L293-L338 HydrophobicContact CD2-CD1 4.24Å; Y334-L338 VanDerWaalsContact O-CB 3.25Å; Y334-L338 WeakPolarHBondContact O-CB 3.39Å; Y334-L338 PolarHBondContact O-N 3.07Å; A335-L338 PolarHBondContact O-N 3.49Å; L338-D341 PolarHBondContact O-N 3.37Å; L338-M342 HydrophobicContact CD1-CE 4.07Å; L338-M342 HydrophobicContact CD2-CE 4.13Å; L338-M342 HydrophobicContact CG-CE 3.81Å; L338-M342 VanDerWaalsContact O-CG 3.31Å; L338-M342 WeakPolarHBondContact O-CG 3.28Å; L338-M342 PolarHBondContact O-N 3.37Å
339	F	93	Very high	89.9	Confident	23 Å²	23	53.4 Å²	53.4	10%	0.101	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-41.9	175.5	-174.4	-108.8	0	0	0	112.4	P112 G130 S131 L133 A335 K337 M342 L343	P112-F339 HydrophobicContact CB-CD2 4.34Å; P112-F339 HydrophobicContact CG-CB 4.39Å; G130-F339 WeakPolarHBondContact O-CE1 3.09Å; S131-F339 WeakPolarHBondContact O-CE2 3.31Å; L133-F339 HydrophobicContact CB-CE2 4.15Å; L133-F339 HydrophobicContact CD2-CD2 4.16Å; L133-F339 HydrophobicContact CD2-CE2 3.92Å; A335-F339 WeakPolarHBondContact O-CB 3.49Å; A335-F339 PolarHBondContact O-N 3.25Å; K337-F339 VanDerWaalsContact C-N 3.29Å; K337-F339 PolarHBondContact O-N 2.94Å; F339-M342 WeakPolarHBondContact O-CB 3.49Å; F339-M342 PolarHBondContact O-N 2.91Å; F339-M342 VanDerWaalsContact O-N 3.17Å; F339-L343 HydrophobicContact CD1-CD1 4.03Å; F339-L343 HydrophobicContact CD1-CG 4.45Å; F339-L343 HydrophobicContact CE1-CD1 3.64Å; F339-L343 HydrophobicContact CE1-CG 4.16Å; F339-L343 HydrophobicContact CZ-CD1 4.2Å; F339-L343 HydrophobicContact CZ-CD2 4.27Å; F339-L343 HydrophobicContact CZ-CG 4.32Å; F339-L343 WeakPolarHBondContact O-CG 3.37Å; F339-L343 PolarHBondContact O-N 3.22Å
340	R	93.1	Very high	90.1	Very high	172 Å²	172	52.8 Å²	52.8	65%	0.649	28%	0.276	S	S	*	.	H	α-helix	trans	-62.6	-41.9	172.7	-71.5	171.6	-173.7	171.7	3.2	111.9	T336 K337 M342 L343 A344	T336-R340 VanDerWaalsContact O-CG 3.31Å; T336-R340 WeakPolarHBondContact O-CG 3.49Å; T336-R340 PolarHBondContact O-N 3.03Å; T336-R340 VanDerWaalsContact O-N 3.09Å; K337-R340 WeakPolarHBondContact O-CB 3.1Å; K337-R340 PolarHBondContact O-N 3.45Å; K337-R340 VanDerWaalsContact O-N 3.11Å; R340-M342 PolarHBondContact O-N 2.94Å; R340-L343 PolarHBondContact O-N 3.13Å; R340-A344 WeakPolarHBondContact O-CB 3.16Å; R340-A344 PolarHBondContact O-N 3.47Å
341	D	92.4	Very high	90.2	Very high	32 Å²	32	56.4 Å²	56.4	17%	0.171	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-25.8	175.1	-74.5	4.9	0	0	0	112.2	S289 H292 K337 L338 M345	S289-D341 PolarHBondContact OG-O 2.84Å; S289-D341 VanDerWaalsContact OG-O 3.1Å; H292-D341 IonicContact CE1-OD1 2.76Å; H292-D341 IonicContact CE1-OD2 3.78Å; H292-D341 IonicContact CG-OD2 3.58Å; H292-D341 IonicContact ND1-OD1 3.74Å; H292-D341 IonicContact ND1-OD2 3.22Å; H292-D341 PolarHBondContact ND1-OD2 2.84Å; K337-D341 PolarHBondContact O-N 2.75Å; L338-D341 PolarHBondContact O-N 3.37Å; D341-M345 WeakPolarHBondContact O-CE 3.24Å; D341-M345 WeakPolarHBondContact O-CG 3.37Å
342	M	94.2	Very high	90.2	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-77.2	-41.5	171	-70.5	170.9	-180	0	0	112.1	A85 P112 L133 I285 A286 S289 L338 F339 R340 A344 M345	A85-M342 HydrophobicContact CB-CE 3.91Å; P112-M342 HydrophobicContact CB-CE 3.94Å; P112-M342 HydrophobicContact CB-SD 3.56Å; P112-M342 VanDerWaalsContact CB-SD 3.56Å; P112-M342 HydrophobicContact CG-CE 4.32Å; P112-M342 HydrophobicContact CG-SD 4.2Å; L133-M342 HydrophobicContact CD2-CB 3.67Å; L133-M342 HydrophobicContact CD2-CG 4.34Å; L133-M342 HydrophobicContact CD2-SD 3.87Å; I285-M342 HydrophobicContact CG2-CB 4.03Å; I285-M342 HydrophobicContact CG2-CG 3.96Å; A286-M342 HydrophobicContact CB-CE 4.47Å; S289-M342 WeakPolarHBondContact OG-CA 3.47Å; S289-M342 VanDerWaalsContact OG-CG 3.28Å; S289-M342 WeakPolarHBondContact OG-CG 3.08Å; S289-M342 PolarHBondContact OG-N 2.9Å; L338-M342 HydrophobicContact CD1-CE 4.07Å; L338-M342 HydrophobicContact CD2-CE 4.13Å; L338-M342 HydrophobicContact CG-CE 3.81Å; L338-M342 VanDerWaalsContact O-CG 3.31Å; L338-M342 WeakPolarHBondContact O-CG 3.28Å; L338-M342 PolarHBondContact O-N 3.37Å; F339-M342 WeakPolarHBondContact O-CB 3.49Å; F339-M342 PolarHBondContact O-N 2.91Å; F339-M342 VanDerWaalsContact O-N 3.17Å; R340-M342 PolarHBondContact O-N 2.94Å; M342-A344 VanDerWaalsContact C-N 3.31Å; M342-A344 PolarHBondContact O-N 3.18Å; M342-M345 WeakPolarHBondContact O-CB 3.36Å; M342-M345 PolarHBondContact O-N 3.03Å
343	L	93.3	Very high	90.1	Very high	37 Å²	37	53.9 Å²	53.9	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-34.5	176.5	-68.9	178.5	0	0	0	112.6	L133 F339 R340 M345 F357 G361	L133-L343 HydrophobicContact CB-CD2 4.45Å; F339-L343 HydrophobicContact CD1-CD1 4.03Å; F339-L343 HydrophobicContact CD1-CG 4.45Å; F339-L343 HydrophobicContact CE1-CD1 3.64Å; F339-L343 HydrophobicContact CE1-CG 4.16Å; F339-L343 HydrophobicContact CZ-CD1 4.2Å; F339-L343 HydrophobicContact CZ-CD2 4.27Å; F339-L343 HydrophobicContact CZ-CG 4.32Å; F339-L343 WeakPolarHBondContact O-CG 3.37Å; F339-L343 PolarHBondContact O-N 3.22Å; R340-L343 PolarHBondContact O-N 3.13Å; L343-M345 VanDerWaalsContact C-N 3.26Å; L343-M345 PolarHBondContact O-N 3.47Å; L343-F357 HydrophobicContact CD2-CB 4.17Å; L343-G361 VanDerWaalsContact CD2-CA 3.46Å
344	A	92.6	Very high	90.1	Very high	82 Å²	82	52.6 Å²	52.6	68%	0.678	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-3.4	179.8	0	0	0	0	0	114.5	R340 M342	R340-A344 WeakPolarHBondContact O-CB 3.16Å; R340-A344 PolarHBondContact O-N 3.47Å; M342-A344 VanDerWaalsContact C-N 3.31Å; M342-A344 PolarHBondContact O-N 3.18Å
345	M	90.8	Very high	90.2	Very high	28 Å²	28	51.9 Å²	51.9	14%	0.138	27%	0.272	C	S	.	.			trans	-70.5	135.3	178.4	-71.6	-69.2	158.8	0	0	111.5	Q288 S289 D341 M342 L343 F347	Q288-M345 HydrophobicContact CB-CE 4.17Å; Q288-M345 HydrophobicContact CB-SD 4.27Å; S289-M345 WeakPolarHBondContact OG-CE 3.34Å; D341-M345 WeakPolarHBondContact O-CE 3.24Å; D341-M345 WeakPolarHBondContact O-CG 3.37Å; M342-M345 WeakPolarHBondContact O-CB 3.36Å; M342-M345 PolarHBondContact O-N 3.03Å; L343-M345 VanDerWaalsContact C-N 3.26Å; L343-M345 PolarHBondContact O-N 3.47Å; M345-F347 HydrophobicContact CB-CE2 3.94Å; M345-F347 HydrophobicContact CB-CZ 4.27Å; M345-F347 HydrophobicContact CG-CE2 4.38Å; M345-F347 HydrophobicContact CG-CZ 4.36Å; M345-F347 HydrophobicContact SD-CE2 4.41Å; M345-F347 HydrophobicContact SD-CZ 3.81Å
346	N	92.4	Very high	90.3	Very high	94 Å²	94	53.9 Å²	53.9	50%	0.503	28%	0.281	S	S	.	.			trans	-135.1	117.9	177.4	-177.8	-6.8	0	0	0	109.1	H354 L355	N346-H354 PolarHBondContact OD1-CE1 3.23Å; N346-L355 WeakPolarHBondContact CA-O 3.14Å
347	F	89.5	Confident	90.5	Very high	14 Å²	14	52.2 Å²	52.2	6%	0.061	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-124.2	119.7	177.7	-58.1	-62.5	0	0	0	110.8	R284 I285 Q288 M345 H354 L355	R284-F347 HydrophobicContact CG-CE2 4.36Å; R284-F347 HydrophobicContact CG-CZ 4.22Å; I285-F347 HydrophobicContact CG1-CD2 4.47Å; I285-F347 HydrophobicContact CG1-CE2 3.89Å; Q288-F347 VanDerWaalsContact OE1-CZ 3.29Å; M345-F347 HydrophobicContact CB-CE2 3.94Å; M345-F347 HydrophobicContact CB-CZ 4.27Å; M345-F347 HydrophobicContact CG-CE2 4.38Å; M345-F347 HydrophobicContact CG-CZ 4.36Å; M345-F347 HydrophobicContact SD-CE2 4.41Å; M345-F347 HydrophobicContact SD-CZ 3.81Å; F347-H354 WeakPolarHBondContact O-CA 3.41Å; F347-L355 HydrophobicContact CB-CB 4.34Å; F347-L355 HydrophobicContact CD2-CD2 4.24Å; F347-L355 PolarHBondContact N-O 3.13Å; F347-L355 PolarHBondContact O-N 3.29Å
348	T	86.8	Confident	90.5	Very high	116 Å²	116	50.1 Å²	50.1	71%	0.712	26%	0.262	S	S	*	.	S	Bend	trans	-82.1	-17.8	171.1	52.5	0	0	0	0	112.4
349	D	88.8	Confident	90.4	Very high	94 Å²	94	57.9 Å²	57.9	50%	0.503	30%	0.299	S	S	.	.	S	Bend	trans	-109.8	22.9	-175.1	71.2	-49	0	0	0	113.7	R284	R284-D349 IonicContact CZ-OD1 2.62Å; R284-D349 IonicContact CZ-OD2 2.62Å; R284-D349 VanDerWaalsContact CZ-OD2 3.22Å; R284-D349 IonicContact NH1-OD1 2.79Å; R284-D349 IonicContact NH1-OD2 3.49Å; R284-D349 PolarHBondContact NH1-OD2 3.1Å; R284-D349 IonicContact NH2-OD1 2.85Å; R284-D349 PolarHBondContact NH2-OD1 3.46Å; R284-D349 IonicContact NH2-OD2 2.8Å; R284-D349 PolarHBondContact NH2-OD2 3.33Å
350	G	85	Confident	90.3	Very high	11 Å²	11	62.9 Å²	62.9	11%	0.113	32%	0.318	C	S	.	.			trans	-62.4	147.9	175.1	0	0	0	0	0	112.1	T352 G353	G350-T352 PolarHBondContact O-N 2.74Å; G350-G353 WeakPolarHBondContact CA-O 3.49Å; G350-G353 WeakPolarHBondContact O-CA 3.08Å; G350-G353 PolarHBondContact O-N 3.26Å
351	R	87.8	Confident	90.2	Very high	149 Å²	149	54.7 Å²	54.7	56%	0.562	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-33	178.2	-67.9	-159.6	-177.8	-176.5	1.1	112.2	D277 D281 G353	D277-R351 HydrophobicContact CB-CB 3.91Å; D277-R351 VanDerWaalsContact OD1-CD 3.29Å; D277-R351 WeakPolarHBondContact OD1-CD 3.39Å; D277-R351 IonicContact OD1-NH1 3.98Å; D281-R351 PolarHBondContact OD1-N 2.92Å; D281-R351 PolarHBondContact OD2-N 3.01Å; R351-G353 PolarHBondContact O-N 3.2Å
352	T	87.7	Confident	90.3	Very high	15 Å²	15	53.5 Å²	53.5	9%	0.092	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	9.2	175.6	66.3	0	0	0	0	112.5	V273 D277 H278 D281 G350 R363	V273-T352 HydrophobicContact CG1-CG2 3.78Å; D277-T352 HydrophobicContact CB-CG2 4.07Å; H278-T352 HydrophobicContact CB-CG2 4.24Å; H278-T352 WeakPolarHBondContact ND1-CG2 3.46Å; D281-T352 VanDerWaalsContact OD2-CB 3.3Å; D281-T352 WeakPolarHBondContact OD2-CB 3.46Å; D281-T352 VanDerWaalsContact OD2-CG2 3.24Å; D281-T352 WeakPolarHBondContact OD2-CG2 3.19Å; D281-T352 PolarHBondContact OD2-N 3.33Å; D281-T352 PolarHBondContact OD2-OG1 2.97Å; G350-T352 PolarHBondContact O-N 2.74Å; T352-R363 PolarHBondContact O-NH2 3.12Å; T352-R363 PolarHBondContact OG1-NH1 2.72Å; T352-R363 PolarHBondContact OG1-NH2 2.97Å
353	G	85.4	Confident	90.1	Very high	25 Å²	25	54.1 Å²	54.1	26%	0.258	28%	0.283	S	S	.	.	S	Bend	trans	93.2	-159.3	-172.6	0	0	0	0	0	113.2	G350 R351 L355	G350-G353 WeakPolarHBondContact CA-O 3.49Å; G350-G353 WeakPolarHBondContact O-CA 3.08Å; G350-G353 PolarHBondContact O-N 3.26Å; R351-G353 PolarHBondContact O-N 3.2Å; G353-L355 PolarHBondContact O-N 3.28Å
354	H	88.2	Confident	90	Very high	53 Å²	53	54.8 Å²	54.8	25%	0.245	29%	0.286	C	S	.	.			trans	-59.2	130.9	179	-174.5	78.4	0	0	0	111.5	N346 F347 E356 R363	N346-H354 PolarHBondContact OD1-CE1 3.23Å; F347-H354 WeakPolarHBondContact O-CA 3.41Å; H354-E356 IonicContact CD2-OE2 2.67Å; H354-E356 IonicContact CE1-OE2 3.85Å; H354-E356 IonicContact NE2-OE2 2.67Å; H354-E356 PolarHBondContact NE2-OE2 3.22Å; H354-R363 PolarHBondContact O-NE 3.43Å; H354-R363 PolarHBondContact O-NH2 2.79Å
355	L	90.1	Very high	89.6	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-129.7	113.6	-172.3	-168.1	62	0	0	0	110.3	T135 D281 I285 N346 F347 G353 F357 R363	T135-L355 HydrophobicContact CG2-CD1 4.45Å; D281-L355 HydrophobicContact CB-CD2 3.82Å; I285-L355 HydrophobicContact CD1-CD2 3.68Å; I285-L355 HydrophobicContact CD1-CG 4.46Å; I285-L355 HydrophobicContact CG1-CD2 4.24Å; N346-L355 WeakPolarHBondContact CA-O 3.14Å; F347-L355 HydrophobicContact CB-CB 4.34Å; F347-L355 HydrophobicContact CD2-CD2 4.24Å; F347-L355 PolarHBondContact N-O 3.13Å; F347-L355 PolarHBondContact O-N 3.29Å; G353-L355 PolarHBondContact O-N 3.28Å; L355-F357 HydrophobicContact CD1-CE1 4.22Å; L355-F357 HydrophobicContact CD1-CZ 4Å; L355-F357 HydrophobicContact CG-CZ 4.11Å; L355-R363 HydrophobicContact CD1-CG 4.26Å
356	E	92.1	Very high	89.5	Confident	44 Å²	44	55.6 Å²	55.6	21%	0.206	28%	0.275	C	S	.	.			trans	-152.1	143.9	-173.6	-178.6	-175.5	163.1	0	0	107	H354 R363 I364 K365	H354-E356 IonicContact CD2-OE2 2.67Å; H354-E356 IonicContact CE1-OE2 3.85Å; H354-E356 IonicContact NE2-OE2 2.67Å; H354-E356 PolarHBondContact NE2-OE2 3.22Å; E356-R363 WeakPolarHBondContact O-CA 3.26Å; E356-I364 HydrophobicContact CB-CB 4.32Å; E356-I364 HydrophobicContact CG-CB 4.3Å; E356-I364 HydrophobicContact CG-CD1 4.29Å; E356-I364 PolarHBondContact O-N 2.84Å; E356-K365 VanDerWaalsContact CD-NZ 3.3Å; E356-K365 IonicContact OE1-NZ 2.78Å; E356-K365 PolarHBondContact OE1-NZ 3.07Å; E356-K365 VanDerWaalsContact OE1-NZ 3.1Å; E356-K365 IonicContact OE2-NZ 2.68Å; E356-K365 PolarHBondContact OE2-NZ 3.06Å
357	F	93.6	Very high	89.4	Confident	16 Å²	16	54 Å²	54	7%	0.07	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-116.5	148.9	-176.1	-59.2	-65.9	0	0	0	112.2	L133 R134 I285 L343 L355 D362 I364	L133-F357 HydrophobicContact CD1-CE1 4.17Å; L133-F357 HydrophobicContact CD1-CE2 4.27Å; L133-F357 HydrophobicContact CD1-CZ 3.92Å; R134-F357 VanDerWaalsContact O-CE1 3.3Å; R134-F357 WeakPolarHBondContact O-CE1 3.26Å; I285-F357 HydrophobicContact CD1-CE2 3.74Å; I285-F357 HydrophobicContact CD1-CZ 3.53Å; I285-F357 HydrophobicContact CG1-CE2 4.35Å; L343-F357 HydrophobicContact CD2-CB 4.17Å; L355-F357 HydrophobicContact CD1-CE1 4.22Å; L355-F357 HydrophobicContact CD1-CZ 4Å; L355-F357 HydrophobicContact CG-CZ 4.11Å; F357-D362 WeakPolarHBondContact CA-O 3.29Å; F357-I364 WeakPolarHBondContact O-CD1 3.44Å
358	N	91.5	Very high	89.6	Confident	45 Å²	45	53.6 Å²	53.6	24%	0.241	26%	0.264	C	S	.	.			trans	-86.9	176	167.4	69.6	9.6	0	0	0	111.3	Y360 G361 D362 I364	N358-Y360 PolarHBondContact O-N 3.44Å; N358-Y360 VanDerWaalsContact O-N 3.15Å; N358-Y360 VanDerWaalsContact OD1-CA 3.27Å; N358-Y360 WeakPolarHBondContact OD1-CA 3.46Å; N358-Y360 WeakPolarHBondContact OD1-CB 3.31Å; N358-Y360 PolarHBondContact OD1-N 3.17Å; N358-G361 PolarHBondContact O-N 3.06Å; N358-G361 PolarHBondContact OD1-N 3.04Å; N358-D362 PolarHBondContact N-O 3.38Å; N358-D362 WeakPolarHBondContact OD1-CB 3.31Å; N358-D362 PolarHBondContact OD1-N 2.95Å; N358-D362 PolarHBondContact OD1-O 2.75Å; N358-I364 HydrophobicContact CB-CD1 3.81Å; N358-I364 HydrophobicContact CB-CG1 3.9Å
359	E	90.6	Very high	89.9	Confident	165 Å²	165	48.7 Å²	48.7	77%	0.771	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.4	176	-58	179.7	165.7	0	0	112.9	G361	E359-G361 VanDerWaalsContact C-N 3.29Å; E359-G361 PolarHBondContact O-N 2.99Å
360	Y	90.8	Very high	90.1	Very high	128 Å²	128	44.2 Å²	44.2	50%	0.502	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	4.8	174.1	-51.2	-78.7	0	0	0	113.7	K126 N358 D362	K126-Y360 WeakPolarHBondContact CE-O 3.43Å; K126-Y360 PolarHBondContact NZ-O 2.87Å; N358-Y360 PolarHBondContact O-N 3.44Å; N358-Y360 VanDerWaalsContact O-N 3.15Å; N358-Y360 VanDerWaalsContact OD1-CA 3.27Å; N358-Y360 WeakPolarHBondContact OD1-CA 3.46Å; N358-Y360 WeakPolarHBondContact OD1-CB 3.31Å; N358-Y360 PolarHBondContact OD1-N 3.17Å; Y360-D362 PolarHBondContact O-N 2.96Å
361	G	90.7	Very high	90.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	67.9	15.3	-178.9	0	0	0	0	0	114.7	L133 R134 L343 N358 E359	L133-G361 CarbonylContact C-O 3.38Å; L133-G361 VanDerWaalsContact CA-O 3.3Å; L133-G361 WeakPolarHBondContact CA-O 3.42Å; R134-G361 PolarHBondContact N-O 3.24Å; L343-G361 VanDerWaalsContact CD2-CA 3.46Å; N358-G361 PolarHBondContact O-N 3.06Å; N358-G361 PolarHBondContact OD1-N 3.04Å; E359-G361 VanDerWaalsContact C-N 3.29Å; E359-G361 PolarHBondContact O-N 2.99Å
362	D	93.4	Very high	90.8	Very high	6 Å²	6	36.6 Å²	36.6	3%	0.032	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-93.2	146.6	175.8	-60.6	-35.6	0	0	0	110.6	S124 R134 F357 N358 Y360 I364	S124-D362 WeakPolarHBondContact CB-OD2 3.49Å; S124-D362 PolarHBondContact OG-OD1 3.2Å; S124-D362 PolarHBondContact OG-OD2 3Å; R134-D362 IonicContact CZ-OD1 3.52Å; R134-D362 IonicContact NE-OD1 2.69Å; R134-D362 PolarHBondContact NE-OD1 3.01Å; R134-D362 IonicContact NH2-OD1 2.8Å; R134-D362 PolarHBondContact NH2-OD1 3.19Å; R134-D362 IonicContact NH2-OD2 3.91Å; F357-D362 WeakPolarHBondContact CA-O 3.29Å; N358-D362 PolarHBondContact N-O 3.38Å; N358-D362 WeakPolarHBondContact OD1-CB 3.31Å; N358-D362 PolarHBondContact OD1-N 2.95Å; N358-D362 PolarHBondContact OD1-O 2.75Å; Y360-D362 PolarHBondContact O-N 2.96Å; D362-I364 PolarHBondContact O-N 3Å
363	R	91.8	Very high	91.1	Very high	14 Å²	14	35.9 Å²	35.9	5%	0.053	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-68.1	129.2	179.5	-178.2	170.4	179.2	176.6	1.7	113	T135 T352 H354 L355 E356	T135-R363 WeakPolarHBondContact O-CD 3.43Å; T135-R363 PolarHBondContact O-NH1 3.12Å; T352-R363 PolarHBondContact O-NH2 3.12Å; T352-R363 PolarHBondContact OG1-NH1 2.72Å; T352-R363 PolarHBondContact OG1-NH2 2.97Å; H354-R363 PolarHBondContact O-NE 3.43Å; H354-R363 PolarHBondContact O-NH2 2.79Å; L355-R363 HydrophobicContact CD1-CG 4.26Å; E356-R363 WeakPolarHBondContact O-CA 3.26Å
364	I	89.6	Confident	91.3	Very high	51 Å²	51	36.1 Å²	36.1	26%	0.262	17%	0.167	S	C	.	.	S	Bend	trans	-88.5	152.4	172.4	-62.2	-179.7	0	0	0	110.3	E356 F357 N358 D362	E356-I364 HydrophobicContact CB-CB 4.32Å; E356-I364 HydrophobicContact CG-CB 4.3Å; E356-I364 HydrophobicContact CG-CD1 4.29Å; E356-I364 PolarHBondContact O-N 2.84Å; F357-I364 WeakPolarHBondContact O-CD1 3.44Å; N358-I364 HydrophobicContact CB-CD1 3.81Å; N358-I364 HydrophobicContact CB-CG1 3.9Å; D362-I364 PolarHBondContact O-N 3Å
365	K	85.5	Confident	90.9	Very high	112 Å²	112	36.7 Å²	36.7	49%	0.487	17%	0.171	S	C	.	.	S	Bend	trans	48.1	45	179.3	-60.9	144.1	-166.3	161.8	0	115.1	E356	E356-K365 VanDerWaalsContact CD-NZ 3.3Å; E356-K365 IonicContact OE1-NZ 2.78Å; E356-K365 PolarHBondContact OE1-NZ 3.07Å; E356-K365 VanDerWaalsContact OE1-NZ 3.1Å; E356-K365 IonicContact OE2-NZ 2.68Å; E356-K365 PolarHBondContact OE2-NZ 3.06Å
366	P	88.7	Confident	89.9	Confident	14 Å²	14	39.2 Å²	39.2	9%	0.091	19%	0.187	C	C	.	.			trans	-62.5	150.7	168.1	32.1	-39.3	0	0	0	111.2	P137 L270 Y368	P137-P366 HydrophobicContact CB-CB 4.1Å; P137-P366 HydrophobicContact CB-CG 3.87Å; P137-P366 HydrophobicContact CG-CB 3.69Å; P137-P366 HydrophobicContact CG-CG 3.93Å; L270-P366 HydrophobicContact CD1-CB 4.21Å; P366-Y368 HydrophobicContact CB-CD2 4.41Å; P366-Y368 HydrophobicContact CB-CE2 3.97Å; P366-Y368 HydrophobicContact CG-CD2 4.17Å; P366-Y368 HydrophobicContact CG-CE2 3.45Å; P366-Y368 VanDerWaalsContact CG-CE2 3.45Å
367	I	90.2	Very high	88.4	Confident	62 Å²	62	42.8 Å²	42.8	32%	0.318	21%	0.207	S	C	.	.			trans	-97.6	126.7	174.8	-58.1	172.8	0	0	0	108.8	L271 Y402 V404	L271-I367 HydrophobicContact CB-CG2 4.4Å; L271-I367 WeakPolarHBondContact CB-O 3.26Å; L271-I367 HydrophobicContact CD2-CB 4.41Å; L271-I367 HydrophobicContact CD2-CG2 4.09Å; L271-I367 PolarHBondContact N-O 3.18Å; L271-I367 VanDerWaalsContact N-O 3.13Å; I367-Y402 WeakPolarHBondContact CA-O 3.35Å; I367-V404 HydrophobicContact CD1-CG2 4.12Å; I367-V404 HydrophobicContact CG1-CG2 4.34Å
368	Y	92.7	Very high	86.3	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.016	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	150.6	175.6	-64.9	-96.2	0	0	0	111	P137 E142 I145 V268 R269 L270 P366 S401 Y402	P137-Y368 WeakPolarHBondContact CB-OH 3.47Å; P137-Y368 HydrophobicContact CG-CE1 4.4Å; P137-Y368 VanDerWaalsContact CG-OH 3.25Å; P137-Y368 WeakPolarHBondContact CG-OH 3.46Å; E142-Y368 HydrophobicContact CG-CE1 4.07Å; I145-Y368 HydrophobicContact CD1-CD1 4.09Å; I145-Y368 HydrophobicContact CD1-CD2 3.27Å; I145-Y368 HydrophobicContact CD1-CE1 4.43Å; I145-Y368 HydrophobicContact CD1-CE2 3.57Å; I145-Y368 HydrophobicContact CD1-CG 3.51Å; V268-Y368 HydrophobicContact CG1-CD1 3.73Å; V268-Y368 HydrophobicContact CG1-CE1 4.44Å; V268-Y368 HydrophobicContact CG1-CG 4.05Å; R269-Y368 CarbonylContact O-C 3.58Å; R269-Y368 WeakPolarHBondContact O-CA 3.42Å; R269-Y368 WeakPolarHBondContact O-CB 3.46Å; L270-Y368 HydrophobicContact CB-CD1 4.27Å; L270-Y368 HydrophobicContact CB-CE1 4.3Å; L270-Y368 HydrophobicContact CD1-CD1 4.19Å; L270-Y368 HydrophobicContact CD1-CE1 4.02Å; P366-Y368 HydrophobicContact CB-CD2 4.41Å; P366-Y368 HydrophobicContact CB-CE2 3.97Å; P366-Y368 HydrophobicContact CG-CD2 4.17Å; P366-Y368 HydrophobicContact CG-CE2 3.45Å; P366-Y368 VanDerWaalsContact CG-CE2 3.45Å; Y368-S401 WeakPolarHBondContact O-CA 3.36Å; Y368-Y402 HydrophobicContact CD2-CD1 4.46Å; Y368-Y402 PolarHBondContact N-O 3Å; Y368-Y402 PolarHBondContact O-N 3.05Å
369	D	92.7	Very high	84.5	Confident	14 Å²	14	49.5 Å²	49.5	8%	0.075	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131.3	172.4	179	34.6	0	0	0	108.8	R269 V371 S398	R269-D369 HydrophobicContact CG-CB 4.03Å; R269-D369 IonicContact CZ-OD2 2.93Å; R269-D369 PolarHBondContact N-O 2.81Å; R269-D369 IonicContact NE-OD2 3.65Å; R269-D369 PolarHBondContact NE-OD2 3.23Å; R269-D369 IonicContact NH2-OD2 3.62Å; R269-D369 PolarHBondContact NH2-OD2 2.68Å; R269-D369 PolarHBondContact O-N 2.84Å; D369-V371 WeakPolarHBondContact OD2-CG1 3.33Å; D369-S398 VanDerWaalsContact OD1-CB 3.23Å; D369-S398 WeakPolarHBondContact OD1-CB 3.3Å; D369-S398 PolarHBondContact OD1-OG 3.21Å
370	I	93.9	Very high	82.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	115.3	179.6	-55.2	175.1	0	0	0	106.6	I145 L149 I266 V399 G400 L422	I145-I370 HydrophobicContact CG2-CD1 4.5Å; L149-I370 HydrophobicContact CD2-CD1 4.33Å; I266-I370 HydrophobicContact CG2-CG2 3.97Å; I370-V399 HydrophobicContact CG2-CG2 4.07Å; I370-V399 WeakPolarHBondContact O-CG2 3.43Å; I370-V399 PolarHBondContact O-N 2.7Å; I370-G400 PolarHBondContact N-O 3.49Å; I370-G400 PolarHBondContact O-N 3.19Å; I370-L422 HydrophobicContact CD1-CD1 3.33Å
371	V	93.8	Very high	80.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	147.9	-175.7	-65.3	0	0	0	0	111.9	L256 I266 G267 R269 D369 L396 V397	L256-V371 HydrophobicContact CD1-CG2 3.45Å; L256-V371 VanDerWaalsContact CD1-CG2 3.45Å; L256-V371 HydrophobicContact CD2-CG2 3.97Å; L256-V371 HydrophobicContact CG-CG2 4.38Å; I266-V371 WeakPolarHBondContact CA-O 3.33Å; G267-V371 PolarHBondContact N-O 3.14Å; G267-V371 WeakPolarHBondContact O-CG2 3.34Å; G267-V371 PolarHBondContact O-N 2.7Å; R269-V371 HydrophobicContact CG-CG1 4.32Å; D369-V371 WeakPolarHBondContact OD2-CG1 3.33Å; V371-L396 HydrophobicContact CB-CB 4.32Å; V371-L396 HydrophobicContact CG1-CB 4.49Å; V371-L396 HydrophobicContact CG2-CD2 4.47Å; V371-V397 CarbonylContact C-O 3.52Å; V371-V397 VanDerWaalsContact CA-O 3.28Å; V371-V397 WeakPolarHBondContact CA-O 3.44Å
372	N	94.5	Very high	78.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.8	170.2	-174.5	-128.4	0	0	0	108.2	G264 V265 Q374 V397 V399 L429 I430	G264-N372 PolarHBondContact O-ND2 3.08Å; G264-N372 VanDerWaalsContact O-ND2 3.16Å; V265-N372 WeakPolarHBondContact O-CA 3.07Å; V265-N372 PolarHBondContact O-ND2 2.99Å; V265-N372 VanDerWaalsContact O-ND2 3.17Å; N372-Q374 PolarHBondContact O-N 3.17Å; N372-Q374 WeakPolarHBondContact OD1-CG 3.36Å; N372-Q374 PolarHBondContact OD1-NE2 2.95Å; N372-V397 PolarHBondContact N-O 3.48Å; N372-V397 PolarHBondContact O-N 3.32Å; N372-V399 HydrophobicContact CB-CB 4.49Å; N372-V399 HydrophobicContact CB-CG1 3.64Å; N372-V399 HydrophobicContact CB-CG2 4.02Å; N372-L429 HydrophobicContact CB-CD2 4.25Å; N372-I430 PolarHBondContact ND2-O 3.33Å; N372-I430 PolarHBondContact OD1-N 3.12Å; N372-I430 PolarHBondContact OD1-O 3.26Å
373	A	92.6	Very high	76.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	116	177.8	0	0	0	0	0	109.5	I261 P262 N263 G264 V265 P394 L396	I261-A373 HydrophobicContact CD1-CB 4.12Å; I261-A373 HydrophobicContact CG1-CB 4.24Å; P262-A373 WeakPolarHBondContact O-CB 3.42Å; N263-A373 PolarHBondContact OD1-O 3.32Å; N263-A373 VanDerWaalsContact OD1-O 3.09Å; G264-A373 PolarHBondContact N-O 2.87Å; V265-A373 HydrophobicContact CB-CB 4.41Å; V265-A373 PolarHBondContact O-N 2.86Å; A373-P394 HydrophobicContact CB-CB 4.22Å; A373-P394 HydrophobicContact CB-CG 3.88Å; A373-L396 HydrophobicContact CB-CD2 4.09Å
374	Q	89.6	Confident	74.7	Confident	29 Å²	29	60.1 Å²	60.1	14%	0.136	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	132.2	-175.1	-61.5	-173.8	-6.4	0	0	111.9	N263 N372 T395 V397 K428 I430	N263-Q374 WeakPolarHBondContact OD1-CA 3.46Å; N372-Q374 PolarHBondContact O-N 3.17Å; N372-Q374 WeakPolarHBondContact OD1-CG 3.36Å; N372-Q374 PolarHBondContact OD1-NE2 2.95Å; Q374-T395 PolarHBondContact N-O 3.08Å; Q374-T395 PolarHBondContact O-N 3.38Å; Q374-T395 PolarHBondContact O-OG1 2.9Å; Q374-V397 HydrophobicContact CB-CG2 4.03Å; Q374-V397 HydrophobicContact CG-CB 4.47Å; Q374-V397 HydrophobicContact CG-CG2 4.27Å; Q374-K428 PolarHBondContact NE2-O 3.02Å; Q374-I430 HydrophobicContact CG-CD1 4.12Å
375	I	81.4	Confident	72.7	Confident	65 Å²	65	61.8 Å²	61.8	33%	0.333	34%	0.34	S	S	.	.			trans	-81.2	129.9	167.9	-57.4	174.2	0	0	0	108	N263 I380 P394	N263-I375 HydrophobicContact CB-CD1 3.98Å; N263-I375 HydrophobicContact CB-CG1 4.14Å; N263-I375 PolarHBondContact OD1-N 3.44Å; I375-I380 HydrophobicContact CG2-CG1 4.48Å; I375-P394 HydrophobicContact CG1-CB 3.98Å
376	T	68.2	Low	70.6	Confident	55 Å²	55	63.6 Å²	63.6	34%	0.337	35%	0.35	S	S	.	.			trans	-86.1	136.7	-176.1	-66.7	0	0	0	0	110.7	Q378 D379	T376-Q378 HydrophobicContact CG2-CB 4.19Å; T376-Q378 HydrophobicContact CG2-CG 4.21Å; T376-Q378 PolarHBondContact O-N 3.3Å; T376-D379 PolarHBondContact O-N 2.95Å
377	N	59.5	Low	68.2	Low	118 Å²	118	73.9 Å²	73.9	63%	0.631	39%	0.393	S	S	*	.	H	α-helix	trans	-62.4	-11.4	-177.1	-72	-19.6	0	0	0	114.8	D379 I380	N377-D379 VanDerWaalsContact C-N 3.31Å; N377-I380 WeakPolarHBondContact OD1-CD1 3.32Å
378	Q	51.4	Low	65.8	Low	153 Å²	153	74 Å²	74	72%	0.715	40%	0.4	S	S	*	.	H	α-helix	trans	-69.5	-31.8	174.2	-67	-173.3	-12.1	0	0	111.6	T376	T376-Q378 HydrophobicContact CG2-CB 4.19Å; T376-Q378 HydrophobicContact CG2-CG 4.21Å; T376-Q378 PolarHBondContact O-N 3.3Å
379	D	51.9	Low	63.6	Low	50 Å²	50	84.2 Å²	84.2	27%	0.267	45%	0.445	S	S	.	.	H	α-helix	trans	-77.3	-38.4	-178.8	-47.8	-47.5	0	0	0	110.4	T376 N377 N381 N382 L383	T376-D379 PolarHBondContact O-N 2.95Å; N377-D379 VanDerWaalsContact C-N 3.31Å; D379-N381 VanDerWaalsContact C-N 3.25Å; D379-N381 PolarHBondContact O-N 3.07Å; D379-N381 VanDerWaalsContact O-N 3.14Å; D379-N382 WeakPolarHBondContact O-CA 3.41Å; D379-N382 PolarHBondContact O-N 2.92Å; D379-L383 HydrophobicContact CB-CD1 4.07Å; D379-L383 WeakPolarHBondContact O-CD1 3.22Å; D379-L383 PolarHBondContact O-N 3.25Å
380	I	52.7	Low	61.6	Low	84 Å²	84	91.7 Å²	91.7	43%	0.431	48%	0.479	S	S	.	.	H	α-helix	trans	-54.8	-37.2	-179	-57.9	-176.9	0	0	0	112.8	I375 N377 N382	I375-I380 HydrophobicContact CG2-CG1 4.48Å; N377-I380 WeakPolarHBondContact OD1-CD1 3.32Å; I380-N382 VanDerWaalsContact C-N 3.34Å
381	N	51.1	Low	60	Low	127 Å²	127	95.8 Å²	95.8	68%	0.679	50%	0.497	S	S	*	.	H	α-helix	trans	-70.3	-30.7	177.9	-72.3	-26.8	0	0	0	112.6	D379 S384	D379-N381 VanDerWaalsContact C-N 3.25Å; D379-N381 PolarHBondContact O-N 3.07Å; D379-N381 VanDerWaalsContact O-N 3.14Å; N381-S384 PolarHBondContact O-OG 3.13Å; N381-S384 VanDerWaalsContact O-OG 3.13Å
382	N	50.9	Low	58.7	Low	118 Å²	118	99.6 Å²	99.6	63%	0.631	52%	0.515	S	S	*	.	H	α-helix	trans	-83	-33.1	177.2	-65.9	-30.6	0	0	0	112.4	D379 I380 S384 A385	D379-N382 WeakPolarHBondContact O-CA 3.41Å; D379-N382 PolarHBondContact O-N 2.92Å; I380-N382 VanDerWaalsContact C-N 3.34Å; N382-S384 PolarHBondContact O-N 2.99Å; N382-S384 VanDerWaalsContact O-N 3.14Å; N382-A385 PolarHBondContact O-N 2.79Å
383	L	49.2	Very low	58.1	Low	96 Å²	96	104.5 Å²	104.5	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-64.5	-16.9	-179.5	-96.7	77.2	0	0	0	114.3	D379 A385 E392	D379-L383 HydrophobicContact CB-CD1 4.07Å; D379-L383 WeakPolarHBondContact O-CD1 3.22Å; D379-L383 PolarHBondContact O-N 3.25Å; L383-A385 PolarHBondContact O-N 3.35Å; L383-A385 VanDerWaalsContact O-N 3.14Å; L383-E392 WeakPolarHBondContact CD1-OE2 3.45Å
384	S	49.2	Very low	57.6	Low	110 Å²	110	104.9 Å²	104.9	77%	0.769	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.3	175.8	67.6	0	0	0	0	114.2	N381 N382	N381-S384 PolarHBondContact O-OG 3.13Å; N381-S384 VanDerWaalsContact O-OG 3.13Å; N382-S384 PolarHBondContact O-N 2.99Å; N382-S384 VanDerWaalsContact O-N 3.14Å
385	A	47.3	Very low	57.6	Low	86 Å²	86	106.6 Å²	106.6	71%	0.711	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-13.5	-175.5	0	0	0	0	0	115.8	N382 L383	N382-A385 PolarHBondContact O-N 2.79Å; L383-A385 PolarHBondContact O-N 3.35Å; L383-A385 VanDerWaalsContact O-N 3.14Å
386	Q	40.4	Very low	58	Low	150 Å²	150	106 Å²	106	70%	0.701	55%	0.545	S	S	*	.			trans	-126.2	100.4	-177.6	-79.4	179.2	-69.5	0	0	112.7	S388	Q386-S388 PolarHBondContact O-N 3.23Å
387	K	38.7	Very low	59.1	Low	230 Å²	230	105.6 Å²	105.6	100%	1	54%	0.543	S	S	*	.			trans	-75.8	70.1	162.3	-76.1	-178.2	174.5	176.8	0	110.6
388	S	39.8	Very low	60.6	Low	66 Å²	66	102.7 Å²	102.7	46%	0.462	53%	0.532	S	S	.	.			trans	-116.4	139.5	162.6	40.5	0	0	0	0	109.5	Q386 E390	Q386-S388 PolarHBondContact O-N 3.23Å; S388-E390 PolarHBondContact O-N 3.11Å
389	F	47.6	Very low	62.6	Low	218 Å²	218	95.6 Å²	95.6	96%	0.956	50%	0.499	S	S	*	.			trans	-81.8	37.9	-167.2	-153.9	-97.4	0	0	0	112.3
390	E	50.4	Low	64.4	Low	170 Å²	170	93.7 Å²	93.7	79%	0.794	49%	0.491	S	S	*	.			trans	-97.7	138.3	-166.9	-159.8	154.9	-153.4	0	0	110.8	S388 E392	S388-E390 PolarHBondContact O-N 3.11Å; E390-E392 PolarHBondContact O-N 3.21Å
391	F	60.3	Low	66.3	Low	86 Å²	86	91.5 Å²	91.5	38%	0.377	48%	0.483	S	S	.	.			trans	-84.8	108.3	-174.8	-172.8	-81.1	0	0	0	110	N260 I261	N260-F391 HydrophobicContact CB-CD1 4.44Å; N260-F391 HydrophobicContact CB-CD2 4.39Å; N260-F391 HydrophobicContact CB-CE1 4.32Å; N260-F391 HydrophobicContact CB-CE2 4.24Å; N260-F391 HydrophobicContact CB-CG 4.5Å; N260-F391 HydrophobicContact CB-CZ 4.22Å; N260-F391 WeakPolarHBondContact O-CZ 3.36Å; I261-F391 WeakPolarHBondContact O-CZ 3.27Å
392	E	66.6	Low	68.2	Low	81 Å²	81	86.3 Å²	86.3	38%	0.379	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-77.8	121.8	170	-173.2	166.6	-133.8	0	0	110.2	L383 E390	L383-E392 WeakPolarHBondContact CD1-OE2 3.45Å; E390-E392 PolarHBondContact O-N 3.21Å
393	R	80.7	Confident	69.9	Low	103 Å²	103	81.5 Å²	81.5	39%	0.389	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-77	121.9	-179.4	-178.6	176	174.9	138.5	3.9	110.1	L256 D257 A258 I261	L256-R393 PolarHBondContact O-NH2 3.48Å; D257-R393 PolarHBondContact O-NH1 2.7Å; A258-R393 PolarHBondContact O-NH1 3.17Å; A258-R393 VanDerWaalsContact O-NH1 3.1Å; I261-R393 HydrophobicContact CG2-CG 4.14Å
394	P	83.6	Confident	71.5	Confident	7 Å²	7	80.3 Å²	80.3	5%	0.045	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-64.3	148.3	178.7	26.6	-35	0	0	0	112.1	I261 A373 I375	I261-P394 HydrophobicContact CG2-CG 4Å; I261-P394 VanDerWaalsContact O-CD 3.26Å; I261-P394 WeakPolarHBondContact O-CD 3.36Å; I261-P394 VanDerWaalsContact O-CG 3.25Å; I261-P394 WeakPolarHBondContact O-CG 3.18Å; A373-P394 HydrophobicContact CB-CB 4.22Å; A373-P394 HydrophobicContact CB-CG 3.88Å; I375-P394 HydrophobicContact CG1-CB 3.98Å
395	T	88	Confident	73.1	Confident	65 Å²	65	81.8 Å²	81.8	40%	0.399	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	139.3	174.7	60	0	0	0	0	110.9	Q374 V397	Q374-T395 PolarHBondContact N-O 3.08Å; Q374-T395 PolarHBondContact O-N 3.38Å; Q374-T395 PolarHBondContact O-OG1 2.9Å; T395-V397 PolarHBondContact O-N 3.38Å
396	L	89.9	Confident	74.4	Confident	52 Å²	52	80.7 Å²	80.7	27%	0.272	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	105.4	177.9	-62.1	-178.6	0	0	0	109.8	L256 I261 V371 A373	L256-L396 HydrophobicContact CD2-CD2 4.17Å; I261-L396 HydrophobicContact CD1-CD2 4.4Å; V371-L396 HydrophobicContact CB-CB 4.32Å; V371-L396 HydrophobicContact CG1-CB 4.49Å; V371-L396 HydrophobicContact CG2-CD2 4.47Å; A373-L396 HydrophobicContact CB-CD2 4.09Å
397	V	91.6	Very high	76	Confident	47 Å²	47	79 Å²	79	29%	0.285	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.6	-178.6	179.5	0	0	0	0	109.7	V371 N372 Q374 T395 V399	V371-V397 CarbonylContact C-O 3.52Å; V371-V397 VanDerWaalsContact CA-O 3.28Å; V371-V397 WeakPolarHBondContact CA-O 3.44Å; N372-V397 PolarHBondContact N-O 3.48Å; N372-V397 PolarHBondContact O-N 3.32Å; Q374-V397 HydrophobicContact CB-CG2 4.03Å; Q374-V397 HydrophobicContact CG-CB 4.47Å; Q374-V397 HydrophobicContact CG-CG2 4.27Å; T395-V397 PolarHBondContact O-N 3.38Å; V397-V399 PolarHBondContact O-N 3Å
398	S	91.8	Very high	77.6	Confident	57 Å²	57	71.1 Å²	71.1	40%	0.399	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	120.2	172.5	176.1	0	0	0	0	110.7	D369	D369-S398 VanDerWaalsContact OD1-CB 3.23Å; D369-S398 WeakPolarHBondContact OD1-CB 3.3Å; D369-S398 PolarHBondContact OD1-OG 3.21Å
399	V	92.4	Very high	79.2	Confident	5 Å²	5	70.7 Å²	70.7	3%	0.03	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	-12.6	-178.4	-67	0	0	0	0	112.8	I370 N372 V397 N425 K428 L429	I370-V399 HydrophobicContact CG2-CG2 4.07Å; I370-V399 WeakPolarHBondContact O-CG2 3.43Å; I370-V399 PolarHBondContact O-N 2.7Å; N372-V399 HydrophobicContact CB-CB 4.49Å; N372-V399 HydrophobicContact CB-CG1 3.64Å; N372-V399 HydrophobicContact CB-CG2 4.02Å; V397-V399 PolarHBondContact O-N 3Å; V399-N425 PolarHBondContact O-N 3.24Å; V399-K428 HydrophobicContact CG1-CB 3.95Å; V399-L429 HydrophobicContact CB-CD2 4.02Å; V399-L429 HydrophobicContact CG1-CD2 4.16Å; V399-L429 HydrophobicContact CG2-CD2 3.75Å
400	G	91	Very high	80.2	Confident	10 Å²	10	66 Å²	66	10%	0.103	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	175.5	-177.4	0	0	0	0	0	112.5	I370 S423	I370-G400 PolarHBondContact N-O 3.49Å; I370-G400 PolarHBondContact O-N 3.19Å; G400-S423 CarbonylContact C-O 3.59Å; G400-S423 WeakPolarHBondContact CA-O 3.47Å
401	S	92.1	Very high	81.3	Confident	37 Å²	37	63 Å²	63	26%	0.259	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	155.7	175.2	62.2	0	0	0	0	110.9	Y368 S423	Y368-S401 WeakPolarHBondContact O-CA 3.36Å; S401-S423 PolarHBondContact N-O 3.5Å; S401-S423 WeakPolarHBondContact O-CB 3.38Å; S401-S423 PolarHBondContact O-N 3.12Å
402	Y	91.6	Very high	81.7	Confident	18 Å²	18	61.4 Å²	61.4	7%	0.071	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	142.8	-178.2	-170.2	-88.2	0	0	0	111.6	I145 D148 I367 Y368 L421 L422	I145-Y402 HydrophobicContact CB-CD2 4.45Å; I145-Y402 HydrophobicContact CD1-CD1 3.75Å; I145-Y402 HydrophobicContact CD1-CE1 4.22Å; I145-Y402 HydrophobicContact CD1-CG 4.05Å; I145-Y402 HydrophobicContact CG1-CD1 3.56Å; I145-Y402 HydrophobicContact CG1-CD2 4.09Å; I145-Y402 HydrophobicContact CG1-CE1 3.62Å; I145-Y402 HydrophobicContact CG1-CE2 4.14Å; I145-Y402 HydrophobicContact CG1-CG 3.78Å; I145-Y402 HydrophobicContact CG2-CD2 4.05Å; I145-Y402 HydrophobicContact CG2-CG 4.18Å; D148-Y402 HydrophobicContact CB-CE2 4.01Å; D148-Y402 WeakPolarHBondContact OD2-CE2 3.47Å; D148-Y402 PolarHBondContact OD2-OH 3.48Å; I367-Y402 WeakPolarHBondContact CA-O 3.35Å; Y368-Y402 HydrophobicContact CD2-CD1 4.46Å; Y368-Y402 PolarHBondContact N-O 3Å; Y368-Y402 PolarHBondContact O-N 3.05Å; Y402-L421 WeakPolarHBondContact CA-O 3.48Å; Y402-L421 HydrophobicContact CD2-CB 4.48Å; Y402-L421 HydrophobicContact CE1-CB 4.43Å; Y402-L421 HydrophobicContact CE1-CD1 4.46Å; Y402-L421 HydrophobicContact CE2-CB 4.12Å; Y402-L422 HydrophobicContact CD2-CB 4.13Å; Y402-L422 HydrophobicContact CD2-CD1 4.09Å; Y402-L422 HydrophobicContact CE2-CB 4.36Å
403	G	85.3	Confident	81.8	Confident	17 Å²	17	60.7 Å²	60.7	18%	0.175	33%	0.331	C	S	.	.	S	Bend	trans	105.8	-12.3	172.4	0	0	0	0	0	114.9	L421	G403-L421 PolarHBondContact N-O 3.24Å
404	V	83	Confident	81.1	Confident	72 Å²	72	58.3 Å²	58.3	44%	0.436	33%	0.33	S	S	.	.	S	Bend	trans	-96	128.1	168.3	-178.3	0	0	0	0	108.3	I367 Q406	I367-V404 HydrophobicContact CD1-CG2 4.12Å; I367-V404 HydrophobicContact CG1-CG2 4.34Å; V404-Q406 PolarHBondContact O-N 3.36Å
405	H	82.2	Confident	80.1	Confident	140 Å²	140	66.2 Å²	66.2	65%	0.648	37%	0.372	S	S	*	.			trans	-65.7	125	177.6	-175.8	13.4	0	0	0	110.7	S420 L421	H405-S420 CarbonylContact C-O 3.4Å; H405-S420 WeakPolarHBondContact CA-O 3.48Å; H405-S420 PolarHBondContact ND1-O 3.12Å; H405-L421 HydrophobicContact CB-CD2 4.35Å
406	Q	74.7	Confident	79	Confident	63 Å²	63	66.6 Å²	66.6	29%	0.294	37%	0.369	S	S	.	.			trans	-118.2	152.3	178.9	-62.8	-155.6	-1.3	0	0	112.3	V404 S420 S423	V404-Q406 PolarHBondContact O-N 3.36Å; Q406-S420 PolarHBondContact N-O 3.48Å; Q406-S423 VanDerWaalsContact CD-OG 3.24Å; Q406-S423 PolarHBondContact NE2-OG 2.97Å; Q406-S423 VanDerWaalsContact NE2-OG 3.16Å; Q406-S423 PolarHBondContact OE1-OG 2.72Å
407	P	75.4	Confident	78	Confident	116 Å²	116	69.8 Å²	69.8	75%	0.753	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-63.4	143.9	168.4	28.9	-35	0	0	0	109.9
408	T	71.8	Confident	77.1	Confident	63 Å²	63	68.3 Å²	68.3	39%	0.387	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-54.1	128.2	176.8	51.1	0	0	0	0	110.5	M410 H418 R447	T408-M410 PolarHBondContact O-N 2.91Å; T408-H418 HydrophobicContact CG2-CB 4.19Å; T408-R447 PolarHBondContact O-NH1 3.24Å; T408-R447 PolarHBondContact OG1-NH1 2.83Å
409	P	73.8	Confident	76.5	Confident	57 Å²	57	66.1 Å²	66.1	37%	0.37	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-55.9	138.6	-179.5	-26.7	34.8	0	0	0	111.6	E411 W412 H418 R447	P409-E411 PolarHBondContact O-N 3.3Å; P409-W412 WeakPolarHBondContact O-CB 3.41Å; P409-W412 PolarHBondContact O-N 2.98Å; P409-H418 VanDerWaalsContact CD-CD2 3.45Å; P409-H418 WeakPolarHBondContact CD-CD2 3.43Å; P409-R447 VanDerWaalsContact O-CZ 3.27Å; P409-R447 PolarHBondContact O-NH1 3.4Å; P409-R447 PolarHBondContact O-NH2 3.21Å
410	M	68.9	Low	75.8	Confident	119 Å²	119	68.6 Å²	68.6	59%	0.586	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.4	-179.5	-173.9	172.4	-76.6	0	0	111.6	T408 W412 C444	T408-M410 PolarHBondContact O-N 2.91Å; M410-W412 VanDerWaalsContact C-N 3.28Å; M410-W412 PolarHBondContact O-N 2.93Å; M410-C444 WeakPolarHBondContact CG-O 3.34Å; M410-C444 WeakPolarHBondContact O-CB 3.28Å; M410-C444 VanDerWaalsContact O-O 3.11Å
411	E	71.4	Confident	75.6	Confident	108 Å²	108	71 Å²	71	51%	0.505	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-13.6	-178.1	-56.9	-172.1	145.8	0	0	114.4	P409 I413 V443	P409-E411 PolarHBondContact O-N 3.3Å; E411-I413 PolarHBondContact O-N 3.39Å; E411-V443 HydrophobicContact CB-CG1 3.84Å; E411-V443 HydrophobicContact CG-CG1 3.83Å
412	W	70.7	Confident	75.4	Confident	52 Å²	52	69.4 Å²	69.4	20%	0.197	38%	0.383	C	S	.	.			trans	-76.7	121	-174.4	-174.7	-94.1	0	0	0	113.7	P409 M410 S414 E416 H418 R447	P409-W412 WeakPolarHBondContact O-CB 3.41Å; P409-W412 PolarHBondContact O-N 2.98Å; M410-W412 VanDerWaalsContact C-N 3.28Å; M410-W412 PolarHBondContact O-N 2.93Å; W412-S414 VanDerWaalsContact CZ2-CB 3.42Å; W412-E416 PolarHBondContact NE1-O 3.38Å; W412-H418 HydrophobicContact CD2-CB 3.98Å; W412-H418 AromaticContact CD2-ND1 3.8Å; W412-H418 AromaticContact CE3-ND1 3.7Å; W412-H418 HydrophobicContact CG-CB 3.95Å; W412-R447 PolarHBondContact O-NH2 3.49Å
413	I	67.3	Low	75.3	Confident	66 Å²	66	70 Å²	70	34%	0.338	39%	0.39	S	S	.	.			trans	-133	68.9	167.4	-53.1	166.5	0	0	0	108.6	E411 L442 C444 C453 T456	E411-I413 PolarHBondContact O-N 3.39Å; I413-L442 HydrophobicContact CD1-CB 3.95Å; I413-C444 HydrophobicContact CD1-CB 4Å; I413-C444 HydrophobicContact CG1-CB 3.76Å; I413-C453 HydrophobicContact CG1-CB 4.48Å; I413-T456 HydrophobicContact CD1-CG2 3.42Å; I413-T456 VanDerWaalsContact CD1-CG2 3.42Å; I413-T456 HydrophobicContact CG1-CG2 4.47Å
414	S	66.2	Low	75.4	Confident	54 Å²	54	70.7 Å²	70.7	38%	0.378	39%	0.39	S	S	.	.			trans	-100.3	151.8	151.5	-168.8	0	0	0	0	107.9	W412 E416	W412-S414 VanDerWaalsContact CZ2-CB 3.42Å; S414-E416 PolarHBondContact O-N 3.45Å; S414-E416 PolarHBondContact OG-N 2.9Å
415	D	63.1	Low	75.7	Confident	173 Å²	173	70.6 Å²	70.6	93%	0.925	39%	0.387	S	S	*	.	S	Bend	trans	-66.4	-23.4	164.5	-61.9	-50.4	0	0	0	110.6
416	E	65.1	Low	75.8	Confident	72 Å²	72	66.1 Å²	66.1	34%	0.336	37%	0.368	S	S	.	.	S	Bend	trans	-70.6	138.1	169.6	-63.7	-172.1	-178.5	0	0	112.3	W412 S414 H418	W412-E416 PolarHBondContact NE1-O 3.38Å; S414-E416 PolarHBondContact O-N 3.45Å; S414-E416 PolarHBondContact OG-N 2.9Å; E416-H418 PolarHBondContact O-N 3.09Å
417	P	68.2	Low	76.4	Confident	119 Å²	119	66.6 Å²	66.6	77%	0.773	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-66.6	125	174.9	27.9	-33.8	0	0	0	111
418	H	72.3	Confident	77	Confident	16 Å²	16	66.2 Å²	66.2	7%	0.074	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-55.8	134.6	176.2	177.2	88	0	0	0	111	T408 P409 W412 E416 S420 L422	T408-H418 HydrophobicContact CG2-CB 4.19Å; P409-H418 VanDerWaalsContact CD-CD2 3.45Å; P409-H418 WeakPolarHBondContact CD-CD2 3.43Å; W412-H418 HydrophobicContact CD2-CB 3.98Å; W412-H418 AromaticContact CD2-ND1 3.8Å; W412-H418 AromaticContact CE3-ND1 3.7Å; W412-H418 HydrophobicContact CG-CB 3.95Å; E416-H418 PolarHBondContact O-N 3.09Å; H418-S420 PolarHBondContact O-N 3.46Å; H418-L422 PolarHBondContact NE2-O 3.44Å; H418-L422 VanDerWaalsContact NE2-O 3.14Å
419	P	79.2	Confident	77.8	Confident	12 Å²	12	63.5 Å²	63.5	8%	0.078	35%	0.347	C	S	.	.			trans	-56.7	109.4	179.3	21.5	-33.7	0	0	0	111.9	D148 A152 L421 L422	D148-P419 HydrophobicContact CB-CB 3.76Å; D148-P419 HydrophobicContact CB-CG 4.15Å; A152-P419 HydrophobicContact CB-CG 4.49Å; P419-L421 PolarHBondContact O-N 3.03Å; P419-L421 VanDerWaalsContact O-N 3.1Å; P419-L422 HydrophobicContact CB-CB 4.09Å; P419-L422 HydrophobicContact CG-CB 4Å; P419-L422 HydrophobicContact CG-CD2 3.84Å; P419-L422 PolarHBondContact O-N 2.99Å
420	S	79.3	Confident	78.6	Confident	57 Å²	57	62.3 Å²	62.3	40%	0.399	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-12.4	-164.7	67.1	0	0	0	0	115.3	H405 Q406 H418	H405-S420 CarbonylContact C-O 3.4Å; H405-S420 WeakPolarHBondContact CA-O 3.48Å; H405-S420 PolarHBondContact ND1-O 3.12Å; Q406-S420 PolarHBondContact N-O 3.48Å; H418-S420 PolarHBondContact O-N 3.46Å
421	L	85.8	Confident	79.7	Confident	61 Å²	61	56.8 Å²	56.8	32%	0.319	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-7.1	176.5	-61.7	177.4	0	0	0	113.4	Y402 G403 H405 P419	Y402-L421 WeakPolarHBondContact CA-O 3.48Å; Y402-L421 HydrophobicContact CD2-CB 4.48Å; Y402-L421 HydrophobicContact CE1-CB 4.43Å; Y402-L421 HydrophobicContact CE1-CD1 4.46Å; Y402-L421 HydrophobicContact CE2-CB 4.12Å; G403-L421 PolarHBondContact N-O 3.24Å; H405-L421 HydrophobicContact CB-CD2 4.35Å; P419-L421 PolarHBondContact O-N 3.03Å; P419-L421 VanDerWaalsContact O-N 3.1Å
422	L	88.2	Confident	80.5	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	119.4	-173.3	176.9	64.9	0	0	0	111.8	D148 L149 A152 I370 Y402 H418 P419	D148-L422 HydrophobicContact CB-CD2 4.3Å; D148-L422 WeakPolarHBondContact O-CD2 3.37Å; L149-L422 HydrophobicContact CD2-CD1 4.09Å; L149-L422 HydrophobicContact CD2-CD2 4.23Å; A152-L422 HydrophobicContact CB-CD2 3.6Å; I370-L422 HydrophobicContact CD1-CD1 3.33Å; Y402-L422 HydrophobicContact CD2-CB 4.13Å; Y402-L422 HydrophobicContact CD2-CD1 4.09Å; Y402-L422 HydrophobicContact CE2-CB 4.36Å; H418-L422 PolarHBondContact NE2-O 3.44Å; H418-L422 VanDerWaalsContact NE2-O 3.14Å; P419-L422 HydrophobicContact CB-CB 4.09Å; P419-L422 HydrophobicContact CG-CB 4Å; P419-L422 HydrophobicContact CG-CD2 3.84Å; P419-L422 PolarHBondContact O-N 2.99Å
423	S	89.3	Confident	81.1	Confident	31 Å²	31	51.6 Å²	51.6	22%	0.217	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.7	166.5	-156.8	0	0	0	0	110	G400 S401 Q406	G400-S423 CarbonylContact C-O 3.59Å; G400-S423 WeakPolarHBondContact CA-O 3.47Å; S401-S423 PolarHBondContact N-O 3.5Å; S401-S423 WeakPolarHBondContact O-CB 3.38Å; S401-S423 PolarHBondContact O-N 3.12Å; Q406-S423 VanDerWaalsContact CD-OG 3.24Å; Q406-S423 PolarHBondContact NE2-OG 2.97Å; Q406-S423 VanDerWaalsContact NE2-OG 3.16Å; Q406-S423 PolarHBondContact OE1-OG 2.72Å
424	I	87.2	Confident	81.9	Confident	32 Å²	32	52.9 Å²	52.9	16%	0.164	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	133.5	172.4	-166.9	163.5	0	0	0	111.1	L149 F153 L426 L429	L149-I424 HydrophobicContact CD2-CD1 3.79Å; F153-I424 HydrophobicContact CE1-CD1 3.89Å; F153-I424 HydrophobicContact CZ-CD1 3.65Å; I424-L426 HydrophobicContact CG2-CD2 4.37Å; I424-L429 HydrophobicContact CD1-CD1 4.07Å; I424-L429 HydrophobicContact CG1-CD1 4.43Å
425	N	88.6	Confident	82.8	Confident	70 Å²	70	51.2 Å²	51.2	37%	0.374	30%	0.298	S	S	.	.			trans	-100.8	94.5	176.2	-172.2	-25.6	0	0	0	110.2	V399 S427 K428	V399-N425 PolarHBondContact O-N 3.24Å; N425-S427 PolarHBondContact O-N 2.98Å; N425-S427 VanDerWaalsContact O-N 3.12Å; N425-S427 WeakPolarHBondContact OD1-CB 3.38Å; N425-S427 PolarHBondContact OD1-N 3.48Å; N425-S427 VanDerWaalsContact OD1-N 3.15Å; N425-S427 PolarHBondContact OD1-OG 2.99Å; N425-K428 HydrophobicContact CB-CD 4.35Å; N425-K428 HydrophobicContact CB-CG 4.35Å; N425-K428 PolarHBondContact O-N 3.48Å
426	L	85.8	Confident	83.9	Confident	46 Å²	46	47.8 Å²	47.8	24%	0.241	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-57.1	-27.3	-178.2	-61.4	175.4	0	0	0	113.6	F153 I424 K428 L429 H462	F153-L426 HydrophobicContact CD1-CD2 4.25Å; F153-L426 HydrophobicContact CE1-CD2 3.79Å; I424-L426 HydrophobicContact CG2-CD2 4.37Å; L426-K428 PolarHBondContact O-N 3.46Å; L426-L429 HydrophobicContact CD2-CD1 3.76Å; L426-L429 PolarHBondContact O-N 2.98Å; L426-H462 HydrophobicContact CB-CB 4.19Å; L426-H462 WeakPolarHBondContact CD1-O 3.31Å; L426-H462 WeakPolarHBondContact O-CB 3.46Å
427	S	86	Confident	84.9	Confident	72 Å²	72	46.1 Å²	46.1	50%	0.503	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-71.6	-17	178.6	74.2	0	0	0	0	114.3	N425	N425-S427 PolarHBondContact O-N 2.98Å; N425-S427 VanDerWaalsContact O-N 3.12Å; N425-S427 WeakPolarHBondContact OD1-CB 3.38Å; N425-S427 PolarHBondContact OD1-N 3.48Å; N425-S427 VanDerWaalsContact OD1-N 3.15Å; N425-S427 PolarHBondContact OD1-OG 2.99Å
428	K	88.3	Confident	85.8	Confident	108 Å²	108	45.6 Å²	45.6	47%	0.47	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-92.5	-9.6	175.8	-66.4	-173.6	176	-174.8	0	113.5	Q374 V399 N425 L426	Q374-K428 PolarHBondContact NE2-O 3.02Å; V399-K428 HydrophobicContact CG1-CB 3.95Å; N425-K428 HydrophobicContact CB-CD 4.35Å; N425-K428 HydrophobicContact CB-CG 4.35Å; N425-K428 PolarHBondContact O-N 3.48Å; L426-K428 PolarHBondContact O-N 3.46Å
429	L	89.7	Confident	86.3	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.037	27%	0.266	C	S	.	.			trans	-76.7	131.8	-176.6	-69.3	175.4	0	0	0	111.5	F153 I266 N372 V399 I424 L426 W431	F153-L429 HydrophobicContact CE1-CD1 3.97Å; F153-L429 HydrophobicContact CZ-CD1 4.16Å; I266-L429 HydrophobicContact CD1-CD1 4.44Å; I266-L429 HydrophobicContact CD1-CD2 3.89Å; I266-L429 HydrophobicContact CG1-CD2 4.23Å; N372-L429 HydrophobicContact CB-CD2 4.25Å; V399-L429 HydrophobicContact CB-CD2 4.02Å; V399-L429 HydrophobicContact CG1-CD2 4.16Å; V399-L429 HydrophobicContact CG2-CD2 3.75Å; I424-L429 HydrophobicContact CD1-CD1 4.07Å; I424-L429 HydrophobicContact CG1-CD1 4.43Å; L426-L429 HydrophobicContact CD2-CD1 3.76Å; L426-L429 PolarHBondContact O-N 2.98Å; L429-W431 HydrophobicContact CD1-CZ2 3.9Å
430	I	90.6	Very high	86.4	Confident	31 Å²	31	55 Å²	55	16%	0.159	30%	0.299	C	S	.	.			trans	-112.5	139.1	165.3	-61.5	177	0	0	0	106.9	G264 N372 Q374 N434	G264-I430 CarbonylContact C-O 3.23Å; G264-I430 WeakPolarHBondContact CA-O 3.32Å; N372-I430 PolarHBondContact ND2-O 3.33Å; N372-I430 PolarHBondContact OD1-N 3.12Å; N372-I430 PolarHBondContact OD1-O 3.26Å; Q374-I430 HydrophobicContact CG-CD1 4.12Å; I430-N434 WeakPolarHBondContact CG2-OD1 3.34Å
431	W	90.9	Very high	86.3	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.015	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-103.4	162.3	176.8	-60.5	97.8	0	0	0	111	F153 W155 A248 I266 L429 N434 S435 A463 A464 P465	F153-W431 HydrophobicContact CE1-CH2 4.36Å; F153-W431 HydrophobicContact CE1-CZ2 4.45Å; F153-W431 HydrophobicContact CE2-CH2 4.14Å; F153-W431 HydrophobicContact CZ-CH2 4.01Å; F153-W431 HydrophobicContact CZ-CZ2 4.48Å; W155-W431 HydrophobicContact CH2-CH2 4.13Å; W155-W431 HydrophobicContact CH2-CZ3 4.08Å; W155-W431 AromaticContact CZ2-CH2 3.89Å; W155-W431 HydrophobicContact CZ2-CH2 3.89Å; W155-W431 AromaticContact CZ2-CZ3 4Å; W155-W431 HydrophobicContact CZ2-CZ3 4Å; A248-W431 HydrophobicContact CB-CE3 3.97Å; A248-W431 HydrophobicContact CB-CZ3 3.77Å; I266-W431 HydrophobicContact CD1-CH2 3.47Å; I266-W431 VanDerWaalsContact CD1-CH2 3.47Å; I266-W431 HydrophobicContact CD1-CZ2 4.25Å; I266-W431 HydrophobicContact CD1-CZ3 3.64Å; I266-W431 HydrophobicContact CG1-CZ3 4.42Å; L429-W431 HydrophobicContact CD1-CZ2 3.9Å; W431-N434 WeakPolarHBondContact O-CA 3.29Å; W431-N434 PolarHBondContact O-N 3.05Å; W431-N434 VanDerWaalsContact O-N 3.11Å; W431-S435 WeakPolarHBondContact CB-O 3.19Å; W431-S435 PolarHBondContact N-O 2.86Å; W431-S435 PolarHBondContact O-N 3.11Å; W431-S435 VanDerWaalsContact O-N 3.09Å; W431-A463 PolarHBondContact NE1-O 2.88Å; W431-A464 HydrophobicContact CH2-CB 3.69Å; W431-A464 VanDerWaalsContact CZ2-CA 3.42Å; W431-A464 HydrophobicContact CZ2-CB 3.46Å; W431-A464 VanDerWaalsContact CZ2-CB 3.46Å; W431-P465 HydrophobicContact CB-CG 4.3Å; W431-P465 HydrophobicContact CD2-CG 3.79Å; W431-P465 HydrophobicContact CE3-CG 4Å; W431-P465 HydrophobicContact CG-CG 3.89Å
432	P	89	Confident	86.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-45	149	171.8	-30.6	37	0	0	0	113.3	L243 A245 W247 G264 N434 S435	L243-P432 WeakPolarHBondContact O-CB 3.49Å; A245-P432 WeakPolarHBondContact CA-O 3.35Å; W247-P432 VanDerWaalsContact O-CD 3.27Å; W247-P432 WeakPolarHBondContact O-CD 3.37Å; W247-P432 WeakPolarHBondContact O-CG 3.38Å; G264-P432 WeakPolarHBondContact O-CD 3.43Å; P432-N434 VanDerWaalsContact C-N 3.26Å; P432-N434 PolarHBondContact O-N 2.97Å; P432-S435 PolarHBondContact O-OG 2.9Å
433	G	83	Confident	85.9	Confident	51 Å²	51	57.8 Å²	57.8	53%	0.526	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	69.4	15	-166.8	0	0	0	0	0	115.5	L243 S435	L243-G433 PolarHBondContact O-N 2.68Å; L243-G433 VanDerWaalsContact O-N 3.13Å; G433-S435 PolarHBondContact O-N 3.29Å
434	N	84.6	Confident	85.6	Confident	92 Å²	92	56.4 Å²	56.4	49%	0.492	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	57.1	36.5	-173.8	-161	33.3	0	0	0	112.7	I430 W431 P432	I430-N434 WeakPolarHBondContact CG2-OD1 3.34Å; W431-N434 WeakPolarHBondContact O-CA 3.29Å; W431-N434 PolarHBondContact O-N 3.05Å; W431-N434 VanDerWaalsContact O-N 3.11Å; P432-N434 VanDerWaalsContact C-N 3.26Å; P432-N434 PolarHBondContact O-N 2.97Å
435	S	83.5	Confident	85.5	Confident	20 Å²	20	57.5 Å²	57.5	14%	0.14	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-93.9	136.2	-171.5	61.2	0	0	0	0	112	W431 P432 G433	W431-S435 WeakPolarHBondContact CB-O 3.19Å; W431-S435 PolarHBondContact N-O 2.86Å; W431-S435 PolarHBondContact O-N 3.11Å; W431-S435 VanDerWaalsContact O-N 3.09Å; P432-S435 PolarHBondContact O-OG 2.9Å; G433-S435 PolarHBondContact O-N 3.29Å
436	I	86.6	Confident	85.3	Confident	101 Å²	101	59 Å²	59	52%	0.518	31%	0.307	S	S	.	.			trans	-113.2	98	176.2	-56.4	177.6	0	0	0	107.7
437	V	85.8	Confident	85	Confident	36 Å²	36	59.7 Å²	59.7	22%	0.218	31%	0.306	C	S	.	.			trans	-80.5	129.4	-179.7	177.1	0	0	0	0	109.8	A463 P465	V437-A463 WeakPolarHBondContact CB-O 3.43Å; V437-A463 PolarHBondContact O-N 2.83Å; V437-P465 HydrophobicContact CG2-CG 4.22Å
438	K	87.6	Confident	84.6	Confident	108 Å²	108	58 Å²	58	47%	0.47	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.9	173.6	-64.8	-179.9	177.9	179.1	0	110	L460 V461 H462	K438-L460 HydrophobicContact CB-CD1 3.82Å; K438-L460 HydrophobicContact CB-CD2 4.46Å; K438-L460 HydrophobicContact CB-CG 3.95Å; K438-L460 HydrophobicContact CD-CD2 4.33Å; K438-L460 HydrophobicContact CD-CG 4.39Å; K438-V461 CarbonylContact C-O 3.54Å; K438-V461 WeakPolarHBondContact CA-O 3.23Å; K438-H462 WeakPolarHBondContact CE-NE2 3.4Å
439	R	82.7	Confident	84.2	Confident	64 Å²	64	61.6 Å²	61.6	24%	0.242	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	148.3	176	-70	-166.2	-173.3	103.9	31.1	111.3	Q441 L460 V461 A463 A464 P465	R439-Q441 HydrophobicContact CB-CG 4.21Å; R439-Q441 PolarHBondContact O-N 3.45Å; R439-L460 WeakPolarHBondContact O-CA 3.48Å; R439-V461 PolarHBondContact N-O 3.22Å; R439-V461 PolarHBondContact O-N 3Å; R439-A463 HydrophobicContact CB-CB 4.18Å; R439-A463 HydrophobicContact CG-CB 4.08Å; R439-A464 PolarHBondContact NH1-O 3.11Å; R439-A464 PolarHBondContact NH2-O 3.16Å; R439-P465 VanDerWaalsContact NH2-C 3.25Å
440	Q	82.7	Confident	83.4	Confident	163 Å²	163	66.2 Å²	66.2	76%	0.762	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	115	164.3	-69.2	-175.2	-8.9	0	0	107.9	R459 L460	Q440-R459 WeakPolarHBondContact CA-O 3.31Å; Q440-L460 HydrophobicContact CG-CD1 4.18Å
441	Q	76.7	Confident	82.5	Confident	85 Å²	85	66.6 Å²	66.6	40%	0.397	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.9	176.9	-73.2	177	-39.5	0	0	108.9	R439 K458 R459	R439-Q441 HydrophobicContact CB-CG 4.21Å; R439-Q441 PolarHBondContact O-N 3.45Å; Q441-K458 WeakPolarHBondContact O-CA 3.29Å; Q441-R459 PolarHBondContact N-O 3.27Å; Q441-R459 PolarHBondContact O-N 3.48Å
442	L	82.3	Confident	81.8	Confident	88 Å²	88	73.4 Å²	73.4	46%	0.461	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	133.7	163.5	-72.3	163.7	0	0	0	107.5	I413 K458	I413-L442 HydrophobicContact CD1-CB 3.95Å; L442-K458 HydrophobicContact CD2-CG 3.52Å; L442-K458 HydrophobicContact CG-CG 4.21Å
443	V	82	Confident	81.4	Confident	4 Å²	4	75.6 Å²	75.6	2%	0.024	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.6	179.5	-177.4	0	0	0	0	108.4	E411 T456 E457 R459 V461	E411-V443 HydrophobicContact CB-CG1 3.84Å; E411-V443 HydrophobicContact CG-CG1 3.83Å; V443-T456 CarbonylContact O-C 3.57Å; V443-T456 WeakPolarHBondContact O-CA 3.1Å; V443-E457 PolarHBondContact N-O 2.89Å; V443-E457 PolarHBondContact O-N 2.88Å; V443-R459 HydrophobicContact CG2-CB 3.86Å; V443-R459 HydrophobicContact CG2-CG 4.37Å; V443-V461 HydrophobicContact CG2-CG2 3.43Å; V443-V461 VanDerWaalsContact CG2-CG2 3.43Å
444	C	84.6	Confident	81.4	Confident	3 Å²	3	80.2 Å²	80.2	2%	0.02	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	131.1	177.2	-162.2	0	0	0	0	109.8	M410 I413 Q446 C453	M410-C444 WeakPolarHBondContact CG-O 3.34Å; M410-C444 WeakPolarHBondContact O-CB 3.28Å; M410-C444 VanDerWaalsContact O-O 3.11Å; I413-C444 HydrophobicContact CD1-CB 4Å; I413-C444 HydrophobicContact CG1-CB 3.76Å; C444-Q446 PolarHBondContact SG-O 3.26Å; C444-C453 VanDerWaalsContact CA-SG 3.57Å; C444-C453 HydrophobicContact CB-CB 3.93Å; C444-C453 WeakPolarHBondContact CB-SG 3.45Å; C444-C453 WeakPolarHBondContact SG-CA 3.26Å; C444-C453 WeakPolarHBondContact SG-CB 3.44Å; C444-C453 CovalentContact SG-SG 2.02Å; C444-C453 PolarHBondContact SG-SG 2.76Å
445	I	84.3	Confident	81.4	Confident	54 Å²	54	81.2 Å²	81.2	28%	0.277	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-33.3	174.6	-51.6	160.7	0	0	0	110.5	K455 E457	I445-K455 HydrophobicContact CD1-CD 4.44Å; I445-K455 HydrophobicContact CD1-CG 4.39Å; I445-K455 PolarHBondContact N-O 2.62Å; I445-E457 HydrophobicContact CD1-CB 3.39Å; I445-E457 HydrophobicContact CD1-CG 4.31Å; I445-E457 HydrophobicContact CG1-CB 3.98Å
446	Q	83.8	Confident	81.5	Confident	102 Å²	102	83.6 Å²	83.6	48%	0.477	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	119	-174.4	-64.5	177.7	-41.5	0	0	109.2	C444 Q454 K455	C444-Q446 PolarHBondContact SG-O 3.26Å; Q446-Q454 WeakPolarHBondContact O-CB 3.4Å; Q446-Q454 PolarHBondContact O-N 2.94Å; Q446-K455 HydrophobicContact CB-CB 4.13Å; Q446-K455 PolarHBondContact O-N 3.26Å
447	R	79.6	Confident	81.5	Confident	60 Å²	60	82.8 Å²	82.8	23%	0.226	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	146.8	166.7	-80.2	-169.8	174.5	118	11.7	110.5	T408 P409 W412 G451 K452	T408-R447 PolarHBondContact O-NH1 3.24Å; T408-R447 PolarHBondContact OG1-NH1 2.83Å; P409-R447 VanDerWaalsContact O-CZ 3.27Å; P409-R447 PolarHBondContact O-NH1 3.4Å; P409-R447 PolarHBondContact O-NH2 3.21Å; W412-R447 PolarHBondContact O-NH2 3.49Å; R447-G451 WeakPolarHBondContact CD-O 3.47Å; R447-G451 PolarHBondContact NE-O 3.19Å; R447-K452 CarbonylContact C-O 3.56Å; R447-K452 VanDerWaalsContact CA-O 3.24Å; R447-K452 WeakPolarHBondContact CA-O 3.44Å
448	A	78.6	Confident	81.5	Confident	37 Å²	37	88.9 Å²	88.9	31%	0.306	44%	0.441	S	S	.	.			trans	-80.8	170	167	0	0	0	0	0	110.9	D450 G451 K452	A448-D450 VanDerWaalsContact CB-OD1 3.28Å; A448-D450 WeakPolarHBondContact CB-OD1 3.09Å; A448-D450 PolarHBondContact O-N 3.05Å; A448-D450 VanDerWaalsContact O-N 3.15Å; A448-G451 PolarHBondContact O-N 2.97Å; A448-K452 PolarHBondContact N-O 3.14Å
449	N	79.6	Confident	81.3	Confident	183 Å²	183	89.4 Å²	89.4	98%	0.979	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-15.7	-177.1	-67.5	-10.3	0	0	0	113.8	G451	N449-G451 VanDerWaalsContact C-N 3.28Å
450	D	73.1	Confident	81.5	Confident	104 Å²	104	91.7 Å²	91.7	56%	0.556	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	0.2	173.8	68.2	-14.7	0	0	0	113.2	A448 K452	A448-D450 VanDerWaalsContact CB-OD1 3.28Å; A448-D450 WeakPolarHBondContact CB-OD1 3.09Å; A448-D450 PolarHBondContact O-N 3.05Å; A448-D450 VanDerWaalsContact O-N 3.15Å; D450-K452 VanDerWaalsContact C-N 3.29Å; D450-K452 PolarHBondContact O-N 3.36Å; D450-K452 WeakPolarHBondContact OD1-CB 3.44Å; D450-K452 PolarHBondContact OD1-N 3.32Å; D450-K452 VanDerWaalsContact OD2-CD 3.31Å; D450-K452 WeakPolarHBondContact OD2-CD 3.34Å; D450-K452 WeakPolarHBondContact OD2-CG 3.29Å
451	G	71	Confident	81.6	Confident	39 Å²	39	84.8 Å²	84.8	40%	0.402	43%	0.425	S	S	.	.	S	Bend	trans	83	-5.1	-177.6	0	0	0	0	0	114.7	R447 A448 N449	R447-G451 WeakPolarHBondContact CD-O 3.47Å; R447-G451 PolarHBondContact NE-O 3.19Å; A448-G451 PolarHBondContact O-N 2.97Å; N449-G451 VanDerWaalsContact C-N 3.28Å
452	K	76	Confident	82	Confident	148 Å²	148	83.1 Å²	83.1	64%	0.643	42%	0.417	S	S	*	.			trans	-75.2	147.8	178.1	-65	-172.9	-175.3	179.1	0	111.2	R447 A448 D450 Q454	R447-K452 CarbonylContact C-O 3.56Å; R447-K452 VanDerWaalsContact CA-O 3.24Å; R447-K452 WeakPolarHBondContact CA-O 3.44Å; A448-K452 PolarHBondContact N-O 3.14Å; D450-K452 VanDerWaalsContact C-N 3.29Å; D450-K452 PolarHBondContact O-N 3.36Å; D450-K452 WeakPolarHBondContact OD1-CB 3.44Å; D450-K452 PolarHBondContact OD1-N 3.32Å; D450-K452 VanDerWaalsContact OD2-CD 3.31Å; D450-K452 WeakPolarHBondContact OD2-CD 3.34Å; D450-K452 WeakPolarHBondContact OD2-CG 3.29Å; K452-Q454 PolarHBondContact O-N 3.49Å
453	C	80.7	Confident	82.1	Confident	45 Å²	45	79.2 Å²	79.2	30%	0.304	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	119.7	174	-171.5	0	0	0	0	110.9	I413 C444 K455	I413-C453 HydrophobicContact CG1-CB 4.48Å; C444-C453 VanDerWaalsContact CA-SG 3.57Å; C444-C453 HydrophobicContact CB-CB 3.93Å; C444-C453 WeakPolarHBondContact CB-SG 3.45Å; C444-C453 WeakPolarHBondContact SG-CA 3.26Å; C444-C453 WeakPolarHBondContact SG-CB 3.44Å; C444-C453 CovalentContact SG-SG 2.02Å; C444-C453 PolarHBondContact SG-SG 2.76Å; C453-K455 PolarHBondContact SG-O 2.98Å; C453-K455 VanDerWaalsContact SG-O 3.37Å
454	Q	82.9	Confident	82.4	Confident	148 Å²	148	79.2 Å²	79.2	69%	0.692	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	-30.2	176.9	-170.2	-179.4	10	0	0	112.1	Q446 K452	Q446-Q454 WeakPolarHBondContact O-CB 3.4Å; Q446-Q454 PolarHBondContact O-N 2.94Å; K452-Q454 PolarHBondContact O-N 3.49Å
455	K	85.4	Confident	82.5	Confident	114 Å²	114	79.3 Å²	79.3	50%	0.496	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	123.7	-178	-170.6	176.7	-179.1	177.9	0	112.4	I445 Q446 C453	I445-K455 HydrophobicContact CD1-CD 4.44Å; I445-K455 HydrophobicContact CD1-CG 4.39Å; I445-K455 PolarHBondContact N-O 2.62Å; Q446-K455 HydrophobicContact CB-CB 4.13Å; Q446-K455 PolarHBondContact O-N 3.26Å; C453-K455 PolarHBondContact SG-O 2.98Å; C453-K455 VanDerWaalsContact SG-O 3.37Å
456	T	85.8	Confident	82.5	Confident	69 Å²	69	81 Å²	81	42%	0.423	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	153.6	178.9	66.8	0	0	0	0	111.3	I413 V443	I413-T456 HydrophobicContact CD1-CG2 3.42Å; I413-T456 VanDerWaalsContact CD1-CG2 3.42Å; I413-T456 HydrophobicContact CG1-CG2 4.47Å; V443-T456 CarbonylContact O-C 3.57Å; V443-T456 WeakPolarHBondContact O-CA 3.1Å
457	E	87	Confident	82.5	Confident	84 Å²	84	76.4 Å²	76.4	39%	0.393	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	141.3	170.9	174.6	176.5	-123.9	0	0	110.1	V443 I445 R459	V443-E457 PolarHBondContact N-O 2.89Å; V443-E457 PolarHBondContact O-N 2.88Å; I445-E457 HydrophobicContact CD1-CB 3.39Å; I445-E457 HydrophobicContact CD1-CG 4.31Å; I445-E457 HydrophobicContact CG1-CB 3.98Å; E457-R459 HydrophobicContact CG-CG 4.19Å; E457-R459 PolarHBondContact O-N 2.65Å; E457-R459 IonicContact OE2-CZ 2.64Å; E457-R459 IonicContact OE2-NE 2.71Å; E457-R459 PolarHBondContact OE2-NE 2.84Å; E457-R459 IonicContact OE2-NH2 3.69Å; E457-R459 PolarHBondContact OE2-NH2 3.27Å
458	K	85.3	Confident	82.5	Confident	164 Å²	164	77.6 Å²	77.6	71%	0.713	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	115.1	175.5	-67.3	-175.7	179.2	-177.3	0	109.6	Q441 L442	Q441-K458 WeakPolarHBondContact O-CA 3.29Å; L442-K458 HydrophobicContact CD2-CG 3.52Å; L442-K458 HydrophobicContact CG-CG 4.21Å
459	R	84.1	Confident	82.7	Confident	119 Å²	119	80.1 Å²	80.1	45%	0.449	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	156.5	175.8	-64	-174.4	176.3	-176.9	-0.3	111.3	Q440 Q441 V443 E457 V461	Q440-R459 WeakPolarHBondContact CA-O 3.31Å; Q441-R459 PolarHBondContact N-O 3.27Å; Q441-R459 PolarHBondContact O-N 3.48Å; V443-R459 HydrophobicContact CG2-CB 3.86Å; V443-R459 HydrophobicContact CG2-CG 4.37Å; E457-R459 HydrophobicContact CG-CG 4.19Å; E457-R459 PolarHBondContact O-N 2.65Å; E457-R459 IonicContact OE2-CZ 2.64Å; E457-R459 IonicContact OE2-NE 2.71Å; E457-R459 PolarHBondContact OE2-NE 2.84Å; E457-R459 IonicContact OE2-NH2 3.69Å; E457-R459 PolarHBondContact OE2-NH2 3.27Å; R459-V461 HydrophobicContact CB-CG2 4.17Å; R459-V461 PolarHBondContact O-N 3.06Å
460	L	85.7	Confident	82.6	Confident	113 Å²	113	73.5 Å²	73.5	59%	0.592	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	99.6	173.1	-175.8	68.7	0	0	0	109.1	K438 R439 Q440	K438-L460 HydrophobicContact CB-CD1 3.82Å; K438-L460 HydrophobicContact CB-CD2 4.46Å; K438-L460 HydrophobicContact CB-CG 3.95Å; K438-L460 HydrophobicContact CD-CD2 4.33Å; K438-L460 HydrophobicContact CD-CG 4.39Å; R439-L460 WeakPolarHBondContact O-CA 3.48Å; Q440-L460 HydrophobicContact CG-CD1 4.18Å
461	V	84.3	Confident	82.9	Confident	17 Å²	17	71.4 Å²	71.4	10%	0.103	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	154.1	-174.4	-168.1	0	0	0	0	110.3	K438 R439 V443 R459	K438-V461 CarbonylContact C-O 3.54Å; K438-V461 WeakPolarHBondContact CA-O 3.23Å; R439-V461 PolarHBondContact N-O 3.22Å; R439-V461 PolarHBondContact O-N 3Å; V443-V461 HydrophobicContact CG2-CG2 3.43Å; V443-V461 VanDerWaalsContact CG2-CG2 3.43Å; R459-V461 HydrophobicContact CB-CG2 4.17Å; R459-V461 PolarHBondContact O-N 3.06Å
462	H	85.5	Confident	83.5	Confident	50 Å²	50	74.3 Å²	74.3	23%	0.231	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	131.2	169.3	-63.7	90.5	0	0	0	109.6	L426 K438	L426-H462 HydrophobicContact CB-CB 4.19Å; L426-H462 WeakPolarHBondContact CD1-O 3.31Å; L426-H462 WeakPolarHBondContact O-CB 3.46Å; K438-H462 WeakPolarHBondContact CE-NE2 3.4Å
463	A	85.2	Confident	84.1	Confident	7 Å²	7	70.9 Å²	70.9	6%	0.058	34%	0.342	C	S	.	.			trans	-137.4	161.6	-174.7	0	0	0	0	0	111.1	W431 V437 R439	W431-A463 PolarHBondContact NE1-O 2.88Å; V437-A463 WeakPolarHBondContact CB-O 3.43Å; V437-A463 PolarHBondContact O-N 2.83Å; R439-A463 HydrophobicContact CB-CB 4.18Å; R439-A463 HydrophobicContact CG-CB 4.08Å
464	A	87	Confident	84.6	Confident	3 Å²	3	68.8 Å²	68.8	3%	0.025	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-74.8	152.5	170.1	0	0	0	0	0	111.8	F153 W155 W431 R439	F153-A464 HydrophobicContact CB-CB 3.78Å; F153-A464 HydrophobicContact CD1-CB 3.63Å; F153-A464 HydrophobicContact CD2-CB 4.41Å; F153-A464 HydrophobicContact CE1-CB 4.29Å; F153-A464 HydrophobicContact CG-CB 3.7Å; W155-A464 HydrophobicContact CZ2-CB 3.81Å; W431-A464 HydrophobicContact CH2-CB 3.69Å; W431-A464 VanDerWaalsContact CZ2-CA 3.42Å; W431-A464 HydrophobicContact CZ2-CB 3.46Å; W431-A464 VanDerWaalsContact CZ2-CB 3.46Å; R439-A464 PolarHBondContact NH1-O 3.11Å; R439-A464 PolarHBondContact NH2-O 3.16Å
465	P	86.9	Confident	85.1	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.032	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-48.3	156.7	170	-29	34.5	0	0	0	113.7	W155 E246 A248 W431 V437 R439	W155-P465 PolarHBondContact NE1-O 3.12Å; E246-P465 WeakPolarHBondContact O-CB 3.12Å; A248-P465 HydrophobicContact CB-CG 4.32Å; W431-P465 HydrophobicContact CB-CG 4.3Å; W431-P465 HydrophobicContact CD2-CG 3.79Å; W431-P465 HydrophobicContact CE3-CG 4Å; W431-P465 HydrophobicContact CG-CG 3.89Å; V437-P465 HydrophobicContact CG2-CG 4.22Å; R439-P465 VanDerWaalsContact NH2-C 3.25Å
466	I	85	Confident	85.5	Confident	90 Å²	90	61 Å²	61	46%	0.462	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-72.2	134	175.9	-53.3	-177.9	0	0	0	106.8	F468	I466-F468 HydrophobicContact CG2-CD1 3.57Å; I466-F468 HydrophobicContact CG2-CE1 3.54Å; I466-F468 HydrophobicContact CG2-CG 4.27Å; I466-F468 HydrophobicContact CG2-CZ 4.24Å; I466-F468 WeakPolarHBondContact CG2-O 3.27Å; I466-F468 PolarHBondContact O-N 3.22Å
467	S	83.1	Confident	86	Confident	5 Å²	5	57.7 Å²	57.7	4%	0.035	27%	0.272	C	S	.	.	S	Bend	trans	-64.9	-23.3	-176.3	47.5	0	0	0	0	114.2	R156 E157 T218 R219	R156-S467 PolarHBondContact N-OG 2.79Å; E157-S467 WeakPolarHBondContact O-CB 3.46Å; T218-S467 WeakPolarHBondContact CA-O 3.4Å; R219-S467 PolarHBondContact N-O 3.33Å
468	F	81	Confident	86.4	Confident	85 Å²	85	53.7 Å²	53.7	37%	0.373	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-124.5	150.8	-178	75.2	-84	0	0	0	111.9	E157 Q217 I466	E157-F468 VanDerWaalsContact OE2-CB 3.26Å; E157-F468 WeakPolarHBondContact OE2-CB 3.15Å; Q217-F468 CarbonylContact O-C 3.45Å; Q217-F468 WeakPolarHBondContact O-CA 3.3Å; I466-F468 HydrophobicContact CG2-CD1 3.57Å; I466-F468 HydrophobicContact CG2-CE1 3.54Å; I466-F468 HydrophobicContact CG2-CG 4.27Å; I466-F468 HydrophobicContact CG2-CZ 4.24Å; I466-F468 WeakPolarHBondContact CG2-O 3.27Å; I466-F468 PolarHBondContact O-N 3.22Å
469	K	81.5	Confident	86.8	Confident	91 Å²	91	46.8 Å²	46.8	40%	0.396	22%	0.224	S	C	.	.			trans	-124.3	104.6	170	177.8	161.3	178.3	165.6	0	109.1	Q217 R219 E246 K471	Q217-K469 WeakPolarHBondContact CB-O 3.46Å; Q217-K469 WeakPolarHBondContact CG-O 3.4Å; Q217-K469 PolarHBondContact O-N 3.22Å; R219-K469 HydrophobicContact CG-CB 4.1Å; E246-K469 IonicContact OE1-NZ 3.78Å; E246-K469 PolarHBondContact OE1-NZ 3.17Å; E246-K469 WeakPolarHBondContact OE2-CD 3.42Å; E246-K469 WeakPolarHBondContact OE2-CE 3.36Å; E246-K469 IonicContact OE2-NZ 2.68Å; E246-K469 PolarHBondContact OE2-NZ 3.06Å; K469-K471 PolarHBondContact O-N 2.83Å
470	K	77.4	Confident	87.2	Confident	44 Å²	44	46.4 Å²	46.4	19%	0.191	23%	0.227	C	C	.	.			trans	-55.1	128.7	178.2	-167.5	178	-177.8	-167.1	0	110.6	T472 T547 P879 W880 E883	K470-T472 PolarHBondContact O-N 3.32Å; K470-T547 PolarHBondContact NZ-OG1 2.84Å; K470-P879 HydrophobicContact CG-CG 4.41Å; K470-W880 HydrophobicContact CD-CZ2 4.3Å; K470-W880 VanDerWaalsContact CE-CZ2 3.44Å; K470-W880 HydrophobicContact CG-CZ2 4.39Å; K470-E883 IonicContact NZ-OE1 3.7Å; K470-E883 PolarHBondContact NZ-OE1 2.93Å; K470-E883 IonicContact NZ-OE2 2.79Å; K470-E883 PolarHBondContact NZ-OE2 2.64Å
471	K	81	Confident	87.5	Confident	60 Å²	60	42.3 Å²	42.3	26%	0.261	21%	0.208	S	C	.	.			trans	-67.1	128.3	171.7	-76.8	178.6	177.1	-177.3	0	109.9	Q217 K469 L474 D585 W880	Q217-K471 HydrophobicContact CG-CG 4Å; K469-K471 PolarHBondContact O-N 2.83Å; K471-L474 HydrophobicContact CB-CD2 3.94Å; K471-D585 WeakPolarHBondContact CD-OD2 3.49Å; K471-D585 IonicContact NZ-OD1 2.71Å; K471-D585 PolarHBondContact NZ-OD1 2.9Å; K471-D585 IonicContact NZ-OD2 3.13Å; K471-D585 PolarHBondContact NZ-OD2 2.89Å; K471-W880 WeakPolarHBondContact O-CZ2 3.48Å; K471-W880 PolarHBondContact O-NE1 3.27Å
472	T	82.6	Confident	87.9	Confident	99 Å²	99	43.1 Å²	43.1	61%	0.607	21%	0.213	S	C	*	.	S	Bend	trans	-94.6	-12.1	174.6	53.1	0	0	0	0	113.6	K470 F549 T550	K470-T472 PolarHBondContact O-N 3.32Å; T472-F549 WeakPolarHBondContact O-CA 3.4Å; T472-T550 PolarHBondContact O-N 2.83Å; T472-T550 PolarHBondContact O-OG1 3.37Å
473	H	89.2	Confident	88.2	Confident	76 Å²	76	40.8 Å²	40.8	35%	0.352	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.8	175.2	-178.6	82.4	0	0	0	107.7	T550 D552	H473-T550 CarbonylContact C-O 3.56Å; H473-T550 VanDerWaalsContact CA-O 3.31Å; H473-T550 WeakPolarHBondContact CA-O 3.38Å; H473-T550 WeakPolarHBondContact CB-OG1 3.36Å; H473-T550 PolarHBondContact ND1-OG1 2.9Å; H473-D552 IonicContact CE1-OD1 3.18Å; H473-D552 PolarHBondContact CE1-OD1 2.92Å; H473-D552 VanDerWaalsContact CE1-OD1 3.25Å; H473-D552 IonicContact NE2-OD1 3.89Å; H473-D552 PolarHBondContact NE2-OD1 2.99Å; H473-D552 IonicContact NE2-OD2 2.74Å; H473-D552 PolarHBondContact NE2-OD2 3.14Å
474	L	90.5	Very high	88.7	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	137.7	-171.3	-62.1	-174.9	0	0	0	110.9	K471 F549 T550 Y551 D552 D585 L586 W880	K471-L474 HydrophobicContact CB-CD2 3.94Å; L474-F549 HydrophobicContact CB-CD2 4.38Å; L474-F549 HydrophobicContact CD1-CB 4.36Å; L474-F549 HydrophobicContact CD1-CD2 3.78Å; L474-F549 HydrophobicContact CD1-CE2 4.18Å; L474-F549 HydrophobicContact CD1-CG 3.98Å; L474-F549 HydrophobicContact CG-CB 4.43Å; L474-F549 HydrophobicContact CG-CD2 4.16Å; L474-F549 HydrophobicContact CG-CG 4.45Å; L474-T550 PolarHBondContact N-O 2.9Å; L474-Y551 WeakPolarHBondContact O-CA 3.49Å; L474-Y551 WeakPolarHBondContact O-CB 3.43Å; L474-D552 PolarHBondContact O-N 3.18Å; L474-D552 VanDerWaalsContact O-N 3.14Å; L474-D585 HydrophobicContact CB-CB 4.48Å; L474-D585 HydrophobicContact CD2-CB 4.09Å; L474-L586 HydrophobicContact CD1-CD2 4.48Å; L474-W880 HydrophobicContact CD1-CD2 4.44Å; L474-W880 HydrophobicContact CD1-CG 4.46Å
475	K	92.9	Very high	89	Confident	97 Å²	97	40.3 Å²	40.3	42%	0.422	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	119.9	168.3	-64.9	-179.8	-179.8	-178.8	0	109.1	T583 D585 L586	K475-T583 WeakPolarHBondContact CD-O 3.49Å; K475-D585 PolarHBondContact O-N 3.11Å; K475-L586 PolarHBondContact O-N 3.14Å
476	V	95.3	Very high	89.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	118.7	-177.1	-178.8	0	0	0	0	109.6	L533 Y551 D552 L553 H554 L586 V588	V476-L533 HydrophobicContact CB-CD2 4.45Å; V476-L533 HydrophobicContact CG1-CD1 4.32Å; V476-L533 HydrophobicContact CG1-CD2 3.96Å; V476-L533 HydrophobicContact CG2-CD1 4.12Å; V476-Y551 HydrophobicContact CG2-CG 4.35Å; V476-D552 PolarHBondContact N-O 3.13Å; V476-L553 HydrophobicContact CB-CD1 4.19Å; V476-L553 HydrophobicContact CG1-CD1 3.9Å; V476-L553 WeakPolarHBondContact O-CA 3.21Å; V476-H554 PolarHBondContact O-N 3.26Å; V476-L586 VanDerWaalsContact CA-O 3.28Å; V476-L586 WeakPolarHBondContact CA-O 3.37Å; V476-L586 HydrophobicContact CG2-CB 4.4Å; V476-L586 HydrophobicContact CG2-CD2 4.27Å; V476-V588 HydrophobicContact CG1-CB 4.09Å; V476-V588 HydrophobicContact CG1-CG2 3.81Å
477	V	95.9	Very high	89.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	143.5	172.8	66.8	0	0	0	0	110.7	H554 V556 I575 I579 A584 L586 A587 V588	V477-H554 CarbonylContact C-O 3.18Å; V477-H554 WeakPolarHBondContact CA-O 3.18Å; V477-V556 HydrophobicContact CG2-CB 3.9Å; V477-V556 HydrophobicContact CG2-CG2 4.5Å; V477-I575 HydrophobicContact CG1-CB 4.49Å; V477-I575 HydrophobicContact CG1-CG1 4.3Å; V477-I575 HydrophobicContact CG1-CG2 3.9Å; V477-I575 HydrophobicContact CG2-CG1 4.14Å; V477-I579 HydrophobicContact CG1-CD1 4.28Å; V477-I579 HydrophobicContact CG1-CG1 4.4Å; V477-A584 HydrophobicContact CB-CB 3.71Å; V477-A584 HydrophobicContact CG1-CB 3.58Å; V477-L586 PolarHBondContact N-O 3.06Å; V477-A587 HydrophobicContact CG1-CB 3.58Å; V477-A587 WeakPolarHBondContact O-CA 3.38Å; V477-V588 PolarHBondContact O-N 2.85Å
478	T	95.6	Very high	89.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	175	172.9	-158.3	0	0	0	0	111.7	V485 L553 H554 L555 V556 V588	T478-V485 HydrophobicContact CG2-CG1 4.24Å; T478-V485 HydrophobicContact CG2-CG2 4.44Å; T478-V485 WeakPolarHBondContact OG1-CG2 3.33Å; T478-L553 HydrophobicContact CG2-CD1 3.85Å; T478-L553 HydrophobicContact CG2-CG 4.46Å; T478-H554 PolarHBondContact N-O 3.13Å; T478-L555 HydrophobicContact CG2-CD2 3.83Å; T478-L555 CarbonylContact O-C 3.54Å; T478-L555 WeakPolarHBondContact O-CA 3.42Å; T478-V556 PolarHBondContact O-N 3.14Å; T478-V588 WeakPolarHBondContact CB-O 3.3Å; T478-V588 PolarHBondContact OG1-O 2.76Å
479	I	93.7	Very high	90.3	Very high	19 Å²	19	42.4 Å²	42.4	10%	0.097	21%	0.214	C	C	.	.			trans	-132	143	-179.6	-173	172.7	0	0	0	109	S481 V485 V556 G559 V561 I575 A589	I479-S481 PolarHBondContact O-N 3.13Å; I479-V485 WeakPolarHBondContact O-CB 3.32Å; I479-V556 HydrophobicContact CB-CG1 4Å; I479-V556 HydrophobicContact CD1-CG1 4.36Å; I479-V556 HydrophobicContact CG1-CG1 3.97Å; I479-G559 WeakPolarHBondContact CD1-O 3.38Å; I479-V561 HydrophobicContact CD1-CG2 3.85Å; I479-I575 HydrophobicContact CB-CD1 3.96Å; I479-I575 HydrophobicContact CG2-CD1 4Å; I479-A589 HydrophobicContact CG2-CB 3.84Å
480	E	92.4	Very high	90.5	Very high	111 Å²	111	40.8 Å²	40.8	52%	0.519	21%	0.207	S	C	.	.			trans	-66.6	118.5	171.1	-177.8	158.9	-128.9	0	0	109.6	T487	E480-T487 HydrophobicContact CB-CG2 4.24Å; E480-T487 HydrophobicContact CG-CG2 4.17Å; E480-T487 WeakPolarHBondContact OE1-CB 3.49Å; E480-T487 WeakPolarHBondContact OE1-CG2 3.46Å; E480-T487 PolarHBondContact OE1-N 3.4Å; E480-T487 PolarHBondContact OE1-OG1 3.42Å
481	S	91.5	Very high	90.7	Very high	27 Å²	27	46.8 Å²	46.8	19%	0.189	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-162.1	99.9	-177.1	-174	0	0	0	0	108.8	I479 F484 V485	I479-S481 PolarHBondContact O-N 3.13Å; S481-F484 CarbonylContact O-C 3.58Å; S481-F484 WeakPolarHBondContact O-CA 3.42Å; S481-F484 WeakPolarHBondContact O-CB 3.14Å; S481-F484 PolarHBondContact O-N 3.16Å; S481-V485 CarbonylContact C-O 3.56Å; S481-V485 PolarHBondContact N-O 3.29Å; S481-V485 PolarHBondContact O-N 2.97Å
482	V	92.2	Very high	90.3	Very high	35 Å²	35	47.8 Å²	47.8	21%	0.212	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	138.8	177.3	-178.3	0	0	0	0	109.3	Q486 R847 Y850	V482-Q486 HydrophobicContact CG2-CG 4.18Å; V482-R847 WeakPolarHBondContact O-CD 3.16Å; V482-R847 VanDerWaalsContact O-CZ 3.28Å; V482-R847 PolarHBondContact O-NE 3.09Å; V482-R847 PolarHBondContact O-NH1 3.09Å; V482-Y850 HydrophobicContact CG1-CD1 4.13Å; V482-Y850 HydrophobicContact CG1-CE1 3.3Å
483	P	92.8	Very high	90.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	cis	-88.6	7.4	-6.6	38.3	-37.7	0	0	0	114.2	Y528 Y850 I905	P483-Y528 PolarHBondContact O-N 3.02Å; P483-Y850 HydrophobicContact CB-CD1 4.28Å; P483-Y850 HydrophobicContact CB-CD2 3.61Å; P483-Y850 HydrophobicContact CB-CE1 4.32Å; P483-Y850 HydrophobicContact CB-CE2 3.62Å; P483-Y850 HydrophobicContact CB-CG 3.91Å; P483-Y850 HydrophobicContact CG-CD1 4.34Å; P483-Y850 HydrophobicContact CG-CD2 3.84Å; P483-Y850 HydrophobicContact CG-CE2 4.35Å; P483-Y850 HydrophobicContact CG-CG 3.78Å; P483-I905 HydrophobicContact CG-CG1 4.36Å
484	F	94.7	Very high	89.5	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-44.3	-174.9	-62.2	-77.5	0	0	0	113.3	S481 G527 Y528 C529 P590 A846 Y870	S481-F484 CarbonylContact O-C 3.58Å; S481-F484 WeakPolarHBondContact O-CA 3.42Å; S481-F484 WeakPolarHBondContact O-CB 3.14Å; S481-F484 PolarHBondContact O-N 3.16Å; F484-G527 CarbonylContact O-C 3.54Å; F484-G527 VanDerWaalsContact O-C 3.23Å; F484-G527 WeakPolarHBondContact O-CA 3.4Å; F484-Y528 HydrophobicContact CD1-CD1 4.15Å; F484-Y528 HydrophobicContact CD1-CG 4.11Å; F484-Y528 HydrophobicContact CE1-CD1 4.45Å; F484-Y528 HydrophobicContact CE1-CG 4.41Å; F484-Y528 PolarHBondContact O-N 2.87Å; F484-C529 PolarHBondContact O-N 2.97Å; F484-P590 HydrophobicContact CB-CB 4.36Å; F484-P590 HydrophobicContact CB-CG 3.92Å; F484-P590 HydrophobicContact CD1-CB 4.2Å; F484-P590 HydrophobicContact CD2-CB 3.73Å; F484-P590 HydrophobicContact CD2-CG 3.77Å; F484-P590 HydrophobicContact CE2-CB 4.08Å; F484-P590 HydrophobicContact CG-CB 3.81Å; F484-P590 HydrophobicContact CG-CG 3.85Å; F484-P590 HydrophobicContact CZ-CB 4.49Å; F484-A846 HydrophobicContact CZ-CB 3.86Å; F484-Y870 HydrophobicContact CE1-CD2 4.18Å; F484-Y870 HydrophobicContact CE1-CE2 4Å; F484-Y870 AromaticContact CE2-CE2 3.95Å; F484-Y870 HydrophobicContact CE2-CE2 3.95Å; F484-Y870 HydrophobicContact CZ-CD2 4.15Å; F484-Y870 AromaticContact CZ-CE2 3.51Å; F484-Y870 HydrophobicContact CZ-CE2 3.51Å
485	V	94.6	Very high	89.2	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-146.3	127.5	174.4	-177.5	0	0	0	0	108.5	T478 I479 S481 C525 Y526 C529 I530	T478-V485 HydrophobicContact CG2-CG1 4.24Å; T478-V485 HydrophobicContact CG2-CG2 4.44Å; T478-V485 WeakPolarHBondContact OG1-CG2 3.33Å; I479-V485 WeakPolarHBondContact O-CB 3.32Å; S481-V485 CarbonylContact C-O 3.56Å; S481-V485 PolarHBondContact N-O 3.29Å; S481-V485 PolarHBondContact O-N 2.97Å; V485-C525 HydrophobicContact CG1-CB 4.34Å; V485-Y526 CarbonylContact C-O 3.56Å; V485-Y526 WeakPolarHBondContact CA-O 3.47Å; V485-C529 HydrophobicContact CG2-CB 3.82Å; V485-I530 HydrophobicContact CG1-CD1 4.26Å; V485-I530 HydrophobicContact CG1-CG1 4.43Å; V485-I530 HydrophobicContact CG2-CD1 4.05Å; V485-I530 HydrophobicContact CG2-CG1 4.29Å
486	Q	92.5	Very high	88.5	Confident	31 Å²	31	55.5 Å²	55.5	15%	0.145	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	147.8	172.7	-47.6	-170.2	7.4	0	0	108.2	V482 C525 Y526	V482-Q486 HydrophobicContact CG2-CG 4.18Å; Q486-C525 WeakPolarHBondContact O-CA 3.48Å; Q486-Y526 HydrophobicContact CB-CD1 4.5Å; Q486-Y526 HydrophobicContact CB-CD2 4.25Å; Q486-Y526 HydrophobicContact CB-CE1 3.92Å; Q486-Y526 HydrophobicContact CB-CE2 3.68Å; Q486-Y526 VanDerWaalsContact CB-CZ 3.49Å; Q486-Y526 HydrophobicContact CG-CD2 4.49Å; Q486-Y526 HydrophobicContact CG-CE2 3.9Å; Q486-Y526 PolarHBondContact N-O 2.67Å; Q486-Y526 PolarHBondContact O-N 3.37Å; Q486-Y526 VanDerWaalsContact O-N 3.1Å; Q486-Y526 VanDerWaalsContact OE1-CE2 3.23Å; Q486-Y526 VanDerWaalsContact OE1-CZ 3.28Å; Q486-Y526 PolarHBondContact OE1-OH 2.67Å
487	T	91.8	Very high	87.5	Confident	20 Å²	20	60.5 Å²	60.5	12%	0.123	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	142	-178.5	80.4	0	0	0	0	111.6	E480 L555	E480-T487 HydrophobicContact CB-CG2 4.24Å; E480-T487 HydrophobicContact CG-CG2 4.17Å; E480-T487 WeakPolarHBondContact OE1-CB 3.49Å; E480-T487 WeakPolarHBondContact OE1-CG2 3.46Å; E480-T487 PolarHBondContact OE1-N 3.4Å; E480-T487 PolarHBondContact OE1-OG1 3.42Å; T487-L555 HydrophobicContact CG2-CD1 3.89Å; T487-L555 HydrophobicContact CG2-CD2 4.16Å
488	H	89.1	Confident	86.1	Confident	99 Å²	99	62.8 Å²	62.8	46%	0.458	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	146.2	163.5	-72.2	-49.7	0	0	0	110.4	K490 Y523 C524 Y526	H488-K490 PolarHBondContact O-N 3.32Å; H488-Y523 CarbonylContact O-C 3.56Å; H488-Y523 WeakPolarHBondContact O-CA 3.48Å; H488-C524 PolarHBondContact N-O 3.03Å; H488-C524 PolarHBondContact O-N 2.9Å; H488-Y526 AromaticContact CD2-CE1 3.44Å; H488-Y526 VanDerWaalsContact CD2-CE1 3.44Å; H488-Y526 WeakPolarHBondContact CD2-CE1 3.13Å; H488-Y526 AromaticContact NE2-CE1 3.65Å; H488-Y526 AromaticContact NE2-CZ 3.72Å; H488-Y526 PolarHBondContact NE2-OH 2.92Å
489	P	89.2	Confident	84.7	Confident	79 Å²	79	70.1 Å²	70.1	51%	0.513	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	135.1	175.9	27.1	-34.5	0	0	0	110.6	L491	P489-L491 PolarHBondContact O-N 3.36Å
490	K	86.1	Confident	83.2	Confident	56 Å²	56	72.7 Å²	72.7	24%	0.243	39%	0.386	C	S	.	.			trans	-70.8	95.1	-178.7	-174.8	171.4	179.1	-173.2	0	110.8	H488 S492 D493 E509 H522	H488-K490 PolarHBondContact O-N 3.32Å; K490-S492 WeakPolarHBondContact CE-O 2.99Å; K490-S492 WeakPolarHBondContact CG-O 3.43Å; K490-D493 VanDerWaalsContact CE-C 3.43Å; K490-D493 WeakPolarHBondContact CE-O 3.44Å; K490-D493 PolarHBondContact NZ-O 3.19Å; K490-E509 HydrophobicContact CD-CG 4.47Å; K490-E509 IonicContact NZ-OE1 3.87Å; K490-E509 PolarHBondContact NZ-OE1 3.44Å; K490-E509 IonicContact NZ-OE2 2.76Å; K490-E509 PolarHBondContact NZ-OE2 3.44Å; K490-H522 HydrophobicContact CB-CB 4.35Å; K490-H522 WeakPolarHBondContact CB-O 3.44Å; K490-H522 HydrophobicContact CD-CB 4.3Å; K490-H522 PolarHBondContact N-O 3.02Å
491	L	81.5	Confident	81.7	Confident	171 Å²	171	67.5 Å²	67.5	90%	0.895	36%	0.361	S	S	*	.			trans	-83.8	-15.5	-179.1	-74.7	158.8	0	0	0	114.1	P489	P489-L491 PolarHBondContact O-N 3.36Å
492	S	73.4	Confident	80.6	Confident	80 Å²	80	71.4 Å²	71.4	56%	0.559	38%	0.38	S	S	*	.	S	Bend	trans	-126.9	158.9	-176	176.9	0	0	0	0	110	K490 K494	K490-S492 WeakPolarHBondContact CE-O 2.99Å; K490-S492 WeakPolarHBondContact CG-O 3.43Å; S492-K494 WeakPolarHBondContact CB-O 3.42Å; S492-K494 PolarHBondContact O-N 3.05Å; S492-K494 PolarHBondContact OG-O 2.71Å
493	D	77.1	Confident	79.8	Confident	156 Å²	156	73 Å²	73	83%	0.834	39%	0.389	S	S	*	.	S	Bend	trans	-57.3	-21.9	176.7	-80.1	-22	0	0	0	113.2	K490	K490-D493 VanDerWaalsContact CE-C 3.43Å; K490-D493 WeakPolarHBondContact CE-O 3.44Å; K490-D493 PolarHBondContact NZ-O 3.19Å
494	K	76.9	Confident	78.8	Confident	152 Å²	152	75 Å²	75	66%	0.661	40%	0.398	S	S	*	.	S	Bend	trans	-135.3	147.6	178.1	-61.9	-168.1	174.1	-160.8	0	112	S492	S492-K494 WeakPolarHBondContact CB-O 3.42Å; S492-K494 PolarHBondContact O-N 3.05Å; S492-K494 PolarHBondContact OG-O 2.71Å
495	C	83.2	Confident	77.8	Confident	10 Å²	10	80.5 Å²	80.5	7%	0.068	42%	0.422	C	S	.	.			trans	-79.6	171.1	164.9	-55.9	0	0	0	0	110.2	E497 E507 C524	C495-E497 HydrophobicContact CB-CG 4.36Å; C495-E497 PolarHBondContact O-N 3.47Å; C495-E507 HydrophobicContact CB-CB 3.76Å; C495-C524 HydrophobicContact CB-CB 3.8Å; C495-C524 WeakPolarHBondContact CB-SG 3.38Å; C495-C524 VanDerWaalsContact SG-CA 3.52Å; C495-C524 WeakPolarHBondContact SG-CB 3.08Å; C495-C524 CovalentContact SG-SG 2.04Å; C495-C524 PolarHBondContact SG-SG 3.33Å
496	N	79.5	Confident	77.1	Confident	119 Å²	119	80.9 Å²	80.9	64%	0.636	42%	0.424	S	S	*	.	S	Bend	trans	-75.4	70.6	173.4	-67.4	-51.6	0	0	0	111.9	E507	N496-E507 HydrophobicContact CB-CB 4.46Å; N496-E507 HydrophobicContact CB-CG 4.32Å; N496-E507 PolarHBondContact N-OE2 3.36Å; N496-E507 PolarHBondContact ND2-OE1 3.34Å; N496-E507 PolarHBondContact O-N 3.04Å
497	E	73.1	Confident	76.8	Confident	104 Å²	104	81.5 Å²	81.5	49%	0.486	43%	0.427	S	S	.	.			trans	-79.6	145.2	179.7	-70.8	159.9	-153.3	0	0	112.1	C495 E507	C495-E497 HydrophobicContact CB-CG 4.36Å; C495-E497 PolarHBondContact O-N 3.47Å; E497-E507 WeakPolarHBondContact CG-O 3.45Å
498	S	67.5	Low	76.6	Confident	48 Å²	48	81.7 Å²	81.7	34%	0.336	43%	0.427	S	S	.	.			trans	-138.2	136.5	167.3	176.9	0	0	0	0	109.8	D500 R534	S498-D500 VanDerWaalsContact C-N 3.26Å; S498-D500 PolarHBondContact O-N 2.88Å; S498-D500 PolarHBondContact OG-N 3.38Å; S498-R534 PolarHBondContact O-NH2 3.28Å
499	D	65.7	Low	76.7	Confident	154 Å²	154	80.1 Å²	80.1	82%	0.824	42%	0.42	S	S	*	.	S	Bend	trans	-71.3	-19.6	177.4	-67.9	-36.7	0	0	0	112.9	P501 N538	D499-P501 WeakPolarHBondContact O-CD 3.17Å; D499-N538 PolarHBondContact O-ND2 2.81Å
500	D	62.5	Low	76.8	Confident	73 Å²	73	76.3 Å²	76.3	39%	0.39	40%	0.396	S	S	.	.			trans	-86.2	112.7	-179.5	-174.4	-8	0	0	0	111	S498 L502 V503 R534	S498-D500 VanDerWaalsContact C-N 3.26Å; S498-D500 PolarHBondContact O-N 2.88Å; S498-D500 PolarHBondContact OG-N 3.38Å; D500-L502 PolarHBondContact O-N 3.01Å; D500-L502 WeakPolarHBondContact OD1-CB 3.47Å; D500-L502 PolarHBondContact OD1-N 2.97Å; D500-V503 HydrophobicContact CB-CG2 4.02Å; D500-V503 PolarHBondContact O-N 3.13Å; D500-R534 PolarHBondContact O-NH2 3.31Å
501	P	61.5	Low	77.2	Confident	2 Å²	2	75.4 Å²	75.4	1%	0.013	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-8.7	-177.8	36.7	-37.3	0	0	0	112.8	D499 V503 R534 L535 N538 T540	D499-P501 WeakPolarHBondContact O-CD 3.17Å; P501-V503 VanDerWaalsContact C-N 3.28Å; P501-R534 HydrophobicContact CB-CB 4.38Å; P501-L535 HydrophobicContact CB-CD2 4.17Å; P501-N538 HydrophobicContact CB-CB 4.33Å; P501-N538 WeakPolarHBondContact CD-ND2 3.11Å; P501-N538 HydrophobicContact CG-CB 4.1Å; P501-T540 HydrophobicContact CG-CG2 3.32Å
502	L	67.7	Low	77.7	Confident	110 Å²	110	69.3 Å²	69.3	58%	0.576	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-11.1	170.8	-60.5	172.4	0	0	0	112.1	D500 F504	D500-L502 PolarHBondContact O-N 3.01Å; D500-L502 WeakPolarHBondContact OD1-CB 3.47Å; D500-L502 PolarHBondContact OD1-N 2.97Å; L502-F504 WeakPolarHBondContact O-CD2 3.04Å; L502-F504 WeakPolarHBondContact O-CE2 3.47Å; L502-F504 PolarHBondContact O-N 3.42Å
503	V	74.7	Confident	78.4	Confident	68 Å²	68	67.7 Å²	67.7	41%	0.412	35%	0.348	S	S	.	.	S	Bend	trans	-84	106.5	164.7	-176.5	0	0	0	0	107.7	D500 P501 T506 R534	D500-V503 HydrophobicContact CB-CG2 4.02Å; D500-V503 PolarHBondContact O-N 3.13Å; P501-V503 VanDerWaalsContact C-N 3.28Å; V503-T506 HydrophobicContact CB-CG2 4.25Å; V503-T506 HydrophobicContact CG1-CG2 3.91Å; V503-T506 WeakPolarHBondContact O-CG2 3.45Å; V503-R534 PolarHBondContact O-NH1 3Å
504	F	72.5	Confident	78.8	Confident	41 Å²	41	61.9 Å²	61.9	18%	0.18	32%	0.317	C	S	.	.			trans	-80.8	161.8	177.7	-62.4	-98.1	0	0	0	110.8	L502 T506 D531 L535 L900 K903	L502-F504 WeakPolarHBondContact O-CD2 3.04Å; L502-F504 WeakPolarHBondContact O-CE2 3.47Å; L502-F504 PolarHBondContact O-N 3.42Å; F504-T506 VanDerWaalsContact C-N 3.34Å; F504-D531 HydrophobicContact CD1-CB 4.33Å; F504-L535 HydrophobicContact CE1-CD1 4.49Å; F504-L900 HydrophobicContact CD1-CD2 3.75Å; F504-L900 HydrophobicContact CE1-CD2 3.6Å; F504-L900 HydrophobicContact CE1-CG 4.17Å; F504-K903 HydrophobicContact CB-CD 4.05Å; F504-K903 HydrophobicContact CD1-CD 3.91Å; F504-K903 HydrophobicContact CD2-CD 4.02Å; F504-K903 HydrophobicContact CE1-CD 4.4Å; F504-K903 HydrophobicContact CG-CD 3.7Å
505	K	74.8	Confident	78.9	Confident	117 Å²	117	59.1 Å²	59.1	51%	0.509	32%	0.315	S	S	.	.	S	Bend	trans	64.3	30.7	-178.8	-45.3	-163.9	170.2	-172.7	0	115	D531 W904	K505-D531 PolarHBondContact N-OD1 3.49Å; K505-D531 PolarHBondContact N-OD2 3.46Å; K505-W904 HydrophobicContact CB-CH2 4Å; K505-W904 HydrophobicContact CB-CZ2 4.06Å; K505-W904 HydrophobicContact CD-CH2 4.19Å; K505-W904 HydrophobicContact CG-CH2 3.68Å; K505-W904 HydrophobicContact CG-CZ2 3.62Å; K505-W904 HydrophobicContact CG-CZ3 4.45Å
506	T	79.7	Confident	78.9	Confident	8 Å²	8	64.5 Å²	64.5	5%	0.049	35%	0.348	C	S	.	.			trans	-83.7	151.9	170.7	59.6	0	0	0	0	110.8	V503 F504 R534	V503-T506 HydrophobicContact CB-CG2 4.25Å; V503-T506 HydrophobicContact CG1-CG2 3.91Å; V503-T506 WeakPolarHBondContact O-CG2 3.45Å; F504-T506 VanDerWaalsContact C-N 3.34Å; T506-R534 WeakPolarHBondContact OG1-CD 3.14Å; T506-R534 PolarHBondContact OG1-NE 2.71Å; T506-R534 PolarHBondContact OG1-NH1 3.27Å
507	E	85.6	Confident	79.2	Confident	44 Å²	44	62.5 Å²	62.5	21%	0.206	34%	0.34	C	S	.	.			trans	-92.6	151	176	-63.4	160.2	-154.4	0	0	111.5	C495 N496 E497 C524 C525 Y526	C495-E507 HydrophobicContact CB-CB 3.76Å; N496-E507 HydrophobicContact CB-CB 4.46Å; N496-E507 HydrophobicContact CB-CG 4.32Å; N496-E507 PolarHBondContact N-OE2 3.36Å; N496-E507 PolarHBondContact ND2-OE1 3.34Å; N496-E507 PolarHBondContact O-N 3.04Å; E497-E507 WeakPolarHBondContact CG-O 3.45Å; E507-C524 HydrophobicContact CB-CB 4.27Å; E507-C524 HydrophobicContact CG-CB 4.48Å; E507-C525 WeakPolarHBondContact CA-O 3.46Å; E507-Y526 HydrophobicContact CG-CD1 4.24Å
508	I	88	Confident	79.7	Confident	25 Å²	25	60.2 Å²	60.2	13%	0.128	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	141.2	173.1	-69.9	-171.6	0	0	0	109.3	C510 C525 I530 R534 Y551 L553	I508-C510 PolarHBondContact O-N 3.21Å; I508-C525 PolarHBondContact N-O 2.81Å; I508-C525 PolarHBondContact O-N 3.4Å; I508-I530 HydrophobicContact CB-CG2 4.2Å; I508-I530 HydrophobicContact CD1-CG2 3.96Å; I508-I530 HydrophobicContact CG1-CG2 4.1Å; I508-R534 HydrophobicContact CD1-CG 3.45Å; I508-R534 VanDerWaalsContact CD1-CG 3.45Å; I508-Y551 HydrophobicContact CD1-CE2 4.39Å; I508-Y551 WeakPolarHBondContact CD1-OH 3.36Å; I508-L553 HydrophobicContact CG2-CD2 4.1Å
509	E	90.5	Very high	80.7	Confident	65 Å²	65	62.6 Å²	62.6	30%	0.304	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	127	172.8	-178.8	162.9	-170	0	0	112.1	K490 H522 Y523	K490-E509 HydrophobicContact CD-CG 4.47Å; K490-E509 IonicContact NZ-OE1 3.87Å; K490-E509 PolarHBondContact NZ-OE1 3.44Å; K490-E509 IonicContact NZ-OE2 2.76Å; K490-E509 PolarHBondContact NZ-OE2 3.44Å; E509-H522 IonicContact OE1-CE1 3.4Å; E509-H522 IonicContact OE1-CG 3.52Å; E509-H522 IonicContact OE1-ND1 3.45Å; E509-H522 PolarHBondContact OE1-ND1 3.09Å; E509-Y523 WeakPolarHBondContact CA-O 3.24Å
510	C	92.4	Very high	81.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143	176.8	54.9	0	0	0	0	110.5	I508 Y523 C525 L553	I508-C510 PolarHBondContact O-N 3.21Å; C510-Y523 PolarHBondContact N-O 3.2Å; C510-Y523 PolarHBondContact O-N 3.45Å; C510-Y523 VanDerWaalsContact SG-CB 3.56Å; C510-Y523 PolarHBondContact SG-O 2.87Å; C510-C525 HydrophobicContact CB-CB 3.82Å; C510-C525 WeakPolarHBondContact CB-SG 3.42Å; C510-C525 WeakPolarHBondContact SG-CB 3.23Å; C510-C525 PolarHBondContact SG-N 2.75Å; C510-C525 VanDerWaalsContact SG-N 3.43Å; C510-C525 CovalentContact SG-SG 2.03Å; C510-C525 PolarHBondContact SG-SG 3.02Å; C510-L553 WeakPolarHBondContact CA-O 3.45Å; C510-L553 HydrophobicContact CB-CB 4.44Å; C510-L553 HydrophobicContact CB-CD2 3.87Å; C510-L553 HydrophobicContact CB-CG 3.91Å
511	T	92.9	Very high	83	Confident	36 Å²	36	63.1 Å²	63.1	22%	0.221	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	141.7	-179.9	62.6	0	0	0	0	112	K521 L553 H554 L555	T511-K521 WeakPolarHBondContact CA-O 3.47Å; T511-L553 PolarHBondContact N-O 3.03Å; T511-L553 VanDerWaalsContact N-O 3.12Å; T511-H554 CarbonylContact O-C 3.58Å; T511-H554 WeakPolarHBondContact O-CA 3.45Å; T511-H554 WeakPolarHBondContact O-CB 3.47Å; T511-L555 PolarHBondContact O-N 2.97Å
512	H	91.8	Very high	84.4	Confident	44 Å²	44	67.4 Å²	67.4	20%	0.204	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	123.6	173.3	178.5	-83.4	0	0	0	109.9	K520 K521 Y523 L555	H512-K520 WeakPolarHBondContact O-CA 3.36Å; H512-K521 PolarHBondContact N-O 3.38Å; H512-K521 PolarHBondContact O-N 3.36Å; H512-Y523 HydrophobicContact CB-CD2 4.12Å; H512-Y523 HydrophobicContact CB-CE2 3.84Å; H512-L555 HydrophobicContact CB-CB 4.17Å; H512-L555 HydrophobicContact CB-CD1 4.17Å
513	T	89.4	Confident	85.6	Confident	45 Å²	45	64.7 Å²	64.7	28%	0.276	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	109.7	172.5	38.4	0	0	0	0	109.9	K520	T513-K520 HydrophobicContact CG2-CD 3.89Å; T513-K520 HydrophobicContact CG2-CG 3.74Å
514	D	84.9	Confident	86.4	Confident	34 Å²	34	61.9 Å²	61.9	18%	0.182	33%	0.329	C	S	.	.			trans	-64.5	122.6	170.9	170.8	-9.9	0	0	0	109.7	T516 T517 G518 I519	D514-T516 VanDerWaalsContact C-N 3.25Å; D514-T516 PolarHBondContact O-N 3.32Å; D514-T516 PolarHBondContact OD1-N 2.92Å; D514-T516 PolarHBondContact OD1-OG1 2.76Å; D514-T517 WeakPolarHBondContact CB-OG1 3.35Å; D514-T517 PolarHBondContact OD1-N 2.91Å; D514-T517 VanDerWaalsContact OD2-CG2 3.32Å; D514-T517 WeakPolarHBondContact OD2-CG2 3.27Å; D514-T517 PolarHBondContact OD2-OG1 3.28Å; D514-G518 VanDerWaalsContact O-CA 3.25Å; D514-G518 WeakPolarHBondContact O-CA 3.26Å; D514-G518 PolarHBondContact O-N 3Å; D514-I519 PolarHBondContact N-O 3.34Å
515	P	78.8	Confident	87.4	Confident	94 Å²	94	59.9 Å²	59.9	61%	0.61	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-21.1	-173.9	28	-35.1	0	0	0	112.8	G557	P515-G557 WeakPolarHBondContact CD-O 3.26Å; P515-G557 WeakPolarHBondContact CG-O 3.39Å
516	T	83.8	Confident	88.3	Confident	124 Å²	124	56.1 Å²	56.1	76%	0.761	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-40.6	-178.6	67.2	0	0	0	0	112.3	D514	D514-T516 VanDerWaalsContact C-N 3.25Å; D514-T516 PolarHBondContact O-N 3.32Å; D514-T516 PolarHBondContact OD1-N 2.92Å; D514-T516 PolarHBondContact OD1-OG1 2.76Å
517	T	86.2	Confident	89	Confident	77 Å²	77	55.7 Å²	55.7	47%	0.472	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-17.7	-177.2	65.8	0	0	0	0	113.7	D514 I519	D514-T517 WeakPolarHBondContact CB-OG1 3.35Å; D514-T517 PolarHBondContact OD1-N 2.91Å; D514-T517 VanDerWaalsContact OD2-CG2 3.32Å; D514-T517 WeakPolarHBondContact OD2-CG2 3.27Å; D514-T517 PolarHBondContact OD2-OG1 3.28Å; T517-I519 HydrophobicContact CG2-CD1 4.5Å; T517-I519 PolarHBondContact O-N 3.37Å; T517-I519 WeakPolarHBondContact OG1-CB 3.41Å; T517-I519 WeakPolarHBondContact OG1-CG1 3.49Å; T517-I519 PolarHBondContact OG1-N 2.93Å
518	G	83	Confident	89.4	Confident	56 Å²	56	53.6 Å²	53.6	58%	0.577	29%	0.291	S	S	*	.			trans	68.6	5.5	-172.5	0	0	0	0	0	114.2	D514 K520	D514-G518 VanDerWaalsContact O-CA 3.25Å; D514-G518 WeakPolarHBondContact O-CA 3.26Å; D514-G518 PolarHBondContact O-N 3Å; G518-K520 PolarHBondContact O-N 3.22Å
519	I	87.8	Confident	89.7	Confident	97 Å²	97	52.4 Å²	52.4	50%	0.497	29%	0.285	S	S	.	.			trans	-75.3	127.3	-176.2	-63	172.1	0	0	0	109.5	D514 T517	D514-I519 PolarHBondContact N-O 3.34Å; T517-I519 HydrophobicContact CG2-CD1 4.5Å; T517-I519 PolarHBondContact O-N 3.37Å; T517-I519 WeakPolarHBondContact OG1-CB 3.41Å; T517-I519 WeakPolarHBondContact OG1-CG1 3.49Å; T517-I519 PolarHBondContact OG1-N 2.93Å
520	K	87.7	Confident	89.8	Confident	137 Å²	137	49.4 Å²	49.4	60%	0.596	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	125.9	171.6	-57.7	-147.6	175.2	-163.4	0	110.4	H512 T513 G518	H512-K520 WeakPolarHBondContact O-CA 3.36Å; T513-K520 HydrophobicContact CG2-CD 3.89Å; T513-K520 HydrophobicContact CG2-CG 3.74Å; G518-K520 PolarHBondContact O-N 3.22Å
521	K	89.6	Confident	89.7	Confident	101 Å²	101	49.4 Å²	49.4	44%	0.439	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	149.7	171.1	-66.8	177.3	-174.8	170.7	0	109.7	T511 H512 Y523	T511-K521 WeakPolarHBondContact CA-O 3.47Å; H512-K521 PolarHBondContact N-O 3.38Å; H512-K521 PolarHBondContact O-N 3.36Å; K521-Y523 HydrophobicContact CB-CD2 4.28Å; K521-Y523 HydrophobicContact CB-CE2 3.55Å; K521-Y523 HydrophobicContact CD-CE2 4.39Å
522	H	90.9	Very high	89.7	Confident	93 Å²	93	47.7 Å²	47.7	43%	0.431	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.9	-178.6	-67.7	-110.6	0	0	0	110	K490 E509	K490-H522 HydrophobicContact CB-CB 4.35Å; K490-H522 WeakPolarHBondContact CB-O 3.44Å; K490-H522 HydrophobicContact CD-CB 4.3Å; K490-H522 PolarHBondContact N-O 3.02Å; E509-H522 IonicContact OE1-CE1 3.4Å; E509-H522 IonicContact OE1-CG 3.52Å; E509-H522 IonicContact OE1-ND1 3.45Å; E509-H522 PolarHBondContact OE1-ND1 3.09Å
523	Y	91.7	Very high	89.7	Confident	52 Å²	52	45.6 Å²	45.6	20%	0.204	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	159.1	-176.9	-68.4	-95.1	0	0	0	109.7	H488 E509 C510 H512 K521 L555	H488-Y523 CarbonylContact O-C 3.56Å; H488-Y523 WeakPolarHBondContact O-CA 3.48Å; E509-Y523 WeakPolarHBondContact CA-O 3.24Å; C510-Y523 PolarHBondContact N-O 3.2Å; C510-Y523 PolarHBondContact O-N 3.45Å; C510-Y523 VanDerWaalsContact SG-CB 3.56Å; C510-Y523 PolarHBondContact SG-O 2.87Å; H512-Y523 HydrophobicContact CB-CD2 4.12Å; H512-Y523 HydrophobicContact CB-CE2 3.84Å; K521-Y523 HydrophobicContact CB-CD2 4.28Å; K521-Y523 HydrophobicContact CB-CE2 3.55Å; K521-Y523 HydrophobicContact CD-CE2 4.39Å; Y523-L555 HydrophobicContact CD2-CD1 4.33Å
524	C	93.1	Very high	89.6	Confident	9 Å²	9	44.1 Å²	44.1	6%	0.061	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	115.6	165.7	-62	0	0	0	0	107.9	H488 C495 E507	H488-C524 PolarHBondContact N-O 3.03Å; H488-C524 PolarHBondContact O-N 2.9Å; C495-C524 HydrophobicContact CB-CB 3.8Å; C495-C524 WeakPolarHBondContact CB-SG 3.38Å; C495-C524 VanDerWaalsContact SG-CA 3.52Å; C495-C524 WeakPolarHBondContact SG-CB 3.08Å; C495-C524 CovalentContact SG-SG 2.04Å; C495-C524 PolarHBondContact SG-SG 3.33Å; E507-C524 HydrophobicContact CB-CB 4.27Å; E507-C524 HydrophobicContact CG-CB 4.48Å
525	C	93.6	Very high	89.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	138.9	179.3	-75.8	0	0	0	0	111	V485 Q486 E507 I508 C510 I530 L553	V485-C525 HydrophobicContact CG1-CB 4.34Å; Q486-C525 WeakPolarHBondContact O-CA 3.48Å; E507-C525 WeakPolarHBondContact CA-O 3.46Å; I508-C525 PolarHBondContact N-O 2.81Å; I508-C525 PolarHBondContact O-N 3.4Å; C510-C525 HydrophobicContact CB-CB 3.82Å; C510-C525 WeakPolarHBondContact CB-SG 3.42Å; C510-C525 WeakPolarHBondContact SG-CB 3.23Å; C510-C525 PolarHBondContact SG-N 2.75Å; C510-C525 VanDerWaalsContact SG-N 3.43Å; C510-C525 CovalentContact SG-SG 2.03Å; C510-C525 PolarHBondContact SG-SG 3.02Å; C525-I530 HydrophobicContact CB-CD1 4.19Å; C525-I530 HydrophobicContact CB-CG1 4.33Å; C525-L553 HydrophobicContact CB-CD2 4.21Å
526	Y	93	Very high	90.1	Very high	37 Å²	37	39 Å²	39	15%	0.145	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	162.3	172.2	62.7	-85.3	0	0	0	110.3	V485 Q486 H488 E507 W904	V485-Y526 CarbonylContact C-O 3.56Å; V485-Y526 WeakPolarHBondContact CA-O 3.47Å; Q486-Y526 HydrophobicContact CB-CD1 4.5Å; Q486-Y526 HydrophobicContact CB-CD2 4.25Å; Q486-Y526 HydrophobicContact CB-CE1 3.92Å; Q486-Y526 HydrophobicContact CB-CE2 3.68Å; Q486-Y526 VanDerWaalsContact CB-CZ 3.49Å; Q486-Y526 HydrophobicContact CG-CD2 4.49Å; Q486-Y526 HydrophobicContact CG-CE2 3.9Å; Q486-Y526 PolarHBondContact N-O 2.67Å; Q486-Y526 PolarHBondContact O-N 3.37Å; Q486-Y526 VanDerWaalsContact O-N 3.1Å; Q486-Y526 VanDerWaalsContact OE1-CE2 3.23Å; Q486-Y526 VanDerWaalsContact OE1-CZ 3.28Å; Q486-Y526 PolarHBondContact OE1-OH 2.67Å; H488-Y526 AromaticContact CD2-CE1 3.44Å; H488-Y526 VanDerWaalsContact CD2-CE1 3.44Å; H488-Y526 WeakPolarHBondContact CD2-CE1 3.13Å; H488-Y526 AromaticContact NE2-CE1 3.65Å; H488-Y526 AromaticContact NE2-CZ 3.72Å; H488-Y526 PolarHBondContact NE2-OH 2.92Å; E507-Y526 HydrophobicContact CG-CD1 4.24Å; Y526-W904 AromaticContact CD2-CH2 3.82Å; Y526-W904 HydrophobicContact CD2-CH2 3.82Å; Y526-W904 HydrophobicContact CD2-CZ3 4.13Å
527	G	93	Very high	90.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	142.7	-178.4	179.1	0	0	0	0	0	113.2	F484 C529 I530 D531	F484-G527 CarbonylContact O-C 3.54Å; F484-G527 VanDerWaalsContact O-C 3.23Å; F484-G527 WeakPolarHBondContact O-CA 3.4Å; G527-C529 VanDerWaalsContact C-N 3.35Å; G527-C529 PolarHBondContact O-N 2.66Å; G527-I530 PolarHBondContact O-N 2.95Å; G527-I530 VanDerWaalsContact O-N 3.1Å; G527-D531 PolarHBondContact O-N 2.91Å
528	Y	94	Very high	89.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-50.4	-50.1	179	-169.2	-77.5	0	0	0	113.3	P483 F484 I530 D531 L532 F607 M897 L900 D901 W904 I905	P483-Y528 PolarHBondContact O-N 3.02Å; F484-Y528 HydrophobicContact CD1-CD1 4.15Å; F484-Y528 HydrophobicContact CD1-CG 4.11Å; F484-Y528 HydrophobicContact CE1-CD1 4.45Å; F484-Y528 HydrophobicContact CE1-CG 4.41Å; F484-Y528 PolarHBondContact O-N 2.87Å; Y528-I530 VanDerWaalsContact C-N 3.28Å; Y528-I530 PolarHBondContact O-N 3.09Å; Y528-D531 PolarHBondContact O-N 3.07Å; Y528-L532 WeakPolarHBondContact O-CB 3.44Å; Y528-L532 PolarHBondContact O-N 2.84Å; Y528-F607 HydrophobicContact CD1-CE2 4.14Å; Y528-F607 AromaticContact CE1-CD2 3.73Å; Y528-F607 HydrophobicContact CE1-CD2 3.73Å; Y528-F607 AromaticContact CE1-CE2 3.68Å; Y528-F607 HydrophobicContact CE1-CE2 3.68Å; Y528-M897 HydrophobicContact CE1-SD 4.39Å; Y528-M897 WeakPolarHBondContact OH-CG 3.28Å; Y528-M897 PolarHBondContact OH-SD 2.68Å; Y528-L900 HydrophobicContact CD2-CB 4.03Å; Y528-L900 HydrophobicContact CE1-CD1 4.49Å; Y528-L900 HydrophobicContact CE2-CB 3.55Å; Y528-D901 WeakPolarHBondContact CE2-OD1 3.4Å; Y528-D901 PolarHBondContact OH-OD1 2.86Å; Y528-W904 HydrophobicContact CD2-CB 3.92Å; Y528-W904 HydrophobicContact CD2-CG 4.26Å; Y528-I905 HydrophobicContact CE2-CD1 4.24Å
529	C	94.7	Very high	88	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-70.7	-26.3	-177.1	-76.5	0	0	0	0	112.1	F484 V485 G527 L533 V588	F484-C529 PolarHBondContact O-N 2.97Å; V485-C529 HydrophobicContact CG2-CB 3.82Å; G527-C529 VanDerWaalsContact C-N 3.35Å; G527-C529 PolarHBondContact O-N 2.66Å; C529-L533 WeakPolarHBondContact O-CB 3.43Å; C529-L533 PolarHBondContact O-N 3.41Å; C529-V588 HydrophobicContact CB-CG1 4.08Å; C529-V588 WeakPolarHBondContact O-CG1 3.36Å
530	I	93.3	Very high	86.1	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-76.2	-45.6	177.1	-52.2	-52.9	0	0	0	110.5	V485 I508 C525 G527 Y528 L532 L533 R534 L553	V485-I530 HydrophobicContact CG1-CD1 4.26Å; V485-I530 HydrophobicContact CG1-CG1 4.43Å; V485-I530 HydrophobicContact CG2-CD1 4.05Å; V485-I530 HydrophobicContact CG2-CG1 4.29Å; I508-I530 HydrophobicContact CB-CG2 4.2Å; I508-I530 HydrophobicContact CD1-CG2 3.96Å; I508-I530 HydrophobicContact CG1-CG2 4.1Å; C525-I530 HydrophobicContact CB-CD1 4.19Å; C525-I530 HydrophobicContact CB-CG1 4.33Å; G527-I530 PolarHBondContact O-N 2.95Å; G527-I530 VanDerWaalsContact O-N 3.1Å; Y528-I530 VanDerWaalsContact C-N 3.28Å; Y528-I530 PolarHBondContact O-N 3.09Å; I530-L532 VanDerWaalsContact C-N 3.32Å; I530-L532 PolarHBondContact O-N 3.35Å; I530-L533 PolarHBondContact O-N 3.34Å; I530-R534 VanDerWaalsContact O-CG 3.32Å; I530-R534 WeakPolarHBondContact O-CG 3.5Å; I530-R534 PolarHBondContact O-N 3.06Å; I530-L553 HydrophobicContact CD1-CD2 3.78Å
531	D	91.2	Very high	84.1	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-40.5	172.6	-78.9	-22	0	0	0	111	F504 K505 G527 Y528 R534 L535 L900 W904	F504-D531 HydrophobicContact CD1-CB 4.33Å; K505-D531 PolarHBondContact N-OD1 3.49Å; K505-D531 PolarHBondContact N-OD2 3.46Å; G527-D531 PolarHBondContact O-N 2.91Å; Y528-D531 PolarHBondContact O-N 3.07Å; D531-R534 PolarHBondContact O-N 2.77Å; D531-R534 IonicContact OD1-NH1 3.26Å; D531-L535 VanDerWaalsContact O-CG 3.32Å; D531-L535 WeakPolarHBondContact O-CG 3.46Å; D531-L535 PolarHBondContact O-N 3.17Å; D531-L900 HydrophobicContact CB-CD2 3.79Å; D531-W904 WeakPolarHBondContact OD2-CZ2 3.48Å; D531-W904 PolarHBondContact OD2-NE1 2.96Å
532	L	91.6	Very high	82	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.8	-45.2	173.6	-179.3	62.4	0	0	0	112.4	Y528 I530 R534 L535 L536 F607 L872 F891 M897 L900	Y528-L532 WeakPolarHBondContact O-CB 3.44Å; Y528-L532 PolarHBondContact O-N 2.84Å; I530-L532 VanDerWaalsContact C-N 3.32Å; I530-L532 PolarHBondContact O-N 3.35Å; L532-R534 VanDerWaalsContact C-N 3.34Å; L532-R534 PolarHBondContact O-N 3.22Å; L532-L535 PolarHBondContact O-N 3.45Å; L532-L536 HydrophobicContact CD1-CD1 4.37Å; L532-L536 HydrophobicContact CD1-CG 4.44Å; L532-L536 HydrophobicContact CG-CD1 4.09Å; L532-L536 VanDerWaalsContact O-CG 3.31Å; L532-L536 WeakPolarHBondContact O-CG 3.26Å; L532-L536 PolarHBondContact O-N 2.89Å; L532-F607 HydrophobicContact CD2-CB 4.02Å; L532-F607 HydrophobicContact CD2-CD1 4.2Å; L532-F607 HydrophobicContact CD2-CD2 3.82Å; L532-F607 HydrophobicContact CD2-CE2 4.32Å; L532-F607 HydrophobicContact CD2-CG 3.75Å; L532-L872 HydrophobicContact CD2-CD2 4.28Å; L532-F891 HydrophobicContact CD1-CD2 3.89Å; L532-F891 HydrophobicContact CD1-CE2 4.03Å; L532-M897 HydrophobicContact CD1-CE 4.32Å; L532-M897 HydrophobicContact CD1-SD 4.42Å; L532-L900 HydrophobicContact CD1-CD1 4.46Å
533	L	91.7	Very high	80.1	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-60.4	-41.7	176	174.2	60.2	0	0	0	112	V476 C529 I530 L536 A537 F549 Y551 L553 V588	V476-L533 HydrophobicContact CB-CD2 4.45Å; V476-L533 HydrophobicContact CG1-CD1 4.32Å; V476-L533 HydrophobicContact CG1-CD2 3.96Å; V476-L533 HydrophobicContact CG2-CD1 4.12Å; C529-L533 WeakPolarHBondContact O-CB 3.43Å; C529-L533 PolarHBondContact O-N 3.41Å; I530-L533 PolarHBondContact O-N 3.34Å; L533-L536 PolarHBondContact O-N 2.86Å; L533-A537 WeakPolarHBondContact O-CB 3.46Å; L533-A537 PolarHBondContact O-N 3.26Å; L533-F549 HydrophobicContact CD1-CE2 4.32Å; L533-F549 HydrophobicContact CD1-CZ 4.45Å; L533-Y551 HydrophobicContact CD1-CD1 4.29Å; L533-Y551 HydrophobicContact CD1-CD2 4.45Å; L533-Y551 HydrophobicContact CD1-CE1 4.4Å; L533-Y551 HydrophobicContact CD1-CG 4.33Å; L533-Y551 HydrophobicContact CD2-CD2 3.79Å; L533-Y551 HydrophobicContact CD2-CE2 3.53Å; L533-Y551 HydrophobicContact CD2-CG 4.47Å; L533-Y551 HydrophobicContact CG-CD2 4.29Å; L533-Y551 HydrophobicContact CG-CE1 4.24Å; L533-Y551 HydrophobicContact CG-CE2 3.93Å; L533-L553 HydrophobicContact CD2-CD1 4.14Å; L533-V588 HydrophobicContact CB-CG1 4.26Å; L533-V588 HydrophobicContact CD1-CG2 4.14Å
534	R	88.8	Confident	78.3	Confident	14 Å²	14	40.1 Å²	40.1	5%	0.053	21%	0.212	C	C	.	.	H	α-helix	trans	-61.8	-42.7	176.1	-70.2	172	73.4	-120.6	0	111.9	S498 D500 P501 V503 T506 I508 I530 D531 L532 A537 N538	S498-R534 PolarHBondContact O-NH2 3.28Å; D500-R534 PolarHBondContact O-NH2 3.31Å; P501-R534 HydrophobicContact CB-CB 4.38Å; V503-R534 PolarHBondContact O-NH1 3Å; T506-R534 WeakPolarHBondContact OG1-CD 3.14Å; T506-R534 PolarHBondContact OG1-NE 2.71Å; T506-R534 PolarHBondContact OG1-NH1 3.27Å; I508-R534 HydrophobicContact CD1-CG 3.45Å; I508-R534 VanDerWaalsContact CD1-CG 3.45Å; I530-R534 VanDerWaalsContact O-CG 3.32Å; I530-R534 WeakPolarHBondContact O-CG 3.5Å; I530-R534 PolarHBondContact O-N 3.06Å; D531-R534 PolarHBondContact O-N 2.77Å; D531-R534 IonicContact OD1-NH1 3.26Å; L532-R534 VanDerWaalsContact C-N 3.34Å; L532-R534 PolarHBondContact O-N 3.22Å; R534-A537 PolarHBondContact O-N 3.46Å; R534-N538 VanDerWaalsContact O-CB 3.29Å; R534-N538 WeakPolarHBondContact O-CB 3.45Å; R534-N538 PolarHBondContact O-N 3.36Å
535	L	86.2	Confident	76.3	Confident	14 Å²	14	42.3 Å²	42.3	7%	0.073	23%	0.225	C	C	.	.	H	α-helix	trans	-66.1	-36.8	176.2	-70.4	164	0	0	0	112.4	P501 F504 D531 L532 F891 I896 L900	P501-L535 HydrophobicContact CB-CD2 4.17Å; F504-L535 HydrophobicContact CE1-CD1 4.49Å; D531-L535 VanDerWaalsContact O-CG 3.32Å; D531-L535 WeakPolarHBondContact O-CG 3.46Å; D531-L535 PolarHBondContact O-N 3.17Å; L532-L535 PolarHBondContact O-N 3.45Å; L535-F891 HydrophobicContact CB-CE2 3.91Å; L535-F891 HydrophobicContact CB-CZ 3.91Å; L535-I896 HydrophobicContact CD1-CG2 3.86Å; L535-L900 HydrophobicContact CD1-CD1 4.27Å
536	L	88.1	Confident	74.3	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-70.8	-32.9	176.6	-70.1	167.6	0	0	0	113.1	L532 L533 F549 L872 L884 A887 V888 F891	L532-L536 HydrophobicContact CD1-CD1 4.37Å; L532-L536 HydrophobicContact CD1-CG 4.44Å; L532-L536 HydrophobicContact CG-CD1 4.09Å; L532-L536 VanDerWaalsContact O-CG 3.31Å; L532-L536 WeakPolarHBondContact O-CG 3.26Å; L532-L536 PolarHBondContact O-N 2.89Å; L533-L536 PolarHBondContact O-N 2.86Å; L536-F549 HydrophobicContact CB-CZ 4.29Å; L536-F549 WeakPolarHBondContact O-CE1 3.34Å; L536-L872 HydrophobicContact CD1-CD1 3.54Å; L536-L884 HydrophobicContact CB-CD2 4.5Å; L536-L884 HydrophobicContact CD2-CD2 4.17Å; L536-A887 HydrophobicContact CD2-CB 3.82Å; L536-V888 HydrophobicContact CD2-CG2 4.42Å; L536-F891 HydrophobicContact CD2-CD2 4.44Å; L536-F891 HydrophobicContact CD2-CE2 3.62Å; L536-F891 HydrophobicContact CD2-CZ 4.13Å; L536-F891 HydrophobicContact CG-CE2 3.96Å
537	A	84.9	Confident	72.9	Confident	14 Å²	14	48.1 Å²	48.1	12%	0.116	27%	0.269	C	S	.	.	H	α-helix	trans	-87.1	-31.6	-176.4	0	0	0	0	0	114.3	L533 R534 F549 Y551	L533-A537 WeakPolarHBondContact O-CB 3.46Å; L533-A537 PolarHBondContact O-N 3.26Å; R534-A537 PolarHBondContact O-N 3.46Å; A537-F549 HydrophobicContact CB-CD2 4.43Å; A537-F549 HydrophobicContact CB-CE1 4.34Å; A537-F549 HydrophobicContact CB-CE2 3.91Å; A537-F549 HydrophobicContact CB-CZ 3.85Å; A537-Y551 HydrophobicContact CB-CD1 3.77Å; A537-Y551 HydrophobicContact CB-CE1 3.42Å; A537-Y551 VanDerWaalsContact CB-CE1 3.42Å
538	N	70	Confident	72	Confident	71 Å²	71	51.1 Å²	51.1	38%	0.38	29%	0.288	S	S	.	.	S	Bend	trans	-99.4	150.2	-166.3	-158.2	-1.7	0	0	0	114.6	D499 P501 R534 T540	D499-N538 PolarHBondContact O-ND2 2.81Å; P501-N538 HydrophobicContact CB-CB 4.33Å; P501-N538 WeakPolarHBondContact CD-ND2 3.11Å; P501-N538 HydrophobicContact CG-CB 4.1Å; R534-N538 VanDerWaalsContact O-CB 3.29Å; R534-N538 WeakPolarHBondContact O-CB 3.45Å; R534-N538 PolarHBondContact O-N 3.36Å; N538-T540 PolarHBondContact O-N 2.84Å; N538-T540 VanDerWaalsContact O-N 3.13Å
539	R	53.4	Low	71.6	Confident	202 Å²	202	51.7 Å²	51.7	76%	0.762	29%	0.291	S	S	*	.			trans	-85.1	44.7	-169.3	-59.9	175.9	171.8	170.7	-2.7	114.5	G541 P548	R539-G541 PolarHBondContact O-N 2.92Å; R539-P548 HydrophobicContact CG-CB 4.24Å
540	T	46.9	Very low	71.4	Confident	54 Å²	54	55.7 Å²	55.7	33%	0.331	32%	0.315	S	S	.	.			trans	-75.3	69.5	178.9	35.5	0	0	0	0	113.7	P501 N538 L542	P501-T540 HydrophobicContact CG-CG2 3.32Å; N538-T540 PolarHBondContact O-N 2.84Å; N538-T540 VanDerWaalsContact O-N 3.13Å; T540-L542 VanDerWaalsContact O-CB 3.26Å; T540-L542 WeakPolarHBondContact O-CB 3.32Å; T540-L542 PolarHBondContact O-N 2.96Å
541	G	45.4	Very low	71.4	Confident	78 Å²	78	58.2 Å²	58.2	80%	0.804	33%	0.325	S	S	*	.	S	Bend	trans	67.9	21.5	155.4	0	0	0	0	0	117.6	R539	R539-G541 PolarHBondContact O-N 2.92Å
542	L	47.1	Very low	71.4	Confident	55 Å²	55	62.8 Å²	62.8	29%	0.288	35%	0.349	S	S	.	.			trans	-134.4	91.9	-156.1	-165.5	131.4	0	0	0	109.9	T540 L544 F891 R894	T540-L542 VanDerWaalsContact O-CB 3.26Å; T540-L542 WeakPolarHBondContact O-CB 3.32Å; T540-L542 PolarHBondContact O-N 2.96Å; L542-L544 VanDerWaalsContact C-N 3.26Å; L542-L544 PolarHBondContact O-N 3.2Å; L542-F891 HydrophobicContact CD2-CE1 4.31Å; L542-R894 VanDerWaalsContact CD1-CZ 3.47Å
543	E	51.4	Low	71.5	Confident	192 Å²	192	63.2 Å²	63.2	90%	0.897	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	14.6	-148	-57.6	-176	125.8	0	0	119.1
544	L	52	Low	71.7	Confident	93 Å²	93	64.3 Å²	64.3	49%	0.487	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-26.6	-169.3	-97.2	73.7	0	0	0	116.7	L542 S546	L542-L544 VanDerWaalsContact C-N 3.26Å; L542-L544 PolarHBondContact O-N 3.2Å; L544-S546 PolarHBondContact O-N 2.84Å
545	T	51.3	Low	72	Confident	56 Å²	56	64.1 Å²	64.1	34%	0.344	36%	0.357	S	S	.	.			trans	-87.3	101.6	176.3	43.9	0	0	0	0	110.9	T547 A887	T545-T547 PolarHBondContact O-N 3.47Å; T545-T547 VanDerWaalsContact O-N 3.09Å; T545-A887 HydrophobicContact CG2-CB 3.93Å
546	S	53.4	Low	72.3	Confident	106 Å²	106	63.6 Å²	63.6	74%	0.741	35%	0.354	S	S	*	.	S	Bend	trans	-62.8	-18.4	-172.7	-64.2	0	0	0	0	115	L544	L544-S546 PolarHBondContact O-N 2.84Å
547	T	62.4	Low	72.2	Confident	53 Å²	53	63.8 Å²	63.8	33%	0.325	36%	0.358	S	S	.	.	S	Bend	trans	-138.9	122.6	178.1	55.5	0	0	0	0	111.4	K470 T545 W880 E883	K470-T547 PolarHBondContact NZ-OG1 2.84Å; T545-T547 PolarHBondContact O-N 3.47Å; T545-T547 VanDerWaalsContact O-N 3.09Å; T547-W880 WeakPolarHBondContact O-CH2 3.25Å; T547-W880 WeakPolarHBondContact O-CZ3 3.45Å; T547-W880 WeakPolarHBondContact OG1-CH2 3.33Å; T547-W880 WeakPolarHBondContact OG1-CZ3 3.38Å; T547-E883 PolarHBondContact OG1-OE2 2.77Å
548	P	74.8	Confident	72.3	Confident	63 Å²	63	66.5 Å²	66.5	41%	0.409	37%	0.371	S	S	.	.			trans	-69.2	147.2	169	31.6	-35.7	0	0	0	110.2	R539	R539-P548 HydrophobicContact CG-CB 4.24Å
549	F	86.1	Confident	73	Confident	12 Å²	12	65.4 Å²	65.4	5%	0.053	38%	0.376	C	S	.	.			trans	-118.6	157.4	171.3	66.4	-88.7	0	0	0	111.2	T472 L474 L533 L536 A537 Y551 W880 L884	T472-F549 WeakPolarHBondContact O-CA 3.4Å; L474-F549 HydrophobicContact CB-CD2 4.38Å; L474-F549 HydrophobicContact CD1-CB 4.36Å; L474-F549 HydrophobicContact CD1-CD2 3.78Å; L474-F549 HydrophobicContact CD1-CE2 4.18Å; L474-F549 HydrophobicContact CD1-CG 3.98Å; L474-F549 HydrophobicContact CG-CB 4.43Å; L474-F549 HydrophobicContact CG-CD2 4.16Å; L474-F549 HydrophobicContact CG-CG 4.45Å; L533-F549 HydrophobicContact CD1-CE2 4.32Å; L533-F549 HydrophobicContact CD1-CZ 4.45Å; L536-F549 HydrophobicContact CB-CZ 4.29Å; L536-F549 WeakPolarHBondContact O-CE1 3.34Å; A537-F549 HydrophobicContact CB-CD2 4.43Å; A537-F549 HydrophobicContact CB-CE1 4.34Å; A537-F549 HydrophobicContact CB-CE2 3.91Å; A537-F549 HydrophobicContact CB-CZ 3.85Å; F549-Y551 HydrophobicContact CD2-CD1 4.31Å; F549-Y551 AromaticContact CE2-CD1 3.97Å; F549-Y551 HydrophobicContact CE2-CD1 3.97Å; F549-W880 HydrophobicContact CB-CH2 3.73Å; F549-W880 HydrophobicContact CB-CZ2 3.78Å; F549-W880 AromaticContact CD1-CH2 3.98Å; F549-W880 HydrophobicContact CD1-CH2 3.98Å; F549-W880 HydrophobicContact CD1-CZ3 4.02Å; F549-W880 HydrophobicContact CG-CH2 4.29Å; F549-W880 HydrophobicContact CG-CZ2 4.49Å; F549-L884 HydrophobicContact CE1-CD2 4.18Å
550	T	90	Very high	74.6	Confident	83 Å²	83	60.6 Å²	60.6	51%	0.509	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	158.1	168.3	53	0	0	0	0	108.8	T472 H473 L474	T472-T550 PolarHBondContact O-N 2.83Å; T472-T550 PolarHBondContact O-OG1 3.37Å; H473-T550 CarbonylContact C-O 3.56Å; H473-T550 VanDerWaalsContact CA-O 3.31Å; H473-T550 WeakPolarHBondContact CA-O 3.38Å; H473-T550 WeakPolarHBondContact CB-OG1 3.36Å; H473-T550 PolarHBondContact ND1-OG1 2.9Å; L474-T550 PolarHBondContact N-O 2.9Å
551	Y	91.9	Very high	76.5	Confident	55 Å²	55	59.7 Å²	59.7	22%	0.216	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	150.1	-177.7	59.2	-86.6	0	0	0	113.6	L474 V476 I508 L533 A537 F549	L474-Y551 WeakPolarHBondContact O-CA 3.49Å; L474-Y551 WeakPolarHBondContact O-CB 3.43Å; V476-Y551 HydrophobicContact CG2-CG 4.35Å; I508-Y551 HydrophobicContact CD1-CE2 4.39Å; I508-Y551 WeakPolarHBondContact CD1-OH 3.36Å; L533-Y551 HydrophobicContact CD1-CD1 4.29Å; L533-Y551 HydrophobicContact CD1-CD2 4.45Å; L533-Y551 HydrophobicContact CD1-CE1 4.4Å; L533-Y551 HydrophobicContact CD1-CG 4.33Å; L533-Y551 HydrophobicContact CD2-CD2 3.79Å; L533-Y551 HydrophobicContact CD2-CE2 3.53Å; L533-Y551 HydrophobicContact CD2-CG 4.47Å; L533-Y551 HydrophobicContact CG-CD2 4.29Å; L533-Y551 HydrophobicContact CG-CE1 4.24Å; L533-Y551 HydrophobicContact CG-CE2 3.93Å; A537-Y551 HydrophobicContact CB-CD1 3.77Å; A537-Y551 HydrophobicContact CB-CE1 3.42Å; A537-Y551 VanDerWaalsContact CB-CE1 3.42Å; F549-Y551 HydrophobicContact CD2-CD1 4.31Å; F549-Y551 AromaticContact CE2-CD1 3.97Å; F549-Y551 HydrophobicContact CE2-CD1 3.97Å
552	D	92.9	Very high	78.3	Confident	95 Å²	95	56.2 Å²	56.2	51%	0.508	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.2	162.7	-74	-7.8	0	0	0	107.6	H473 L474 V476	H473-D552 IonicContact CE1-OD1 3.18Å; H473-D552 PolarHBondContact CE1-OD1 2.92Å; H473-D552 VanDerWaalsContact CE1-OD1 3.25Å; H473-D552 IonicContact NE2-OD1 3.89Å; H473-D552 PolarHBondContact NE2-OD1 2.99Å; H473-D552 IonicContact NE2-OD2 2.74Å; H473-D552 PolarHBondContact NE2-OD2 3.14Å; L474-D552 PolarHBondContact O-N 3.18Å; L474-D552 VanDerWaalsContact O-N 3.14Å; V476-D552 PolarHBondContact N-O 3.13Å
553	L	93.8	Very high	79.9	Confident	10 Å²	10	56.1 Å²	56.1	5%	0.052	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.6	-179.5	-176.9	63.4	0	0	0	111.4	V476 T478 I508 C510 T511 C525 I530 L533	V476-L553 HydrophobicContact CB-CD1 4.19Å; V476-L553 HydrophobicContact CG1-CD1 3.9Å; V476-L553 WeakPolarHBondContact O-CA 3.21Å; T478-L553 HydrophobicContact CG2-CD1 3.85Å; T478-L553 HydrophobicContact CG2-CG 4.46Å; I508-L553 HydrophobicContact CG2-CD2 4.1Å; C510-L553 WeakPolarHBondContact CA-O 3.45Å; C510-L553 HydrophobicContact CB-CB 4.44Å; C510-L553 HydrophobicContact CB-CD2 3.87Å; C510-L553 HydrophobicContact CB-CG 3.91Å; T511-L553 PolarHBondContact N-O 3.03Å; T511-L553 VanDerWaalsContact N-O 3.12Å; C525-L553 HydrophobicContact CB-CD2 4.21Å; I530-L553 HydrophobicContact CD1-CD2 3.78Å; L533-L553 HydrophobicContact CD2-CD1 4.14Å
554	H	94.4	Very high	81.4	Confident	24 Å²	24	49.2 Å²	49.2	11%	0.111	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	149.8	172.5	74	-94.6	0	0	0	112.9	V476 V477 T478 T511 E578	V476-H554 PolarHBondContact O-N 3.26Å; V477-H554 CarbonylContact C-O 3.18Å; V477-H554 WeakPolarHBondContact CA-O 3.18Å; T478-H554 PolarHBondContact N-O 3.13Å; T511-H554 CarbonylContact O-C 3.58Å; T511-H554 WeakPolarHBondContact O-CA 3.45Å; T511-H554 WeakPolarHBondContact O-CB 3.47Å; H554-E578 IonicContact CD2-OE2 2.71Å; H554-E578 IonicContact CE1-OE2 2.84Å; H554-E578 IonicContact NE2-OE1 3.57Å; H554-E578 IonicContact NE2-OE2 3.14Å; H554-E578 PolarHBondContact NE2-OE2 3.25Å
555	L	94.8	Very high	82.4	Confident	10 Å²	10	47.8 Å²	47.8	5%	0.052	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	138	171.8	-70.3	159.2	0	0	0	108.9	T478 T487 T511 H512 Y523	T478-L555 HydrophobicContact CG2-CD2 3.83Å; T478-L555 CarbonylContact O-C 3.54Å; T478-L555 WeakPolarHBondContact O-CA 3.42Å; T487-L555 HydrophobicContact CG2-CD1 3.89Å; T487-L555 HydrophobicContact CG2-CD2 4.16Å; T511-L555 PolarHBondContact O-N 2.97Å; H512-L555 HydrophobicContact CB-CB 4.17Å; H512-L555 HydrophobicContact CB-CD1 4.17Å; Y523-L555 HydrophobicContact CD2-CD1 4.33Å
556	V	93.4	Very high	83.3	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.018	30%	0.302	C	S	.	.			trans	-56.7	134.4	178.1	63.6	0	0	0	0	111.3	V477 T478 I479 D558 G559 I575	V477-V556 HydrophobicContact CG2-CB 3.9Å; V477-V556 HydrophobicContact CG2-CG2 4.5Å; T478-V556 PolarHBondContact O-N 3.14Å; I479-V556 HydrophobicContact CB-CG1 4Å; I479-V556 HydrophobicContact CD1-CG1 4.36Å; I479-V556 HydrophobicContact CG1-CG1 3.97Å; V556-D558 WeakPolarHBondContact CG2-OD1 3.25Å; V556-D558 PolarHBondContact O-N 2.98Å; V556-G559 PolarHBondContact O-N 2.94Å; V556-I575 HydrophobicContact CB-CG1 3.97Å; V556-I575 HydrophobicContact CG1-CG1 4.31Å; V556-I575 HydrophobicContact CG2-CG1 4.05Å
557	G	86.9	Confident	83.9	Confident	11 Å²	11	54.3 Å²	54.3	11%	0.113	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-35.1	-169.2	0	0	0	0	0	115.5	P515 E578	P515-G557 WeakPolarHBondContact CD-O 3.26Å; P515-G557 WeakPolarHBondContact CG-O 3.39Å; G557-E578 PolarHBondContact N-OE1 2.95Å
558	D	85.3	Confident	83.7	Confident	71 Å²	71	60.5 Å²	60.5	38%	0.38	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-0.8	-177.5	62.5	7.7	0	0	0	114	V556 Q560 G574	V556-D558 WeakPolarHBondContact CG2-OD1 3.25Å; V556-D558 PolarHBondContact O-N 2.98Å; D558-Q560 PolarHBondContact O-N 3.33Å; D558-Q560 PolarHBondContact OD1-N 3.44Å; D558-G574 VanDerWaalsContact OD1-CA 3.31Å; D558-G574 WeakPolarHBondContact OD1-CA 3.49Å; D558-G574 WeakPolarHBondContact OD2-CA 3.27Å; D558-G574 PolarHBondContact OD2-N 3.35Å
559	G	85.7	Confident	83.3	Confident	47 Å²	47	60.7 Å²	60.7	49%	0.485	33%	0.329	S	S	.	.	S	Bend	trans	69.4	12.7	-175.6	0	0	0	0	0	114.9	I479 V556	I479-G559 WeakPolarHBondContact CD1-O 3.38Å; V556-G559 PolarHBondContact O-N 2.94Å
560	Q	86.6	Confident	82.7	Confident	101 Å²	101	67.4 Å²	67.4	47%	0.472	36%	0.36	S	S	.	.			trans	-109.5	150.9	-177.7	-62.2	-172.4	0.3	0	0	112.9	D558 T573 G574 I575	D558-Q560 PolarHBondContact O-N 3.33Å; D558-Q560 PolarHBondContact OD1-N 3.44Å; Q560-T573 PolarHBondContact OE1-OG1 3.29Å; Q560-T573 VanDerWaalsContact OE1-OG1 3.07Å; Q560-G574 WeakPolarHBondContact O-CA 3.46Å; Q560-I575 PolarHBondContact O-N 2.86Å; Q560-I575 VanDerWaalsContact O-N 3.17Å
561	V	86.7	Confident	82.4	Confident	35 Å²	35	69.9 Å²	69.9	21%	0.212	36%	0.364	C	S	.	.			trans	-71.3	-36.8	169.7	179.1	0	0	0	0	110.7	I479 I575 I576 V591	I479-V561 HydrophobicContact CD1-CG2 3.85Å; V561-I575 WeakPolarHBondContact O-CB 3.47Å; V561-I575 PolarHBondContact O-N 2.9Å; V561-I576 PolarHBondContact O-N 2.62Å; V561-V591 HydrophobicContact CG1-CB 4.31Å; V561-V591 HydrophobicContact CG1-CG1 3.75Å; V561-V591 HydrophobicContact CG1-CG2 4.03Å
562	G	83.1	Confident	82.2	Confident	5 Å²	5	68.9 Å²	68.9	5%	0.052	36%	0.359	C	S	.	.			trans	122.5	128.5	175.3	0	0	0	0	0	113	T573 R597	G562-T573 WeakPolarHBondContact CA-O 3.33Å; G562-R597 PolarHBondContact O-NH2 2.83Å
563	D	81.9	Confident	81.9	Confident	54 Å²	54	66.2 Å²	66.2	29%	0.289	35%	0.346	S	S	.	.			trans	-131.6	173.7	169.9	-159.7	1.5	0	0	0	109.1	W572 T573	D563-W572 WeakPolarHBondContact O-CA 3.18Å; D563-T573 PolarHBondContact N-OG1 2.99Å; D563-T573 VanDerWaalsContact N-OG1 3.13Å; D563-T573 PolarHBondContact O-N 3.39Å; D563-T573 PolarHBondContact O-OG1 3.39Å
564	V	81.4	Confident	81.7	Confident	46 Å²	46	65.9 Å²	65.9	28%	0.279	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-86	118.2	176.3	-179	0	0	0	0	109.5	E566 W572	V564-E566 PolarHBondContact O-N 2.84Å; V564-W572 HydrophobicContact CG2-CD2 3.95Å; V564-W572 HydrophobicContact CG2-CE3 4.12Å; V564-W572 HydrophobicContact CG2-CH2 3.81Å; V564-W572 HydrophobicContact CG2-CZ2 3.6Å; V564-W572 HydrophobicContact CG2-CZ3 4.05Å
565	D	74.1	Confident	81.7	Confident	64 Å²	64	64.8 Å²	64.8	34%	0.342	34%	0.341	S	S	.	.			trans	-70	105	169.8	-180	16.2	0	0	0	109.9	N567 H570 K571	D565-N567 PolarHBondContact O-N 3.36Å; D565-N567 PolarHBondContact OD1-N 3.42Å; D565-N567 VanDerWaalsContact OD1-N 3.08Å; D565-H570 PolarHBondContact O-N 2.91Å; D565-K571 PolarHBondContact N-O 3.1Å
566	E	69.7	Low	81.6	Confident	156 Å²	156	64.3 Å²	64.3	73%	0.729	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-23	179.2	-65.1	-170.3	166.2	0	0	112.8	V564 E568	V564-E566 PolarHBondContact O-N 2.84Å; E566-E568 PolarHBondContact O-N 3.05Å
567	N	66.1	Low	81.5	Confident	142 Å²	142	64.9 Å²	64.9	76%	0.759	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-23.9	-157.5	-74.9	-60.5	0	0	0	116.3	D565	D565-N567 PolarHBondContact O-N 3.36Å; D565-N567 PolarHBondContact OD1-N 3.42Å; D565-N567 VanDerWaalsContact OD1-N 3.08Å
568	E	58.9	Low	81.7	Confident	184 Å²	184	65.8 Å²	65.8	86%	0.86	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-160.7	-15.7	178	-120.5	163.7	-136.9	0	0	117.7	E566	E566-E568 PolarHBondContact O-N 3.05Å
569	T	65.4	Low	82.1	Confident	67 Å²	67	62.4 Å²	62.4	41%	0.411	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.7	-2.6	-170.1	63.8	0	0	0	0	117.8	K571	T569-K571 PolarHBondContact O-N 3.32Å; T569-K571 WeakPolarHBondContact OG1-CD 3.46Å; T569-K571 WeakPolarHBondContact OG1-CG 3.39Å
570	H	73.8	Confident	82.3	Confident	152 Å²	152	62.8 Å²	62.8	70%	0.704	32%	0.318	S	S	*	.			trans	47.2	32.9	-172.4	-66.3	-58.2	0	0	0	113.2	D565	D565-H570 PolarHBondContact O-N 2.91Å
571	K	83.3	Confident	82.2	Confident	136 Å²	136	62 Å²	62	59%	0.591	32%	0.324	S	S	*	.			trans	-87.6	146.1	175.7	-73.2	176.7	-169.7	165	0	109.1	D565 T569	D565-K571 PolarHBondContact N-O 3.1Å; T569-K571 PolarHBondContact O-N 3.32Å; T569-K571 WeakPolarHBondContact OG1-CD 3.46Å; T569-K571 WeakPolarHBondContact OG1-CG 3.39Å
572	W	87	Confident	82.1	Confident	33 Å²	33	62.1 Å²	62.1	13%	0.125	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-82.2	134	170.9	-71.5	81.3	0	0	0	109.6	D563 V564 I576 G577 L580 E596 R597 R600	D563-W572 WeakPolarHBondContact O-CA 3.18Å; V564-W572 HydrophobicContact CG2-CD2 3.95Å; V564-W572 HydrophobicContact CG2-CE3 4.12Å; V564-W572 HydrophobicContact CG2-CH2 3.81Å; V564-W572 HydrophobicContact CG2-CZ2 3.6Å; V564-W572 HydrophobicContact CG2-CZ3 4.05Å; W572-I576 HydrophobicContact CB-CB 4.35Å; W572-I576 HydrophobicContact CB-CG2 4Å; W572-I576 HydrophobicContact CD2-CB 4.39Å; W572-I576 HydrophobicContact CD2-CG2 3.59Å; W572-I576 HydrophobicContact CE3-CB 3.93Å; W572-I576 HydrophobicContact CE3-CG1 4.38Å; W572-I576 HydrophobicContact CE3-CG2 3.51Å; W572-I576 HydrophobicContact CG-CG2 3.84Å; W572-I576 HydrophobicContact CZ3-CG2 4.18Å; W572-G577 VanDerWaalsContact O-CA 3.22Å; W572-G577 WeakPolarHBondContact O-CA 3.37Å; W572-L580 HydrophobicContact CB-CD1 4.07Å; W572-L580 HydrophobicContact CG-CD1 3.77Å; W572-E596 HydrophobicContact CH2-CB 3.99Å; W572-E596 WeakPolarHBondContact CZ2-O 3.46Å; W572-R597 HydrophobicContact CH2-CG 4.04Å; W572-R597 HydrophobicContact CZ3-CG 3.91Å; W572-R600 HydrophobicContact CZ2-CG 4.27Å
573	T	88.3	Confident	82.3	Confident	39 Å²	39	64.9 Å²	64.9	24%	0.239	35%	0.349	C	S	.	.			trans	-83	178.7	167.4	64	0	0	0	0	110.7	Q560 G562 D563 G577	Q560-T573 PolarHBondContact OE1-OG1 3.29Å; Q560-T573 VanDerWaalsContact OE1-OG1 3.07Å; G562-T573 WeakPolarHBondContact CA-O 3.33Å; D563-T573 PolarHBondContact N-OG1 2.99Å; D563-T573 VanDerWaalsContact N-OG1 3.13Å; D563-T573 PolarHBondContact O-N 3.39Å; D563-T573 PolarHBondContact O-OG1 3.39Å; T573-G577 PolarHBondContact O-N 3.01Å
574	G	89.3	Confident	82.8	Confident	4 Å²	4	62.3 Å²	62.3	4%	0.041	34%	0.335	C	S	.	.	H	α-helix	trans	63.9	-158	166.8	0	0	0	0	0	116.4	D558 Q560 I576 G577 E578	D558-G574 VanDerWaalsContact OD1-CA 3.31Å; D558-G574 WeakPolarHBondContact OD1-CA 3.49Å; D558-G574 WeakPolarHBondContact OD2-CA 3.27Å; D558-G574 PolarHBondContact OD2-N 3.35Å; Q560-G574 WeakPolarHBondContact O-CA 3.46Å; G574-I576 PolarHBondContact O-N 2.87Å; G574-G577 WeakPolarHBondContact O-CA 2.98Å; G574-G577 PolarHBondContact O-N 2.86Å; G574-E578 PolarHBondContact O-N 2.96Å
575	I	93	Very high	83.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-50.5	-43.3	176.2	-71.7	173.2	0	0	0	111.2	V477 I479 V556 Q560 V561 E578 I579 A587 A589 V591	V477-I575 HydrophobicContact CG1-CB 4.49Å; V477-I575 HydrophobicContact CG1-CG1 4.3Å; V477-I575 HydrophobicContact CG1-CG2 3.9Å; V477-I575 HydrophobicContact CG2-CG1 4.14Å; I479-I575 HydrophobicContact CB-CD1 3.96Å; I479-I575 HydrophobicContact CG2-CD1 4Å; V556-I575 HydrophobicContact CB-CG1 3.97Å; V556-I575 HydrophobicContact CG1-CG1 4.31Å; V556-I575 HydrophobicContact CG2-CG1 4.05Å; Q560-I575 PolarHBondContact O-N 2.86Å; Q560-I575 VanDerWaalsContact O-N 3.17Å; V561-I575 WeakPolarHBondContact O-CB 3.47Å; V561-I575 PolarHBondContact O-N 2.9Å; I575-E578 PolarHBondContact O-N 2.61Å; I575-I579 HydrophobicContact CG2-CG1 4.41Å; I575-I579 VanDerWaalsContact O-CG1 3.3Å; I575-I579 WeakPolarHBondContact O-CG1 3.42Å; I575-I579 PolarHBondContact O-N 3.47Å; I575-A587 HydrophobicContact CG2-CB 3.38Å; I575-A589 HydrophobicContact CD1-CB 3.72Å; I575-V591 HydrophobicContact CD1-CG2 4.31Å; I575-V591 HydrophobicContact CG2-CG2 4.5Å
576	I	93.4	Very high	84.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.7	-43.4	179.4	-55.2	-55.9	0	0	0	111.1	V561 W572 G574 I579 L580 V591 R597 V601 V873	V561-I576 PolarHBondContact O-N 2.62Å; W572-I576 HydrophobicContact CB-CB 4.35Å; W572-I576 HydrophobicContact CB-CG2 4Å; W572-I576 HydrophobicContact CD2-CB 4.39Å; W572-I576 HydrophobicContact CD2-CG2 3.59Å; W572-I576 HydrophobicContact CE3-CB 3.93Å; W572-I576 HydrophobicContact CE3-CG1 4.38Å; W572-I576 HydrophobicContact CE3-CG2 3.51Å; W572-I576 HydrophobicContact CG-CG2 3.84Å; W572-I576 HydrophobicContact CZ3-CG2 4.18Å; G574-I576 PolarHBondContact O-N 2.87Å; I576-I579 PolarHBondContact O-N 3.38Å; I576-L580 HydrophobicContact CG2-CD1 3.98Å; I576-L580 HydrophobicContact CG2-CG 4.48Å; I576-L580 WeakPolarHBondContact O-CB 3.38Å; I576-L580 VanDerWaalsContact O-CG 3.27Å; I576-L580 WeakPolarHBondContact O-CG 3.49Å; I576-L580 PolarHBondContact O-N 2.9Å; I576-V591 HydrophobicContact CD1-CG1 4.49Å; I576-R597 HydrophobicContact CD1-CG 4.41Å; I576-R597 HydrophobicContact CG1-CG 4.33Å; I576-V601 HydrophobicContact CD1-CG1 4.42Å; I576-V601 HydrophobicContact CD1-CG2 3.97Å; I576-V601 HydrophobicContact CG2-CG1 3.98Å; I576-V873 HydrophobicContact CD1-CG1 4.02Å
577	G	90.8	Very high	85.5	Confident	15 Å²	15	50.9 Å²	50.9	16%	0.155	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-43.4	173.8	0	0	0	0	0	113.3	W572 T573 G574 L580 S581	W572-G577 VanDerWaalsContact O-CA 3.22Å; W572-G577 WeakPolarHBondContact O-CA 3.37Å; T573-G577 PolarHBondContact O-N 3.01Å; G574-G577 WeakPolarHBondContact O-CA 2.98Å; G574-G577 PolarHBondContact O-N 2.86Å; G577-L580 PolarHBondContact O-N 3.07Å; G577-S581 VanDerWaalsContact O-CB 3.32Å; G577-S581 WeakPolarHBondContact O-CB 3.35Å; G577-S581 PolarHBondContact O-N 2.85Å; G577-S581 PolarHBondContact O-OG 2.84Å; G577-S581 VanDerWaalsContact O-OG 3.09Å
578	E	92.1	Very high	86.9	Confident	30 Å²	30	44.2 Å²	44.2	14%	0.14	24%	0.242	C	C	.	.	H	α-helix	trans	-62	-45.2	176.8	-77.4	-143.1	-140.1	0	0	112.9	H554 G557 G574 I575 S581 G582 T583 A584	H554-E578 IonicContact CD2-OE2 2.71Å; H554-E578 IonicContact CE1-OE2 2.84Å; H554-E578 IonicContact NE2-OE1 3.57Å; H554-E578 IonicContact NE2-OE2 3.14Å; H554-E578 PolarHBondContact NE2-OE2 3.25Å; G557-E578 PolarHBondContact N-OE1 2.95Å; G574-E578 PolarHBondContact O-N 2.96Å; I575-E578 PolarHBondContact O-N 2.61Å; E578-S581 PolarHBondContact O-N 2.89Å; E578-S581 PolarHBondContact O-OG 3.25Å; E578-G582 PolarHBondContact O-N 3.38Å; E578-T583 VanDerWaalsContact CA-OG1 3.24Å; E578-T583 WeakPolarHBondContact CA-OG1 2.95Å; E578-T583 WeakPolarHBondContact CB-OG1 3.47Å; E578-T583 WeakPolarHBondContact CG-OG1 3.45Å; E578-T583 PolarHBondContact O-N 2.86Å; E578-T583 VanDerWaalsContact O-N 3.12Å; E578-T583 PolarHBondContact O-OG1 3.09Å; E578-T583 VanDerWaalsContact O-OG1 3.12Å; E578-T583 WeakPolarHBondContact OE2-CB 3.32Å; E578-T583 PolarHBondContact OE2-OG1 3.43Å; E578-A584 HydrophobicContact CB-CB 4.44Å
579	I	93.1	Very high	88.7	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-39.9	176.5	-67.5	-72.6	0	0	0	111.7	V477 I575 I576 G582 A584 A587 V601 K875	V477-I579 HydrophobicContact CG1-CD1 4.28Å; V477-I579 HydrophobicContact CG1-CG1 4.4Å; I575-I579 HydrophobicContact CG2-CG1 4.41Å; I575-I579 VanDerWaalsContact O-CG1 3.3Å; I575-I579 WeakPolarHBondContact O-CG1 3.42Å; I575-I579 PolarHBondContact O-N 3.47Å; I576-I579 PolarHBondContact O-N 3.38Å; I579-G582 PolarHBondContact O-N 2.69Å; I579-A584 HydrophobicContact CD1-CB 3.74Å; I579-A584 HydrophobicContact CG1-CB 4.4Å; I579-A587 HydrophobicContact CD1-CB 4.22Å; I579-A587 HydrophobicContact CG1-CB 4.31Å; I579-V601 HydrophobicContact CG2-CG1 4.01Å; I579-K875 HydrophobicContact CG2-CB 4.21Å
580	L	89.9	Confident	90	Very high	54 Å²	54	32.8 Å²	32.8	28%	0.283	19%	0.185	S	C	.	.	H	α-helix	trans	-70.3	-40.5	178.9	-71.2	174	0	0	0	112.2	W572 I576 G577 G582 R600 V601	W572-L580 HydrophobicContact CB-CD1 4.07Å; W572-L580 HydrophobicContact CG-CD1 3.77Å; I576-L580 HydrophobicContact CG2-CD1 3.98Å; I576-L580 HydrophobicContact CG2-CG 4.48Å; I576-L580 WeakPolarHBondContact O-CB 3.38Å; I576-L580 VanDerWaalsContact O-CG 3.27Å; I576-L580 WeakPolarHBondContact O-CG 3.49Å; I576-L580 PolarHBondContact O-N 2.9Å; G577-L580 PolarHBondContact O-N 3.07Å; L580-G582 VanDerWaalsContact C-N 3.29Å; L580-G582 PolarHBondContact O-N 3.38Å; L580-R600 HydrophobicContact CD1-CB 4.4Å; L580-R600 HydrophobicContact CD2-CB 4.45Å; L580-V601 HydrophobicContact CD2-CG1 4.12Å; L580-V601 HydrophobicContact CG-CG1 4.2Å
581	S	85.7	Confident	91	Very high	85 Å²	85	25.6 Å²	25.6	59%	0.594	15%	0.151	S	C	*	.	H	α-helix	trans	-70.9	-22.4	176.1	70.3	0	0	0	0	113.4	G577 E578	G577-S581 VanDerWaalsContact O-CB 3.32Å; G577-S581 WeakPolarHBondContact O-CB 3.35Å; G577-S581 PolarHBondContact O-N 2.85Å; G577-S581 PolarHBondContact O-OG 2.84Å; G577-S581 VanDerWaalsContact O-OG 3.09Å; E578-S581 PolarHBondContact O-N 2.89Å; E578-S581 PolarHBondContact O-OG 3.25Å
582	G	84.7	Confident	91.5	Very high	38 Å²	38	19.4 Å²	19.4	39%	0.392	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	21	-179.2	0	0	0	0	0	113.9	E578 I579 L580 A584	E578-G582 PolarHBondContact O-N 3.38Å; I579-G582 PolarHBondContact O-N 2.69Å; L580-G582 VanDerWaalsContact C-N 3.29Å; L580-G582 PolarHBondContact O-N 3.38Å; G582-A584 VanDerWaalsContact C-N 3.32Å
583	T	86.9	Confident	91.9	Very high	62 Å²	62	20.1 Å²	20.1	38%	0.38	13%	0.131	S	C	.	.	S	Bend	trans	-67.6	-38.6	165.8	54.5	0	0	0	0	110.5	K475 E578	K475-T583 WeakPolarHBondContact CD-O 3.49Å; E578-T583 VanDerWaalsContact CA-OG1 3.24Å; E578-T583 WeakPolarHBondContact CA-OG1 2.95Å; E578-T583 WeakPolarHBondContact CB-OG1 3.47Å; E578-T583 WeakPolarHBondContact CG-OG1 3.45Å; E578-T583 PolarHBondContact O-N 2.86Å; E578-T583 VanDerWaalsContact O-N 3.12Å; E578-T583 PolarHBondContact O-OG1 3.09Å; E578-T583 VanDerWaalsContact O-OG1 3.12Å; E578-T583 WeakPolarHBondContact OE2-CB 3.32Å; E578-T583 PolarHBondContact OE2-OG1 3.43Å
584	A	91.9	Very high	92	Very high	1 Å²	1	19 Å²	19	1%	0.008	12%	0.124	C	C	.	.			trans	-110.4	152.2	172.7	0	0	0	0	0	111.7	V477 E578 I579 G582	V477-A584 HydrophobicContact CB-CB 3.71Å; V477-A584 HydrophobicContact CG1-CB 3.58Å; E578-A584 HydrophobicContact CB-CB 4.44Å; I579-A584 HydrophobicContact CD1-CB 3.74Å; I579-A584 HydrophobicContact CG1-CB 4.4Å; G582-A584 VanDerWaalsContact C-N 3.32Å
585	D	91.7	Very high	92.1	Very high	25 Å²	25	22.8 Å²	22.8	13%	0.134	15%	0.148	C	C	.	.	S	Bend	trans	-105.5	-26.7	175.6	-77.7	-58.2	0	0	0	112.8	K471 L474 K475 N878	K471-D585 WeakPolarHBondContact CD-OD2 3.49Å; K471-D585 IonicContact NZ-OD1 2.71Å; K471-D585 PolarHBondContact NZ-OD1 2.9Å; K471-D585 IonicContact NZ-OD2 3.13Å; K471-D585 PolarHBondContact NZ-OD2 2.89Å; L474-D585 HydrophobicContact CB-CB 4.48Å; L474-D585 HydrophobicContact CD2-CB 4.09Å; K475-D585 PolarHBondContact O-N 3.11Å; D585-N878 PolarHBondContact O-ND2 2.78Å
586	L	94.4	Very high	91.9	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	142.1	-180	173.7	65.4	0	0	0	108.7	L474 K475 V476 V477 V588 L872 V873 M874 L884	L474-L586 HydrophobicContact CD1-CD2 4.48Å; K475-L586 PolarHBondContact O-N 3.14Å; V476-L586 VanDerWaalsContact CA-O 3.28Å; V476-L586 WeakPolarHBondContact CA-O 3.37Å; V476-L586 HydrophobicContact CG2-CB 4.4Å; V476-L586 HydrophobicContact CG2-CD2 4.27Å; V477-L586 PolarHBondContact N-O 3.06Å; L586-V588 HydrophobicContact CD2-CG2 3.95Å; L586-V588 HydrophobicContact CG-CG2 3.97Å; L586-L872 HydrophobicContact CD1-CB 4.19Å; L586-V873 CarbonylContact C-O 3.47Å; L586-V873 WeakPolarHBondContact CA-O 3.39Å; L586-M874 HydrophobicContact CD1-CE 4.46Å; L586-M874 HydrophobicContact CD1-CG 3.64Å; L586-M874 HydrophobicContact CD1-SD 4.05Å; L586-L884 HydrophobicContact CD1-CD1 3.95Å; L586-L884 HydrophobicContact CD2-CD1 4.14Å
587	A	96.5	Very high	91.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.6	167.6	0	0	0	0	0	110.7	V477 I575 I579 V873	V477-A587 HydrophobicContact CG1-CB 3.58Å; V477-A587 WeakPolarHBondContact O-CA 3.38Å; I575-A587 HydrophobicContact CG2-CB 3.38Å; I579-A587 HydrophobicContact CD1-CB 4.22Å; I579-A587 HydrophobicContact CG1-CB 4.31Å; A587-V873 HydrophobicContact CB-CB 3.84Å; A587-V873 HydrophobicContact CB-CG2 4.13Å; A587-V873 PolarHBondContact N-O 3.26Å; A587-V873 PolarHBondContact O-N 3Å
588	V	95.7	Very high	91.9	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.012	18%	0.176	C	C	.	.			trans	-124.2	91.4	174.4	-172.7	0	0	0	0	108.1	V476 V477 T478 C529 L533 L586 L872	V476-V588 HydrophobicContact CG1-CB 4.09Å; V476-V588 HydrophobicContact CG1-CG2 3.81Å; V477-V588 PolarHBondContact O-N 2.85Å; T478-V588 WeakPolarHBondContact CB-O 3.3Å; T478-V588 PolarHBondContact OG1-O 2.76Å; C529-V588 HydrophobicContact CB-CG1 4.08Å; C529-V588 WeakPolarHBondContact O-CG1 3.36Å; L533-V588 HydrophobicContact CB-CG1 4.26Å; L533-V588 HydrophobicContact CD1-CG2 4.14Å; L586-V588 HydrophobicContact CD2-CG2 3.95Å; L586-V588 HydrophobicContact CG-CG2 3.97Å; V588-L872 HydrophobicContact CB-CD2 4.37Å; V588-L872 HydrophobicContact CG1-CD2 3.92Å; V588-L872 HydrophobicContact CG2-CD2 4.22Å
589	A	95.2	Very high	91.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-155	164.4	-172.1	0	0	0	0	0	109.4	I479 I575 V591	I479-A589 HydrophobicContact CG2-CB 3.84Å; I575-A589 HydrophobicContact CD1-CB 3.72Å; A589-V591 HydrophobicContact CB-CG2 3.88Å; A589-V591 PolarHBondContact O-N 3.08Å
590	P	94.2	Very high	91.6	Very high	11 Å²	11	36.7 Å²	36.7	7%	0.071	22%	0.219	C	C	.	.			trans	-72.5	71.3	171.1	31.8	-35.7	0	0	0	110.8	F484 Y870	F484-P590 HydrophobicContact CB-CB 4.36Å; F484-P590 HydrophobicContact CB-CG 3.92Å; F484-P590 HydrophobicContact CD1-CB 4.2Å; F484-P590 HydrophobicContact CD2-CB 3.73Å; F484-P590 HydrophobicContact CD2-CG 3.77Å; F484-P590 HydrophobicContact CE2-CB 4.08Å; F484-P590 HydrophobicContact CG-CB 3.81Å; F484-P590 HydrophobicContact CG-CG 3.85Å; F484-P590 HydrophobicContact CZ-CB 4.49Å; P590-Y870 HydrophobicContact CB-CD1 4.36Å; P590-Y870 HydrophobicContact CB-CD2 3.9Å; P590-Y870 HydrophobicContact CB-CE1 4.16Å; P590-Y870 HydrophobicContact CB-CE2 3.68Å; P590-Y870 HydrophobicContact CB-CG 4.24Å
591	V	94.7	Very high	91.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	21%	0.206	C	C	.	.			trans	-95.2	109.7	177.9	-174.1	0	0	0	0	109.4	V561 I575 I576 A589 I593 F603 Y870 G871 V873	V561-V591 HydrophobicContact CG1-CB 4.31Å; V561-V591 HydrophobicContact CG1-CG1 3.75Å; V561-V591 HydrophobicContact CG1-CG2 4.03Å; I575-V591 HydrophobicContact CD1-CG2 4.31Å; I575-V591 HydrophobicContact CG2-CG2 4.5Å; I576-V591 HydrophobicContact CD1-CG1 4.49Å; A589-V591 HydrophobicContact CB-CG2 3.88Å; A589-V591 PolarHBondContact O-N 3.08Å; V591-I593 PolarHBondContact O-N 2.62Å; V591-F603 HydrophobicContact CG1-CE1 3.94Å; V591-F603 HydrophobicContact CG1-CZ 4.36Å; V591-Y870 WeakPolarHBondContact O-CA 3.46Å; V591-G871 PolarHBondContact O-N 2.94Å; V591-V873 HydrophobicContact CB-CG2 3.86Å; V591-V873 HydrophobicContact CG1-CG2 3.87Å; V591-V873 HydrophobicContact CG2-CG2 3.92Å
592	S	94.3	Very high	92.2	Very high	6 Å²	6	32.6 Å²	32.6	4%	0.042	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-64.4	131	173.8	-21.9	0	0	0	0	110.5	T594 R597 S869	S592-T594 PolarHBondContact O-N 3.44Å; S592-R597 PolarHBondContact O-NH1 3.47Å; S592-R597 VanDerWaalsContact O-NH1 3.12Å; S592-S869 WeakPolarHBondContact CA-O 3.25Å
593	I	93.8	Very high	92.7	Very high	48 Å²	48	32.1 Å²	32.1	25%	0.246	18%	0.176	C	C	.	.			trans	-72.1	121.2	176.6	-58.2	177.4	0	0	0	107.7	V591 F603 P606 N868 S869	V591-I593 PolarHBondContact O-N 2.62Å; I593-F603 HydrophobicContact CD1-CB 4.17Å; I593-F603 HydrophobicContact CD1-CD1 4.41Å; I593-F603 HydrophobicContact CD1-CG 4.31Å; I593-F603 HydrophobicContact CG1-CB 4.32Å; I593-F603 HydrophobicContact CG1-CD1 3.74Å; I593-F603 HydrophobicContact CG1-CD2 4.36Å; I593-F603 HydrophobicContact CG1-CE1 4Å; I593-F603 HydrophobicContact CG1-CG 3.9Å; I593-F603 HydrophobicContact CG1-CZ 4.44Å; I593-F603 HydrophobicContact CG2-CD2 3.98Å; I593-F603 HydrophobicContact CG2-CE2 4.14Å; I593-F603 HydrophobicContact CG2-CG 4.32Å; I593-P606 HydrophobicContact CD1-CB 4.33Å; I593-N868 PolarHBondContact O-OD1 2.95Å; I593-N868 VanDerWaalsContact O-OD1 3.12Å; I593-S869 WeakPolarHBondContact CG1-O 3.24Å; I593-S869 PolarHBondContact N-O 2.93Å
594	T	91.3	Very high	93.1	Very high	15 Å²	15	29.4 Å²	29.4	9%	0.092	16%	0.159	C	C	.	.			trans	-131.6	151.1	173.7	83.8	0	0	0	0	109.4	S592 E596 R597 A598 P800	S592-T594 PolarHBondContact O-N 3.44Å; T594-E596 VanDerWaalsContact C-N 3.26Å; T594-E596 VanDerWaalsContact CB-OE2 3.31Å; T594-E596 WeakPolarHBondContact CB-OE2 3.45Å; T594-E596 PolarHBondContact O-N 3.14Å; T594-E596 PolarHBondContact OG1-OE2 3.03Å; T594-R597 PolarHBondContact O-N 2.99Å; T594-R597 VanDerWaalsContact O-N 3.13Å; T594-A598 PolarHBondContact O-N 3.26Å; T594-P800 HydrophobicContact CG2-CB 4.14Å; T594-P800 HydrophobicContact CG2-CG 4.36Å
595	P	91	Very high	93.2	Very high	85 Å²	85	35.2 Å²	35.2	55%	0.552	19%	0.185	S	C	*	.	H	α-helix	trans	-61.3	-33	-176.6	19.3	-28.9	0	0	0	112.8	R597 A598 A599	P595-R597 VanDerWaalsContact C-N 3.32Å; P595-R597 PolarHBondContact O-N 3.36Å; P595-A598 PolarHBondContact O-N 2.79Å; P595-A599 WeakPolarHBondContact O-CB 3.4Å; P595-A599 PolarHBondContact O-N 3.28Å
596	E	88	Confident	93.5	Very high	76 Å²	76	34.9 Å²	34.9	36%	0.355	18%	0.183	S	C	.	.	H	α-helix	trans	-64.2	-39.6	177.5	-55.1	67.9	-138.9	0	0	111.6	W572 T594 R807	W572-E596 HydrophobicContact CH2-CB 3.99Å; W572-E596 WeakPolarHBondContact CZ2-O 3.46Å; T594-E596 VanDerWaalsContact C-N 3.26Å; T594-E596 VanDerWaalsContact CB-OE2 3.31Å; T594-E596 WeakPolarHBondContact CB-OE2 3.45Å; T594-E596 PolarHBondContact O-N 3.14Å; T594-E596 PolarHBondContact OG1-OE2 3.03Å; E596-R807 IonicContact OE1-CZ 3.51Å; E596-R807 IonicContact OE1-NH1 3.46Å; E596-R807 PolarHBondContact OE1-NH1 2.97Å; E596-R807 IonicContact OE1-NH2 3.86Å; E596-R807 PolarHBondContact OE1-NH2 2.64Å; E596-R807 IonicContact OE2-CZ 3.91Å; E596-R807 IonicContact OE2-NH1 3.82Å; E596-R807 IonicContact OE2-NH2 3.77Å; E596-R807 PolarHBondContact OE2-NH2 2.69Å
597	R	92	Very high	93.5	Very high	15 Å²	15	34.8 Å²	34.8	6%	0.057	18%	0.183	C	C	.	.	H	α-helix	trans	-71.2	-48.4	176.2	-67.3	174.1	174.5	161.9	1.4	109.5	G562 W572 I576 S592 T594 P595 A599 R600 V601 F603	G562-R597 PolarHBondContact O-NH2 2.83Å; W572-R597 HydrophobicContact CH2-CG 4.04Å; W572-R597 HydrophobicContact CZ3-CG 3.91Å; I576-R597 HydrophobicContact CD1-CG 4.41Å; I576-R597 HydrophobicContact CG1-CG 4.33Å; S592-R597 PolarHBondContact O-NH1 3.47Å; S592-R597 VanDerWaalsContact O-NH1 3.12Å; T594-R597 PolarHBondContact O-N 2.99Å; T594-R597 VanDerWaalsContact O-N 3.13Å; P595-R597 VanDerWaalsContact C-N 3.32Å; P595-R597 PolarHBondContact O-N 3.36Å; R597-A599 PolarHBondContact O-N 3.18Å; R597-R600 PolarHBondContact O-N 3.32Å; R597-V601 HydrophobicContact CB-CG2 4.16Å; R597-V601 WeakPolarHBondContact O-CG2 3.29Å; R597-V601 PolarHBondContact O-N 3.05Å; R597-F603 HydrophobicContact CB-CE2 3.81Å; R597-F603 HydrophobicContact CB-CZ 3.76Å
598	A	92.4	Very high	93.4	Very high	40 Å²	40	36.5 Å²	36.5	33%	0.331	19%	0.19	S	C	.	.	H	α-helix	trans	-61.6	-24.3	179.1	0	0	0	0	0	113.2	T594 P595 R600 V601 F603 K876	T594-A598 PolarHBondContact O-N 3.26Å; P595-A598 PolarHBondContact O-N 2.79Å; A598-R600 VanDerWaalsContact C-N 3.25Å; A598-R600 PolarHBondContact O-N 3.27Å; A598-V601 VanDerWaalsContact O-O 3.1Å; A598-F603 HydrophobicContact CB-CD2 4.22Å; A598-F603 HydrophobicContact CB-CE2 4.2Å; A598-K876 WeakPolarHBondContact O-CE 3.4Å; A598-K876 PolarHBondContact O-NZ 3.31Å
599	A	90.9	Very high	93.3	Very high	58 Å²	58	43.1 Å²	43.1	48%	0.479	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-25.6	170.9	0	0	0	0	0	113.2	P595 R597 K876	P595-A599 WeakPolarHBondContact O-CB 3.4Å; P595-A599 PolarHBondContact O-N 3.28Å; R597-A599 PolarHBondContact O-N 3.18Å; A599-K876 WeakPolarHBondContact O-CE 3.31Å; A599-K876 PolarHBondContact O-NZ 2.67Å
600	R	89	Confident	93.2	Very high	148 Å²	148	43.9 Å²	43.9	56%	0.558	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121	-36.2	-173.4	-61.6	-57.3	-177	87.8	0.9	115.7	W572 L580 R597 A598	W572-R600 HydrophobicContact CZ2-CG 4.27Å; L580-R600 HydrophobicContact CD1-CB 4.4Å; L580-R600 HydrophobicContact CD2-CB 4.45Å; R597-R600 PolarHBondContact O-N 3.32Å; A598-R600 VanDerWaalsContact C-N 3.25Å; A598-R600 PolarHBondContact O-N 3.27Å
601	V	93.2	Very high	93.1	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	174.4	171.8	-69	0	0	0	0	110.4	I576 I579 L580 R597 A598 F603 V873 M874 K876	I576-V601 HydrophobicContact CD1-CG1 4.42Å; I576-V601 HydrophobicContact CD1-CG2 3.97Å; I576-V601 HydrophobicContact CG2-CG1 3.98Å; I579-V601 HydrophobicContact CG2-CG1 4.01Å; L580-V601 HydrophobicContact CD2-CG1 4.12Å; L580-V601 HydrophobicContact CG-CG1 4.2Å; R597-V601 HydrophobicContact CB-CG2 4.16Å; R597-V601 WeakPolarHBondContact O-CG2 3.29Å; R597-V601 PolarHBondContact O-N 3.05Å; A598-V601 VanDerWaalsContact O-O 3.1Å; V601-F603 HydrophobicContact CG2-CE2 3.97Å; V601-F603 HydrophobicContact CG2-CZ 4.16Å; V601-V873 HydrophobicContact CB-CG1 3.62Å; V601-V873 HydrophobicContact CG1-CG1 3.99Å; V601-V873 HydrophobicContact CG2-CG1 3.6Å; V601-M874 WeakPolarHBondContact CB-O 3.42Å; V601-K876 WeakPolarHBondContact O-CE 3.39Å
602	E	93.9	Very high	93.1	Very high	52 Å²	52	43.7 Å²	43.7	24%	0.243	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.5	177.9	-154.6	164	-152.7	0	0	109.1	M874 K876 N877 L881	E602-M874 PolarHBondContact N-O 3.31Å; E602-M874 PolarHBondContact O-N 3.11Å; E602-K876 HydrophobicContact CB-CG 4.09Å; E602-K876 WeakPolarHBondContact OE2-CA 3.3Å; E602-N877 WeakPolarHBondContact OE2-CA 3.43Å; E602-N877 PolarHBondContact OE2-N 3.09Å; E602-L881 HydrophobicContact CB-CD1 4.47Å; E602-L881 HydrophobicContact CG-CD1 3.89Å; E602-L881 HydrophobicContact CG-CD2 3.76Å; E602-L881 HydrophobicContact CG-CG 4.43Å; E602-L881 WeakPolarHBondContact OE1-CD2 3.4Å
603	F	95.8	Very high	93	Very high	28 Å²	28	43.5 Å²	43.5	12%	0.123	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	142.5	-179.6	-68.9	-85.4	0	0	0	110.1	V591 I593 R597 A598 V601 L872 V873 L881	V591-F603 HydrophobicContact CG1-CE1 3.94Å; V591-F603 HydrophobicContact CG1-CZ 4.36Å; I593-F603 HydrophobicContact CD1-CB 4.17Å; I593-F603 HydrophobicContact CD1-CD1 4.41Å; I593-F603 HydrophobicContact CD1-CG 4.31Å; I593-F603 HydrophobicContact CG1-CB 4.32Å; I593-F603 HydrophobicContact CG1-CD1 3.74Å; I593-F603 HydrophobicContact CG1-CD2 4.36Å; I593-F603 HydrophobicContact CG1-CE1 4Å; I593-F603 HydrophobicContact CG1-CG 3.9Å; I593-F603 HydrophobicContact CG1-CZ 4.44Å; I593-F603 HydrophobicContact CG2-CD2 3.98Å; I593-F603 HydrophobicContact CG2-CE2 4.14Å; I593-F603 HydrophobicContact CG2-CG 4.32Å; R597-F603 HydrophobicContact CB-CE2 3.81Å; R597-F603 HydrophobicContact CB-CZ 3.76Å; A598-F603 HydrophobicContact CB-CD2 4.22Å; A598-F603 HydrophobicContact CB-CE2 4.2Å; V601-F603 HydrophobicContact CG2-CE2 3.97Å; V601-F603 HydrophobicContact CG2-CZ 4.16Å; F603-L872 WeakPolarHBondContact CA-O 3.32Å; F603-V873 HydrophobicContact CD1-CG2 4.01Å; F603-V873 HydrophobicContact CE1-CG1 4.46Å; F603-V873 HydrophobicContact CE1-CG2 3.67Å; F603-L881 WeakPolarHBondContact O-CD1 3.44Å
604	T	95.2	Very high	93.1	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.031	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-63.8	169.9	163.3	60.7	0	0	0	0	110.6	L872 M874 L881 L884 S885	T604-L872 HydrophobicContact CG2-CB 3.83Å; T604-L872 HydrophobicContact CG2-CD1 4.26Å; T604-L872 HydrophobicContact CG2-CG 4.36Å; T604-L872 PolarHBondContact N-O 3.1Å; T604-L872 WeakPolarHBondContact OG1-CB 3.31Å; T604-L872 PolarHBondContact OG1-N 3.49Å; T604-L872 VanDerWaalsContact OG1-N 3.16Å; T604-M874 HydrophobicContact CG2-CE 3.54Å; T604-L881 HydrophobicContact CG2-CD1 4.44Å; T604-L884 HydrophobicContact CG2-CB 3.9Å; T604-S885 WeakPolarHBondContact CA-OG 3.27Å
605	K	94.9	Very high	93.2	Very high	124 Å²	124	40.5 Å²	40.5	54%	0.539	20%	0.201	S	C	.	.	S	Bend	trans	-49.8	140.1	156.9	-67.1	-64	-177.5	-178.7	0	109.5	S885 L889	K605-S885 PolarHBondContact N-OG 3Å; K605-L889 HydrophobicContact CB-CD2 4.18Å; K605-L889 HydrophobicContact CB-CG 4.24Å; K605-L889 HydrophobicContact CG-CD1 4.23Å; K605-L889 HydrophobicContact CG-CD2 4.27Å; K605-L889 HydrophobicContact CG-CG 4.23Å
606	P	96.2	Very high	93.3	Very high	17 Å²	17	36.5 Å²	36.5	11%	0.11	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-64.9	143.3	-170.5	26.9	-35.8	0	0	0	111	I593 Y609 S869 Y870 V888 H892	I593-P606 HydrophobicContact CD1-CB 4.33Å; P606-Y609 HydrophobicContact CB-CE1 4.44Å; P606-Y609 HydrophobicContact CG-CD1 4.41Å; P606-Y609 HydrophobicContact CG-CE1 3.6Å; P606-Y609 HydrophobicContact CG-CE2 4.32Å; P606-Y609 WeakPolarHBondContact CG-OH 3.43Å; P606-S869 VanDerWaalsContact CB-CB 3.49Å; P606-Y870 CarbonylContact C-O 3.5Å; P606-Y870 VanDerWaalsContact CA-O 3.28Å; P606-Y870 WeakPolarHBondContact CA-O 3.37Å; P606-Y870 WeakPolarHBondContact CB-O 3.42Å; P606-V888 WeakPolarHBondContact O-CG1 3.37Å; P606-H892 PolarHBondContact O-CE1 3.2Å; P606-H892 VanDerWaalsContact O-CE1 3.26Å
607	F	94.5	Very high	93.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-94.2	-19.2	176.6	73	-99.8	0	0	0	112.5	Y528 L532 Y870 L872 V888 M897	Y528-F607 HydrophobicContact CD1-CE2 4.14Å; Y528-F607 AromaticContact CE1-CD2 3.73Å; Y528-F607 HydrophobicContact CE1-CD2 3.73Å; Y528-F607 AromaticContact CE1-CE2 3.68Å; Y528-F607 HydrophobicContact CE1-CE2 3.68Å; L532-F607 HydrophobicContact CD2-CB 4.02Å; L532-F607 HydrophobicContact CD2-CD1 4.2Å; L532-F607 HydrophobicContact CD2-CD2 3.82Å; L532-F607 HydrophobicContact CD2-CE2 4.32Å; L532-F607 HydrophobicContact CD2-CG 3.75Å; F607-Y870 WeakPolarHBondContact CD1-O 3.47Å; F607-Y870 HydrophobicContact CE2-CD2 4.44Å; F607-Y870 VanDerWaalsContact CZ-CB 3.46Å; F607-Y870 HydrophobicContact CZ-CD2 4.24Å; F607-Y870 HydrophobicContact CZ-CG 4.28Å; F607-Y870 PolarHBondContact N-O 2.94Å; F607-L872 HydrophobicContact CD1-CD2 3.77Å; F607-L872 HydrophobicContact CD1-CG 4.31Å; F607-L872 HydrophobicContact CE1-CD2 4.01Å; F607-V888 HydrophobicContact CB-CG1 3.93Å; F607-M897 HydrophobicContact CB-CE 3.86Å; F607-M897 HydrophobicContact CB-SD 4.42Å; F607-M897 WeakPolarHBondContact O-CE 3.13Å; F607-M897 WeakPolarHBondContact O-CG 3.36Å; F607-M897 VanDerWaalsContact O-SD 3.35Å
608	K	94.3	Very high	93.1	Very high	35 Å²	35	39 Å²	39	15%	0.152	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	124.1	177.5	-173.1	82.1	-172.8	101	0	109.5	S869 Y870 D901 I905	K608-S869 CarbonylContact O-C 3.56Å; K608-S869 WeakPolarHBondContact O-CA 3.28Å; K608-Y870 HydrophobicContact CB-CD2 4.17Å; K608-Y870 HydrophobicContact CG-CD2 4.4Å; K608-Y870 PolarHBondContact O-N 3.24Å; K608-D901 VanDerWaalsContact CD-OD1 3.28Å; K608-D901 WeakPolarHBondContact CD-OD1 3.37Å; K608-D901 VanDerWaalsContact CE-CG 3.49Å; K608-D901 VanDerWaalsContact CE-OD1 3.29Å; K608-D901 WeakPolarHBondContact CE-OD1 3.45Å; K608-D901 WeakPolarHBondContact CE-OD2 3.29Å; K608-D901 IonicContact NZ-OD1 3.58Å; K608-D901 IonicContact NZ-OD2 2.73Å; K608-D901 PolarHBondContact NZ-OD2 2.76Å; K608-I905 HydrophobicContact CD-CD1 4.4Å
609	Y	93.8	Very high	92.4	Very high	142 Å²	142	43.9 Å²	43.9	56%	0.557	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	140.3	164.7	-59.2	-84.7	0	0	0	109.7	P606 S869	P606-Y609 HydrophobicContact CB-CE1 4.44Å; P606-Y609 HydrophobicContact CG-CD1 4.41Å; P606-Y609 HydrophobicContact CG-CE1 3.6Å; P606-Y609 HydrophobicContact CG-CE2 4.32Å; P606-Y609 WeakPolarHBondContact CG-OH 3.43Å; Y609-S869 WeakPolarHBondContact CD1-OG 3.5Å
610	L	92.9	Very high	91.4	Very high	15 Å²	15	48.7 Å²	48.7	8%	0.079	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	-171.1	179.2	65.1	139.7	0	0	0	110.6	D844 N868 Y870	L610-D844 HydrophobicContact CD1-CB 3.51Å; L610-D844 WeakPolarHBondContact CD1-OD1 3.31Å; L610-N868 CarbonylContact C-O 3.52Å; L610-N868 WeakPolarHBondContact CG-O 3.38Å; L610-N868 PolarHBondContact N-O 2.82Å; L610-N868 PolarHBondContact O-N 3.4Å; L610-Y870 HydrophobicContact CD1-CE1 3.94Å; L610-Y870 HydrophobicContact CD1-CE2 4.33Å; L610-Y870 HydrophobicContact CD2-CD1 3.7Å; L610-Y870 HydrophobicContact CD2-CD2 3.74Å; L610-Y870 HydrophobicContact CD2-CE1 3.78Å; L610-Y870 HydrophobicContact CD2-CE2 3.81Å; L610-Y870 HydrophobicContact CD2-CG 3.68Å
611	G	92.2	Very high	90.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	-173.6	163.7	0	0	0	0	0	109.4	S845 V864	G611-S845 PolarHBondContact N-OG 3.04Å; G611-S845 VanDerWaalsContact O-CB 3.28Å; G611-S845 WeakPolarHBondContact O-CB 3.5Å; G611-S845 PolarHBondContact O-N 2.89Å; G611-S845 PolarHBondContact O-OG 3.08Å; G611-V864 VanDerWaalsContact CA-CG1 3.43Å
612	I	94.5	Very high	88.7	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.036	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	134.2	-178.2	-51.4	171.8	0	0	0	109	V801 Y804 I842 V864 F865	I612-V801 HydrophobicContact CD1-CG1 4.28Å; I612-V801 HydrophobicContact CD1-CG2 4.46Å; I612-V801 HydrophobicContact CG1-CG2 4.32Å; I612-V801 HydrophobicContact CG2-CG1 4.16Å; I612-Y804 HydrophobicContact CD1-CD1 3.72Å; I612-Y804 HydrophobicContact CD1-CE1 4.18Å; I612-Y804 HydrophobicContact CD1-CG 3.95Å; I612-I842 HydrophobicContact CG2-CG2 3.31Å; I612-V864 WeakPolarHBondContact O-CA 3.11Å; I612-V864 WeakPolarHBondContact O-CG1 3.19Å; I612-F865 WeakPolarHBondContact CA-O 3.44Å; I612-F865 HydrophobicContact CB-CD2 4.16Å; I612-F865 HydrophobicContact CB-CE1 4.3Å; I612-F865 HydrophobicContact CB-CE2 3.82Å; I612-F865 HydrophobicContact CB-CZ 3.9Å; I612-F865 WeakPolarHBondContact CB-O 3.42Å; I612-F865 HydrophobicContact CD1-CE2 4.23Å; I612-F865 HydrophobicContact CG2-CE1 4.04Å; I612-F865 HydrophobicContact CG2-CE2 3.71Å; I612-F865 HydrophobicContact CG2-CZ 3.43Å; I612-F865 VanDerWaalsContact CG2-CZ 3.43Å; I612-F865 PolarHBondContact N-O 3.46Å; I612-F865 WeakPolarHBondContact O-CD1 3.45Å; I612-F865 PolarHBondContact O-N 3.47Å
613	T	94	Very high	87.2	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.018	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	174.7	170.3	-170.2	0	0	0	0	109.9	W843 L848 T860	T613-W843 PolarHBondContact N-O 3.3Å; T613-W843 PolarHBondContact O-N 2.84Å; T613-W843 VanDerWaalsContact O-O 3.11Å; T613-L848 HydrophobicContact CG2-CB 4.22Å; T613-L848 HydrophobicContact CG2-CD1 3.64Å; T613-L848 HydrophobicContact CG2-CG 4.45Å; T613-L848 WeakPolarHBondContact O-CD1 3.3Å; T613-T860 HydrophobicContact CG2-CG2 3.81Å
614	I	94.6	Very high	86.1	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	115.6	-169.9	-48.6	-178.5	0	0	0	108.9	V616 I776 L784 A840 F841 I842 T860 A861 F865	I614-V616 HydrophobicContact CG2-CG1 4.1Å; I614-I776 HydrophobicContact CG2-CD1 3.97Å; I614-L784 HydrophobicContact CD1-CD1 3.6Å; I614-A840 HydrophobicContact CG2-CB 3.72Å; I614-F841 CarbonylContact C-O 3.51Å; I614-F841 WeakPolarHBondContact CA-O 3.35Å; I614-I842 HydrophobicContact CG1-CG1 4.36Å; I614-I842 HydrophobicContact CG2-CG1 4.41Å; I614-T860 CarbonylContact O-C 3.53Å; I614-T860 WeakPolarHBondContact O-CA 3.39Å; I614-A861 HydrophobicContact CB-CB 4.45Å; I614-A861 PolarHBondContact O-N 3.12Å; I614-F865 HydrophobicContact CD1-CE1 4.44Å; I614-F865 HydrophobicContact CG1-CE1 4.16Å
615	L	94.3	Very high	85.1	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	127.1	172.8	-170.9	67.1	0	0	0	109.8	I830 I833 F841 L848 V852 L858	L615-I830 HydrophobicContact CD2-CG1 4.25Å; L615-I833 HydrophobicContact CB-CD1 3.92Å; L615-I833 HydrophobicContact CD2-CD1 3.44Å; L615-I833 VanDerWaalsContact CD2-CD1 3.44Å; L615-I833 HydrophobicContact CG-CD1 3.71Å; L615-F841 HydrophobicContact CB-CB 4.37Å; L615-F841 HydrophobicContact CB-CD1 4.45Å; L615-F841 HydrophobicContact CD2-CD1 4.49Å; L615-F841 PolarHBondContact N-O 2.84Å; L615-F841 PolarHBondContact O-N 2.78Å; L615-L848 HydrophobicContact CB-CD1 3.89Å; L615-L848 HydrophobicContact CB-CD2 3.86Å; L615-L848 HydrophobicContact CB-CG 4.33Å; L615-L848 HydrophobicContact CD2-CD2 3.82Å; L615-L848 HydrophobicContact CG-CD2 4.31Å; L615-V852 HydrophobicContact CD1-CG2 3.52Å; L615-L858 HydrophobicContact CD1-CB 3.96Å; L615-L858 HydrophobicContact CD1-CD1 4.39Å; L615-L858 HydrophobicContact CD2-CD1 4.09Å
616	V	93.1	Very high	84.2	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	158.1	175.7	-58.7	0	0	0	0	111.2	I614 I776 A840 I859 A861	I614-V616 HydrophobicContact CG2-CG1 4.1Å; V616-I776 HydrophobicContact CG1-CD1 3.48Å; V616-I776 VanDerWaalsContact CG1-CD1 3.48Å; V616-I776 HydrophobicContact CG1-CG1 4.19Å; V616-A840 HydrophobicContact CG1-CB 4.26Å; V616-I859 HydrophobicContact CG2-CG2 3.56Å; V616-I859 PolarHBondContact N-O 2.81Å; V616-I859 PolarHBondContact O-N 2.82Å; V616-A861 HydrophobicContact CG1-CB 4.23Å; V616-A861 HydrophobicContact CG2-CB 4.07Å
617	K	91.2	Very high	83.1	Confident	78 Å²	78	62.6 Å²	62.6	34%	0.339	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	134	170.1	-169.2	162.8	-171.7	158.1	0	110.1	E619 I833 K834 E857	K617-E619 PolarHBondContact O-N 3.06Å; K617-I833 HydrophobicContact CB-CG2 4.05Å; K617-K834 PolarHBondContact NZ-O 2.93Å; K617-E857 WeakPolarHBondContact CE-OE2 3.38Å; K617-E857 IonicContact NZ-OE2 2.81Å; K617-E857 PolarHBondContact NZ-OE2 3.12Å
618	R	84.5	Confident	82.4	Confident	65 Å²	65	64.9 Å²	64.9	25%	0.245	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-75.5	117.6	-179.4	-168.3	-176.7	-53.3	-156	1.1	110.8	R620 C856 E857 L858 I859	R618-R620 PolarHBondContact O-N 3.2Å; R618-C856 PolarHBondContact NE-O 2.86Å; R618-E857 VanDerWaalsContact CB-O 3.24Å; R618-E857 WeakPolarHBondContact CB-O 3.31Å; R618-E857 PolarHBondContact N-O 2.86Å; R618-L858 PolarHBondContact NH2-O 3.03Å; R618-I859 HydrophobicContact CB-CG2 4.32Å
619	E	77.2	Confident	81.8	Confident	143 Å²	143	67.3 Å²	67.3	67%	0.668	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-80.6	116.4	173	-61	-165.2	169.1	0	0	110	K617 P772	K617-E619 PolarHBondContact O-N 3.06Å; E619-P772 WeakPolarHBondContact O-CB 3.43Å
620	R	70	Confident	81.1	Confident	159 Å²	159	66.2 Å²	66.2	60%	0.6	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-93.2	123.5	173.8	-66.2	-176.6	-175.1	145.2	6.2	109.4	R618 R622 C856	R618-R620 PolarHBondContact O-N 3.2Å; R620-R622 PolarHBondContact O-N 3.2Å; R620-C856 PolarHBondContact NH2-O 3.07Å
621	A	62.7	Low	80.8	Confident	75 Å²	75	66.2 Å²	66.2	62%	0.62	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-59.5	122.3	171.7	0	0	0	0	0	109.6
622	R	62.8	Low	80.6	Confident	232 Å²	232	67 Å²	67	88%	0.875	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-88	118.1	176.4	-68.8	-175.6	179.6	-175.7	-0.1	109.1	R620 N624	R620-R622 PolarHBondContact O-N 3.2Å; R622-N624 PolarHBondContact O-N 2.83Å
623	S	63	Low	80.3	Confident	63 Å²	63	73.5 Å²	73.5	44%	0.441	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-70.5	117.8	174.1	47.5	0	0	0	0	110.9	N926	S623-N926 WeakPolarHBondContact CB-OD1 3.46Å; S623-N926 PolarHBondContact OG-OD1 3.44Å
624	N	71.8	Confident	80	Confident	123 Å²	123	78.2 Å²	78.2	66%	0.658	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-80.2	139.2	171.2	-75.8	-36.1	0	0	0	109.9	R622 G626 S627	R622-N624 PolarHBondContact O-N 2.83Å; N624-G626 PolarHBondContact O-N 2.66Å; N624-S627 VanDerWaalsContact O-CB 3.25Å; N624-S627 WeakPolarHBondContact O-CB 3.48Å; N624-S627 PolarHBondContact O-N 3.43Å
625	L	74.4	Confident	79.9	Confident	102 Å²	102	80.8 Å²	80.8	53%	0.534	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-24.2	179.3	-73.5	166.2	0	0	0	114.2	F628 A928	L625-F628 WeakPolarHBondContact O-CD1 3.25Å; L625-F628 VanDerWaalsContact O-CE1 3.27Å; L625-F628 WeakPolarHBondContact O-CE1 3.29Å; L625-A928 HydrophobicContact CD2-CB 3.8Å
626	G	76.1	Confident	79.7	Confident	40 Å²	40	83.9 Å²	83.9	41%	0.412	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	4.6	177.5	0	0	0	0	0	115.8	N624 F628 L629	N624-G626 PolarHBondContact O-N 2.66Å; G626-F628 PolarHBondContact O-N 2.85Å; G626-F628 VanDerWaalsContact O-N 3.13Å; G626-L629 PolarHBondContact O-N 3.33Å
627	S	73.3	Confident	79.6	Confident	32 Å²	32	88.4 Å²	88.4	22%	0.224	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-54.4	-33.7	-175.4	171.7	0	0	0	0	113.2	N624 L629 Q630	N624-S627 VanDerWaalsContact O-CB 3.25Å; N624-S627 WeakPolarHBondContact O-CB 3.48Å; N624-S627 PolarHBondContact O-N 3.43Å; S627-L629 PolarHBondContact O-N 3.32Å; S627-Q630 WeakPolarHBondContact O-CB 3.36Å; S627-Q630 PolarHBondContact O-N 2.91Å; S627-Q630 VanDerWaalsContact O-N 3.1Å
628	F	78.8	Confident	79.6	Confident	47 Å²	47	89.4 Å²	89.4	21%	0.206	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-64.2	-18.2	176.6	72.7	-89.2	0	0	0	114.9	L625 G626 P631 Y759 V930 M933	L625-F628 WeakPolarHBondContact O-CD1 3.25Å; L625-F628 VanDerWaalsContact O-CE1 3.27Å; L625-F628 WeakPolarHBondContact O-CE1 3.29Å; G626-F628 PolarHBondContact O-N 2.85Å; G626-F628 VanDerWaalsContact O-N 3.13Å; F628-P631 WeakPolarHBondContact O-CD 3.46Å; F628-Y759 PolarHBondContact O-OH 3.2Å; F628-V930 HydrophobicContact CB-CG2 4.17Å; F628-V930 HydrophobicContact CD1-CG2 3.8Å; F628-V930 HydrophobicContact CD2-CG2 4.16Å; F628-V930 HydrophobicContact CE1-CG2 4.21Å; F628-V930 HydrophobicContact CG-CG2 3.78Å; F628-M933 HydrophobicContact CZ-CG 4.15Å
629	L	82.1	Confident	79.9	Confident	86 Å²	86	91.6 Å²	91.6	45%	0.45	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-87.9	-18.4	175.4	-66.6	175.2	0	0	0	113	G626 S627 W637	G626-L629 PolarHBondContact O-N 3.33Å; S627-L629 PolarHBondContact O-N 3.32Å; L629-W637 HydrophobicContact CD2-CZ2 4.31Å; L629-W637 PolarHBondContact O-NE1 3.09Å
630	Q	80.3	Confident	80.6	Confident	119 Å²	119	85.5 Å²	85.5	56%	0.556	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.1	-175.2	-168.1	170.3	-18.7	0	0	116.3	S627 F632 F766	S627-Q630 WeakPolarHBondContact O-CB 3.36Å; S627-Q630 PolarHBondContact O-N 2.91Å; S627-Q630 VanDerWaalsContact O-N 3.1Å; Q630-F632 PolarHBondContact O-N 2.86Å; Q630-F632 VanDerWaalsContact O-N 3.08Å; Q630-F766 VanDerWaalsContact NE2-CE2 3.28Å
631	P	85.3	Confident	81.5	Confident	15 Å²	15	79.7 Å²	79.7	10%	0.097	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-17.8	179.4	-28.5	37	0	0	0	115.8	F628 Y759 N762 L763	F628-P631 WeakPolarHBondContact O-CD 3.46Å; P631-Y759 HydrophobicContact CB-CD2 4.05Å; P631-Y759 HydrophobicContact CB-CE2 4.02Å; P631-Y759 HydrophobicContact CG-CE2 4.02Å; P631-N762 HydrophobicContact CB-CB 3.8Å; P631-N762 PolarHBondContact O-ND2 3.07Å; P631-L763 HydrophobicContact CG-CB 4.05Å; P631-L763 HydrophobicContact CG-CD1 3.93Å
632	F	88.3	Confident	83	Confident	17 Å²	17	80.8 Å²	80.8	8%	0.075	43%	0.432	C	S	.	.	S	Bend	trans	-132.4	138.1	174.9	-72.8	-28	0	0	0	110.2	Q630 L636 W637 I755 Y759	Q630-F632 PolarHBondContact O-N 2.86Å; Q630-F632 VanDerWaalsContact O-N 3.08Å; F632-L636 HydrophobicContact CB-CB 4.43Å; F632-L636 HydrophobicContact CB-CD2 4.12Å; F632-L636 HydrophobicContact CD1-CD1 4.07Å; F632-L636 HydrophobicContact CD1-CD2 3.96Å; F632-L636 HydrophobicContact CD2-CD2 3.67Å; F632-L636 HydrophobicContact CE1-CD1 4.4Å; F632-L636 HydrophobicContact CE1-CD2 4.22Å; F632-L636 HydrophobicContact CE2-CD2 3.92Å; F632-L636 HydrophobicContact CG-CD1 4.47Å; F632-L636 HydrophobicContact CG-CD2 3.68Å; F632-L636 HydrophobicContact CZ-CD2 4.19Å; F632-W637 HydrophobicContact CD2-CH2 4.44Å; F632-W637 HydrophobicContact CD2-CZ2 4.06Å; F632-I755 HydrophobicContact CE2-CG2 4.11Å; F632-I755 HydrophobicContact CZ-CG2 4.34Å; F632-Y759 AromaticContact CD2-CD2 4Å; F632-Y759 HydrophobicContact CD2-CD2 4Å; F632-Y759 AromaticContact CE2-CD2 3.99Å; F632-Y759 HydrophobicContact CE2-CD2 3.99Å; F632-Y759 HydrophobicContact CE2-CG 4.28Å
633	E	88.5	Confident	84.4	Confident	144 Å²	144	70.9 Å²	70.9	67%	0.673	40%	0.399	S	S	*	.			trans	-59.6	152.7	170.2	-72.1	-166.3	168.7	0	0	111.9	S635 L636 W637	E633-S635 WeakPolarHBondContact CB-OG 3.43Å; E633-S635 PolarHBondContact O-N 3.27Å; E633-S635 PolarHBondContact OE2-OG 3.01Å; E633-L636 PolarHBondContact O-N 3.1Å; E633-W637 PolarHBondContact O-N 2.94Å; E633-W637 VanDerWaalsContact O-N 3.08Å
634	S	87.5	Confident	85.7	Confident	101 Å²	101	67.9 Å²	67.9	71%	0.706	38%	0.378	S	S	*	.	H	α-helix	trans	-57.6	-30.2	173.2	53.5	0	0	0	0	112.8	V638	S634-V638 WeakPolarHBondContact O-CG2 3.46Å; S634-V638 PolarHBondContact O-N 2.96Å; S634-V638 VanDerWaalsContact O-N 3.15Å
635	S	91.8	Very high	86.6	Confident	55 Å²	55	66.8 Å²	66.8	39%	0.385	37%	0.369	S	S	.	.	H	α-helix	trans	-57.3	-49.4	170.5	60.7	0	0	0	0	111.7	E633 V638 L639	E633-S635 WeakPolarHBondContact CB-OG 3.43Å; E633-S635 PolarHBondContact O-N 3.27Å; E633-S635 PolarHBondContact OE2-OG 3.01Å; S635-V638 PolarHBondContact O-N 2.9Å; S635-L639 WeakPolarHBondContact O-CG 3.32Å; S635-L639 PolarHBondContact O-N 3.18Å
636	L	90.8	Very high	87.5	Confident	65 Å²	65	65.5 Å²	65.5	34%	0.34	37%	0.365	S	S	.	.	H	α-helix	trans	-69.4	-41.1	-178.6	-164.8	156.1	0	0	0	111.2	F632 E633 V638 L639 V640	F632-L636 HydrophobicContact CB-CB 4.43Å; F632-L636 HydrophobicContact CB-CD2 4.12Å; F632-L636 HydrophobicContact CD1-CD1 4.07Å; F632-L636 HydrophobicContact CD1-CD2 3.96Å; F632-L636 HydrophobicContact CD2-CD2 3.67Å; F632-L636 HydrophobicContact CE1-CD1 4.4Å; F632-L636 HydrophobicContact CE1-CD2 4.22Å; F632-L636 HydrophobicContact CE2-CD2 3.92Å; F632-L636 HydrophobicContact CG-CD1 4.47Å; F632-L636 HydrophobicContact CG-CD2 3.68Å; F632-L636 HydrophobicContact CZ-CD2 4.19Å; E633-L636 PolarHBondContact O-N 3.1Å; L636-V638 VanDerWaalsContact C-N 3.31Å; L636-V638 PolarHBondContact O-N 3.17Å; L636-L639 PolarHBondContact O-N 3.16Å; L636-L639 VanDerWaalsContact O-N 3.12Å; L636-V640 HydrophobicContact CD2-CG2 3.65Å; L636-V640 WeakPolarHBondContact O-CG2 3.2Å; L636-V640 PolarHBondContact O-N 2.99Å
637	W	90.6	Very high	88.3	Confident	96 Å²	96	64.6 Å²	64.6	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-56.5	-43	172.9	-80.6	112.4	0	0	0	112.7	L629 F632 E633 V640 A641 Y759	L629-W637 HydrophobicContact CD2-CZ2 4.31Å; L629-W637 PolarHBondContact O-NE1 3.09Å; F632-W637 HydrophobicContact CD2-CH2 4.44Å; F632-W637 HydrophobicContact CD2-CZ2 4.06Å; E633-W637 PolarHBondContact O-N 2.94Å; E633-W637 VanDerWaalsContact O-N 3.08Å; W637-V640 PolarHBondContact O-N 3.06Å; W637-A641 WeakPolarHBondContact O-CB 3.4Å; W637-A641 PolarHBondContact O-N 2.77Å; W637-Y759 HydrophobicContact CH2-CE2 4.47Å; W637-Y759 HydrophobicContact CZ2-CD2 4.31Å; W637-Y759 HydrophobicContact CZ2-CE2 4.07Å
638	V	91.3	Very high	89.1	Confident	98 Å²	98	63.1 Å²	63.1	59%	0.594	34%	0.341	S	S	*	.	H	α-helix	trans	-66.6	-39.7	175.4	172.3	0	0	0	0	111.4	S634 S635 L636 A641 L642	S634-V638 WeakPolarHBondContact O-CG2 3.46Å; S634-V638 PolarHBondContact O-N 2.96Å; S634-V638 VanDerWaalsContact O-N 3.15Å; S635-V638 PolarHBondContact O-N 2.9Å; L636-V638 VanDerWaalsContact C-N 3.31Å; L636-V638 PolarHBondContact O-N 3.17Å; V638-A641 PolarHBondContact O-N 3.02Å; V638-L642 VanDerWaalsContact O-CB 3.22Å; V638-L642 WeakPolarHBondContact O-CB 3.45Å; V638-L642 PolarHBondContact O-N 2.95Å
639	L	91.5	Very high	89.6	Confident	112 Å²	112	66 Å²	66	59%	0.586	35%	0.353	S	S	*	.	H	α-helix	trans	-66	-40.8	175.9	-72.2	172.2	0	0	0	112.6	S635 L636 L642 S643	S635-L639 WeakPolarHBondContact O-CG 3.32Å; S635-L639 PolarHBondContact O-N 3.18Å; L636-L639 PolarHBondContact O-N 3.16Å; L636-L639 VanDerWaalsContact O-N 3.12Å; L639-L642 PolarHBondContact O-N 3.04Å; L639-S643 VanDerWaalsContact O-CB 3.27Å; L639-S643 WeakPolarHBondContact O-CB 3.43Å; L639-S643 PolarHBondContact O-N 2.93Å; L639-S643 PolarHBondContact O-OG 2.81Å
640	V	90.9	Very high	90	Very high	15 Å²	15	64.5 Å²	64.5	9%	0.091	35%	0.348	C	S	.	.	H	α-helix	trans	-62.3	-51.7	174.7	169.4	0	0	0	0	109.5	L636 W637 L642 S643 V644 L726 I755	L636-V640 HydrophobicContact CD2-CG2 3.65Å; L636-V640 WeakPolarHBondContact O-CG2 3.2Å; L636-V640 PolarHBondContact O-N 2.99Å; W637-V640 PolarHBondContact O-N 3.06Å; V640-L642 VanDerWaalsContact C-N 3.33Å; V640-L642 PolarHBondContact O-N 2.97Å; V640-S643 WeakPolarHBondContact CA-OG 3.29Å; V640-S643 PolarHBondContact O-N 3.46Å; V640-S643 VanDerWaalsContact O-N 3.13Å; V640-S643 PolarHBondContact O-OG 3.43Å; V640-V644 WeakPolarHBondContact O-CG2 3.42Å; V640-V644 PolarHBondContact O-N 3.29Å; V640-L726 HydrophobicContact CG1-CD1 4.49Å; V640-L726 HydrophobicContact CG1-CD2 3.8Å; V640-I755 HydrophobicContact CG1-CD1 4.49Å; V640-I755 HydrophobicContact CG2-CD1 4.15Å; V640-I755 HydrophobicContact CG2-CG2 4.31Å
641	A	89.9	Confident	90.4	Very high	36 Å²	36	58.8 Å²	58.8	30%	0.298	32%	0.321	S	S	.	.	H	α-helix	trans	-56.4	-45.1	176.4	0	0	0	0	0	112.3	W637 V638 V644 H645	W637-A641 WeakPolarHBondContact O-CB 3.4Å; W637-A641 PolarHBondContact O-N 2.77Å; V638-A641 PolarHBondContact O-N 3.02Å; A641-V644 PolarHBondContact O-N 3.06Å; A641-H645 PolarHBondContact O-N 3.42Å; A641-H645 PolarHBondContact O-ND1 3.46Å
642	L	93.2	Very high	90.4	Very high	98 Å²	98	61.2 Å²	61.2	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-41.9	176.9	-175.3	149.6	0	0	0	111.6	V638 L639 V640 V644 H645 V646	V638-L642 VanDerWaalsContact O-CB 3.22Å; V638-L642 WeakPolarHBondContact O-CB 3.45Å; V638-L642 PolarHBondContact O-N 2.95Å; L639-L642 PolarHBondContact O-N 3.04Å; V640-L642 VanDerWaalsContact C-N 3.33Å; V640-L642 PolarHBondContact O-N 2.97Å; L642-V644 PolarHBondContact O-N 2.91Å; L642-H645 PolarHBondContact O-N 3.35Å; L642-V646 HydrophobicContact CD2-CG2 3.72Å; L642-V646 HydrophobicContact CG-CG2 4.41Å; L642-V646 WeakPolarHBondContact O-CG2 3.42Å; L642-V646 PolarHBondContact O-N 3.07Å
643	S	92	Very high	90.4	Very high	25 Å²	25	63 Å²	63	18%	0.175	34%	0.339	C	S	.	.	H	α-helix	trans	-63.7	-38.2	179.9	72	0	0	0	0	112.6	L639 V640 H645 V646 V647 W748	L639-S643 VanDerWaalsContact O-CB 3.27Å; L639-S643 WeakPolarHBondContact O-CB 3.43Å; L639-S643 PolarHBondContact O-N 2.93Å; L639-S643 PolarHBondContact O-OG 2.81Å; V640-S643 WeakPolarHBondContact CA-OG 3.29Å; V640-S643 PolarHBondContact O-N 3.46Å; V640-S643 VanDerWaalsContact O-N 3.13Å; V640-S643 PolarHBondContact O-OG 3.43Å; S643-H645 VanDerWaalsContact C-N 3.34Å; S643-H645 PolarHBondContact O-N 3.41Å; S643-V646 PolarHBondContact O-N 3.01Å; S643-V647 WeakPolarHBondContact O-CB 3.26Å; S643-V647 WeakPolarHBondContact O-CG2 3.48Å; S643-V647 PolarHBondContact O-N 2.84Å; S643-W748 WeakPolarHBondContact OG-CH2 3.45Å
644	V	91.8	Very high	90.2	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-57.3	-47.3	172.4	176.9	0	0	0	0	110.6	V640 A641 L642 V647 A648 A722 W723 L726 W748	V640-V644 WeakPolarHBondContact O-CG2 3.42Å; V640-V644 PolarHBondContact O-N 3.29Å; A641-V644 PolarHBondContact O-N 3.06Å; L642-V644 PolarHBondContact O-N 2.91Å; V644-V647 PolarHBondContact O-N 2.72Å; V644-A648 VanDerWaalsContact O-CB 3.23Å; V644-A648 WeakPolarHBondContact O-CB 3.39Å; V644-A648 PolarHBondContact O-N 3.21Å; V644-A722 HydrophobicContact CG1-CB 3.83Å; V644-W723 HydrophobicContact CG1-CD2 3.96Å; V644-W723 HydrophobicContact CG1-CG 3.88Å; V644-W723 HydrophobicContact CG1-CZ2 4.47Å; V644-L726 HydrophobicContact CG2-CD2 3.61Å; V644-W748 HydrophobicContact CB-CZ2 4.34Å; V644-W748 HydrophobicContact CG2-CH2 4.08Å; V644-W748 HydrophobicContact CG2-CZ2 3.75Å
645	H	91.1	Very high	89.8	Confident	100 Å²	100	54.7 Å²	54.7	46%	0.463	29%	0.291	S	S	.	.	H	α-helix	trans	-70.6	-37.4	-178.8	-68.5	83.2	0	0	0	112.5	A641 L642 S643 F649	A641-H645 PolarHBondContact O-N 3.42Å; A641-H645 PolarHBondContact O-ND1 3.46Å; L642-H645 PolarHBondContact O-N 3.35Å; S643-H645 VanDerWaalsContact C-N 3.34Å; S643-H645 PolarHBondContact O-N 3.41Å; H645-F649 VanDerWaalsContact O-CB 3.31Å; H645-F649 WeakPolarHBondContact O-CB 3.35Å; H645-F649 PolarHBondContact O-N 3.14Å
646	V	93.3	Very high	89	Confident	74 Å²	74	55.6 Å²	55.6	45%	0.448	29%	0.289	S	S	.	.	H	α-helix	trans	-65.2	-45.8	174.5	170.7	0	0	0	0	110.7	L642 S643 F649 V650	L642-V646 HydrophobicContact CD2-CG2 3.72Å; L642-V646 HydrophobicContact CG-CG2 4.41Å; L642-V646 WeakPolarHBondContact O-CG2 3.42Å; L642-V646 PolarHBondContact O-N 3.07Å; S643-V646 PolarHBondContact O-N 3.01Å; V646-F649 PolarHBondContact O-N 3.47Å; V646-V650 HydrophobicContact CG1-CG2 4.45Å; V646-V650 WeakPolarHBondContact O-CG2 3.41Å; V646-V650 PolarHBondContact O-N 3.01Å
647	V	91.6	Very high	88.2	Confident	22 Å²	22	59.8 Å²	59.8	13%	0.133	31%	0.305	C	S	.	.	H	α-helix	trans	-66.5	-42.1	178.3	171	0	0	0	0	111.1	S643 V644 F649 V650 L651 W748	S643-V647 WeakPolarHBondContact O-CB 3.26Å; S643-V647 WeakPolarHBondContact O-CG2 3.48Å; S643-V647 PolarHBondContact O-N 2.84Å; V644-V647 PolarHBondContact O-N 2.72Å; V647-F649 VanDerWaalsContact C-N 3.32Å; V647-F649 PolarHBondContact O-N 3.4Å; V647-V650 PolarHBondContact O-N 3.48Å; V647-L651 HydrophobicContact CG1-CD1 3.86Å; V647-L651 HydrophobicContact CG1-CG 4.21Å; V647-L651 VanDerWaalsContact O-CB 3.29Å; V647-L651 WeakPolarHBondContact O-CB 3.5Å; V647-L651 VanDerWaalsContact O-CG 3.24Å; V647-L651 WeakPolarHBondContact O-CG 3.16Å; V647-L651 PolarHBondContact O-N 3.41Å; V647-W748 HydrophobicContact CB-CD2 4.28Å; V647-W748 HydrophobicContact CB-CE3 4.18Å; V647-W748 HydrophobicContact CB-CZ3 4.44Å; V647-W748 HydrophobicContact CG1-CB 4.18Å; V647-W748 HydrophobicContact CG1-CD2 3.85Å; V647-W748 HydrophobicContact CG1-CE3 4.11Å; V647-W748 HydrophobicContact CG1-CG 3.86Å; V647-W748 HydrophobicContact CG2-CD2 4.26Å; V647-W748 HydrophobicContact CG2-CE3 3.67Å; V647-W748 HydrophobicContact CG2-CZ3 3.84Å
648	A	89.8	Confident	87	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.1	-42.5	172.2	0	0	0	0	0	112.6	V644 L651 Y652 A718 V719 A722	V644-A648 VanDerWaalsContact O-CB 3.23Å; V644-A648 WeakPolarHBondContact O-CB 3.39Å; V644-A648 PolarHBondContact O-N 3.21Å; A648-L651 PolarHBondContact O-N 3.01Å; A648-Y652 WeakPolarHBondContact O-CB 3.2Å; A648-Y652 PolarHBondContact O-N 3.35Å; A648-A718 WeakPolarHBondContact CB-O 3.32Å; A648-A718 WeakPolarHBondContact O-CB 3.35Å; A648-V719 HydrophobicContact CB-CB 4.21Å; A648-V719 HydrophobicContact CB-CG2 3.61Å; A648-A722 HydrophobicContact CB-CB 3.98Å
649	F	90.6	Very high	85.5	Confident	107 Å²	107	55.7 Å²	55.7	47%	0.469	29%	0.292	S	S	.	.	H	α-helix	trans	-66	-44.3	175.9	-178.2	-111.1	0	0	0	111.9	H645 V646 V647 Y652 L653 L715	H645-F649 VanDerWaalsContact O-CB 3.31Å; H645-F649 WeakPolarHBondContact O-CB 3.35Å; H645-F649 PolarHBondContact O-N 3.14Å; V646-F649 PolarHBondContact O-N 3.47Å; V647-F649 VanDerWaalsContact C-N 3.32Å; V647-F649 PolarHBondContact O-N 3.4Å; F649-Y652 WeakPolarHBondContact O-CB 3.16Å; F649-Y652 PolarHBondContact O-N 3.27Å; F649-L653 HydrophobicContact CD1-CD1 4.05Å; F649-L653 HydrophobicContact CD1-CG 4.36Å; F649-L653 HydrophobicContact CE1-CD1 3.53Å; F649-L653 HydrophobicContact CE1-CD2 4.47Å; F649-L653 HydrophobicContact CE1-CG 4.08Å; F649-L653 HydrophobicContact CE2-CD2 4.12Å; F649-L653 HydrophobicContact CE2-CG 4.33Å; F649-L653 HydrophobicContact CZ-CD1 3.84Å; F649-L653 HydrophobicContact CZ-CD2 3.97Å; F649-L653 HydrophobicContact CZ-CG 4.06Å; F649-L653 WeakPolarHBondContact O-CG 3.44Å; F649-L653 PolarHBondContact O-N 2.83Å; F649-L715 HydrophobicContact CD2-CD1 4.5Å
650	V	90.5	Very high	83.7	Confident	55 Å²	55	58.6 Å²	58.6	33%	0.333	30%	0.301	S	S	.	.	H	α-helix	trans	-65.3	-39.4	176.5	175.4	0	0	0	0	111.4	V646 V647 L653 L654 L744	V646-V650 HydrophobicContact CG1-CG2 4.45Å; V646-V650 WeakPolarHBondContact O-CG2 3.41Å; V646-V650 PolarHBondContact O-N 3.01Å; V647-V650 PolarHBondContact O-N 3.48Å; V650-L653 PolarHBondContact O-N 3.02Å; V650-L654 HydrophobicContact CG1-CD1 3.95Å; V650-L654 HydrophobicContact CG1-CG 4.17Å; V650-L654 WeakPolarHBondContact O-CB 3.45Å; V650-L654 VanDerWaalsContact O-CG 3.29Å; V650-L654 WeakPolarHBondContact O-CG 3.48Å; V650-L654 PolarHBondContact O-N 3.05Å; V650-L744 HydrophobicContact CB-CD2 4.16Å; V650-L744 HydrophobicContact CG1-CD2 3.54Å
651	L	87.7	Confident	81.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-46.1	173.1	-77.5	171.4	0	0	0	111.4	V647 A648 L654 D655 M713 A718 F721 A741 L744	V647-L651 HydrophobicContact CG1-CD1 3.86Å; V647-L651 HydrophobicContact CG1-CG 4.21Å; V647-L651 VanDerWaalsContact O-CB 3.29Å; V647-L651 WeakPolarHBondContact O-CB 3.5Å; V647-L651 VanDerWaalsContact O-CG 3.24Å; V647-L651 WeakPolarHBondContact O-CG 3.16Å; V647-L651 PolarHBondContact O-N 3.41Å; A648-L651 PolarHBondContact O-N 3.01Å; L651-L654 PolarHBondContact O-N 3.04Å; L651-D655 PolarHBondContact O-N 3.01Å; L651-M713 HydrophobicContact CB-CE 3.95Å; L651-M713 WeakPolarHBondContact O-CE 3.48Å; L651-A718 HydrophobicContact CB-CB 4.46Å; L651-F721 HydrophobicContact CD1-CD1 3.69Å; L651-F721 HydrophobicContact CD1-CE1 3.86Å; L651-A741 HydrophobicContact CD2-CB 3.8Å; L651-A741 WeakPolarHBondContact CD2-O 3.31Å; L651-L744 HydrophobicContact CD2-CB 4.16Å; L651-L744 HydrophobicContact CD2-CD2 3.89Å; L651-L744 HydrophobicContact CD2-CG 4.13Å; L651-L744 HydrophobicContact CG-CD2 4.02Å
652	Y	86.8	Confident	79.8	Confident	65 Å²	65	66.1 Å²	66.1	26%	0.255	33%	0.331	S	S	.	.	H	α-helix	trans	-58.1	-47.6	172.7	169.5	-99	0	0	0	111.8	A648 F649 H656 M713 L715	A648-Y652 WeakPolarHBondContact O-CB 3.2Å; A648-Y652 PolarHBondContact O-N 3.35Å; F649-Y652 WeakPolarHBondContact O-CB 3.16Å; F649-Y652 PolarHBondContact O-N 3.27Å; Y652-H656 WeakPolarHBondContact O-CB 3.46Å; Y652-H656 PolarHBondContact O-N 2.69Å; Y652-M713 VanDerWaalsContact CD2-O 3.28Å; Y652-M713 WeakPolarHBondContact CD2-O 3.48Å; Y652-L715 HydrophobicContact CD1-CD1 4.4Å; Y652-L715 HydrophobicContact CD2-CB 4.15Å; Y652-L715 HydrophobicContact CE2-CB 4.4Å; Y652-L715 HydrophobicContact CG-CB 4.46Å; Y652-L715 HydrophobicContact CG-CD1 4.13Å
653	L	86.5	Confident	77.3	Confident	55 Å²	55	65.4 Å²	65.4	29%	0.288	33%	0.331	S	S	.	.	H	α-helix	trans	-63.7	-43.7	177.8	-66.4	-172.7	0	0	0	112.2	F649 V650 H656 F657	F649-L653 HydrophobicContact CD1-CD1 4.05Å; F649-L653 HydrophobicContact CD1-CG 4.36Å; F649-L653 HydrophobicContact CE1-CD1 3.53Å; F649-L653 HydrophobicContact CE1-CD2 4.47Å; F649-L653 HydrophobicContact CE1-CG 4.08Å; F649-L653 HydrophobicContact CE2-CD2 4.12Å; F649-L653 HydrophobicContact CE2-CG 4.33Å; F649-L653 HydrophobicContact CZ-CD1 3.84Å; F649-L653 HydrophobicContact CZ-CD2 3.97Å; F649-L653 HydrophobicContact CZ-CG 4.06Å; F649-L653 WeakPolarHBondContact O-CG 3.44Å; F649-L653 PolarHBondContact O-N 2.83Å; V650-L653 PolarHBondContact O-N 3.02Å; L653-H656 PolarHBondContact O-N 2.76Å; L653-F657 HydrophobicContact CB-CD2 4.26Å; L653-F657 HydrophobicContact CD2-CD2 4.42Å; L653-F657 HydrophobicContact CD2-CE2 3.98Å; L653-F657 WeakPolarHBondContact O-CB 3.5Å; L653-F657 WeakPolarHBondContact O-CD2 3.5Å; L653-F657 PolarHBondContact O-N 3.18Å
654	L	85.2	Confident	74.8	Confident	56 Å²	56	72 Å²	72	29%	0.293	36%	0.364	S	S	.	.	H	α-helix	trans	-63.3	-42.2	-179.1	-76.7	175.5	0	0	0	111.8	V650 L651 S658 A741 L744	V650-L654 HydrophobicContact CG1-CD1 3.95Å; V650-L654 HydrophobicContact CG1-CG 4.17Å; V650-L654 WeakPolarHBondContact O-CB 3.45Å; V650-L654 VanDerWaalsContact O-CG 3.29Å; V650-L654 WeakPolarHBondContact O-CG 3.48Å; V650-L654 PolarHBondContact O-N 3.05Å; L651-L654 PolarHBondContact O-N 3.04Å; L654-S658 WeakPolarHBondContact O-CA 3.26Å; L654-S658 WeakPolarHBondContact O-CB 3.44Å; L654-S658 PolarHBondContact O-N 2.89Å; L654-A741 HydrophobicContact CB-CB 4.17Å; L654-L744 HydrophobicContact CD1-CB 4.39Å; L654-L744 HydrophobicContact CD1-CD2 3.7Å
655	D	79	Confident	72.4	Confident	14 Å²	14	76.9 Å²	76.9	8%	0.075	40%	0.398	C	S	.	.	H	α-helix	trans	-77.4	-31.2	176.5	-91.4	20.6	0	0	0	112.8	L651 M713 H737 S738 A741	L651-D655 PolarHBondContact O-N 3.01Å; D655-M713 HydrophobicContact CB-CB 4.35Å; D655-M713 HydrophobicContact CB-CE 3.89Å; D655-M713 WeakPolarHBondContact OD2-CE 3.26Å; D655-H737 PolarHBondContact OD2-N 3.15Å; D655-S738 WeakPolarHBondContact OD1-CB 3.4Å; D655-S738 PolarHBondContact OD1-N 3.17Å; D655-S738 PolarHBondContact OD1-OG 2.98Å; D655-A741 WeakPolarHBondContact OD1-CB 3.42Å
656	H	75.9	Confident	70.2	Confident	74 Å²	74	79.5 Å²	79.5	34%	0.343	42%	0.416	S	S	.	.	H	α-helix	trans	-71.1	-38.1	176.2	-166.3	98.7	0	0	0	113.3	Y652 L653 R662	Y652-H656 WeakPolarHBondContact O-CB 3.46Å; Y652-H656 PolarHBondContact O-N 2.69Å; L653-H656 PolarHBondContact O-N 2.76Å; H656-R662 PolarHBondContact NE2-NH1 3.28Å; H656-R662 VanDerWaalsContact NE2-NH1 3.18Å; H656-R662 PolarHBondContact O-NH1 3.39Å
657	F	73.7	Confident	67.7	Low	154 Å²	154	84 Å²	84	68%	0.675	44%	0.436	S	S	*	.	H	α-helix	trans	-93.8	-7	178.3	-70.3	-62.8	0	0	0	113.7	L653 P659	L653-F657 HydrophobicContact CB-CD2 4.26Å; L653-F657 HydrophobicContact CD2-CD2 4.42Å; L653-F657 HydrophobicContact CD2-CE2 3.98Å; L653-F657 WeakPolarHBondContact O-CB 3.5Å; L653-F657 WeakPolarHBondContact O-CD2 3.5Å; L653-F657 PolarHBondContact O-N 3.18Å; F657-P659 VanDerWaalsContact O-CD 3.29Å; F657-P659 WeakPolarHBondContact O-CD 3.4Å
658	S	65.5	Low	65.4	Low	12 Å²	12	91 Å²	91	8%	0.084	47%	0.473	C	S	.	.			trans	-58.5	117.3	171.4	168.7	0	0	0	0	109.9	L654 F660 G661 S738	L654-S658 WeakPolarHBondContact O-CA 3.26Å; L654-S658 WeakPolarHBondContact O-CB 3.44Å; L654-S658 PolarHBondContact O-N 2.89Å; S658-F660 PolarHBondContact O-N 3.18Å; S658-F660 PolarHBondContact OG-N 2.89Å; S658-G661 PolarHBondContact O-N 3.22Å; S658-G661 VanDerWaalsContact O-N 3.08Å; S658-G661 PolarHBondContact OG-N 2.91Å; S658-S738 WeakPolarHBondContact OG-CB 3.32Å
659	P	59.3	Low	62.8	Low	95 Å²	95	99.6 Å²	99.6	62%	0.617	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-2.8	175	29.3	-34.7	0	0	0	112.8	F657 T663	F657-P659 VanDerWaalsContact O-CD 3.29Å; F657-P659 WeakPolarHBondContact O-CD 3.4Å; P659-T663 WeakPolarHBondContact O-CG2 3.11Å; P659-T663 PolarHBondContact O-OG1 3Å
660	F	53.4	Low	60.3	Low	173 Å²	173	99.4 Å²	99.4	76%	0.759	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-6.4	175.7	-58.6	-78.8	0	0	0	113.5	S658	S658-F660 PolarHBondContact O-N 3.18Å; S658-F660 PolarHBondContact OG-N 2.89Å
661	G	52.5	Low	57.8	Low	36 Å²	36	102.8 Å²	102.8	37%	0.371	55%	0.547	S	S	.	.	S	Bend	trans	-87.7	-4.8	-179.6	0	0	0	0	0	114.9	S658	S658-G661 PolarHBondContact O-N 3.22Å; S658-G661 VanDerWaalsContact O-N 3.08Å; S658-G661 PolarHBondContact OG-N 2.91Å
662	R	47.6	Very low	55.2	Low	174 Å²	174	110.3 Å²	110.3	66%	0.657	59%	0.588	S	S	*	*	S	Bend	trans	-130.5	14	-173.3	-88.1	-178.2	165.7	126	-8	114	H656	H656-R662 PolarHBondContact NE2-NH1 3.28Å; H656-R662 VanDerWaalsContact NE2-NH1 3.18Å; H656-R662 PolarHBondContact O-NH1 3.39Å
663	T	39.7	Very low	52.6	Low	83 Å²	83	110.2 Å²	110.2	51%	0.509	61%	0.607	S	S	.	*			trans	-129.6	79.8	-167.4	55.2	0	0	0	0	111.3	P659	P659-T663 WeakPolarHBondContact O-CG2 3.11Å; P659-T663 PolarHBondContact O-OG1 3Å
664	N	39.9	Very low	50	Low	164 Å²	164	114 Å²	114	88%	0.877	64%	0.637	S	S	*	*	S	Bend	trans	-170.2	52.4	160.3	-95.2	-15.7	0	0	0	112.4
665	S	41	Very low	47.4	Very low	101 Å²	101	114.6 Å²	114.6	71%	0.706	66%	0.657	S	S	*	*	S	Bend	trans	-148	-14.4	171.7	63.1	0	0	0	0	117.7
666	D	44.9	Very low	45.2	Very low	156 Å²	156	119.3 Å²	119.3	83%	0.834	69%	0.691	S	S	*	*	S	Bend	trans	-131.6	28.1	-169.5	-77.3	-48.8	0	0	0	114.8
667	L	40.8	Very low	43.3	Very low	168 Å²	168	126 Å²	126	88%	0.88	72%	0.715	S	S	*	*			trans	-141.9	62	-178.2	-130.4	151.5	0	0	0	114.3
668	D	42.5	Very low	41.8	Very low	168 Å²	168	123.7 Å²	123.7	90%	0.898	72%	0.718	S	S	*	*			trans	-147.3	73.6	165.5	-139.4	2.5	0	0	0	111.2
669	M	36.1	Very low	40.7	Very low	181 Å²	181	128.6 Å²	128.6	89%	0.892	75%	0.747	S	S	*	*			trans	-171.3	70.2	148.3	-168.2	153.6	63.2	0	0	113.5
670	S	37	Very low	39.7	Very low	103 Å²	103	130.6 Å²	130.6	72%	0.72	75%	0.752	S	S	*	*			trans	-172.6	109.8	151.2	56.2	0	0	0	0	106.9
671	V	38.5	Very low	39	Very low	126 Å²	126	131.4 Å²	131.4	76%	0.764	75%	0.75	S	S	*	*				45.2	71.5	56.1	-167.9	0	0	0	0	110.6
672	D	34.5	Very low	38.3	Very low	159 Å²	159	136.4 Å²	136.4	85%	0.85	76%	0.764	S	S	*	*				-176.3	160.1	91.9	-100.8	-30.9	0	0	0	112.7
673	G	30.7	Very low	37.7	Very low	63 Å²	63	135.5 Å²	135.5	65%	0.649	77%	0.765	S	S	*	*			trans	113.6	56.5	146.4	0	0	0	0	0	120.6
674	S	32.1	Very low	37.5	Very low	133 Å²	133	136.8 Å²	136.8	93%	0.93	77%	0.769	S	S	*	*			trans	71.1	148.1	152.1	78.9	0	0	0	0	119.1
675	G	30	Very low	37.3	Very low	69 Å²	69	135.3 Å²	135.3	71%	0.711	76%	0.761	S	S	*	*			trans	-174.5	-47.5	175.8	0	0	0	0	0	120.1
676	S	32.7	Very low	37.3	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	76%	0.757	S	S	*	*			trans	65	137.3	176	-165.7	0	0	0	0	116.2
677	Y	37.5	Very low	36.9	Very low	216 Å²	216	135.9 Å²	135.9	85%	0.847	75%	0.745	S	S	*	*			cis	178.6	171.4	-15.6	-114	-70.7	0	0	0	105.3
678	S	41.6	Very low	36.6	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	74%	0.737	S	S	*	*			trans	85.2	130.9	169.8	79.8	0	0	0	0	117.1
679	T	42.6	Very low	36.1	Very low	115 Å²	115	133.4 Å²	133.4	71%	0.706	73%	0.727	S	S	*	*			cis	-166.5	142.6	-5	11.5	0	0	0	0	112.3
680	L	37.8	Very low	36	Very low	137 Å²	137	131.1 Å²	131.1	72%	0.717	72%	0.719	S	S	*	*			trans	61.7	147.6	146.4	-55.2	161.7	0	0	0	118.4
681	R	38	Very low	36.2	Very low	190 Å²	190	132.9 Å²	132.9	72%	0.717	72%	0.72	S	S	*	*			cis	-174.9	176.9	-13.5	-112.3	-178.6	-170.9	180	9.3	106.7
682	Q	39.3	Very low	36.4	Very low	141 Å²	141	135.8 Å²	135.8	66%	0.659	72%	0.723	S	S	*	*			cis	-152.8	127.3	6.4	-144.1	172.3	-105	0	0	111.4
683	F	33.6	Very low	36.5	Very low	155 Å²	155	135.6 Å²	135.6	68%	0.68	72%	0.722	S	S	*	*			trans	66.5	113	133	-81.8	-117.8	0	0	0	123.6
684	D	35.5	Very low	37.1	Very low	111 Å²	111	138.9 Å²	138.9	59%	0.594	73%	0.729	S	S	*	*				82.3	131.6	113	-72.8	21.4	0	0	0	124.6
685	N	36.6	Very low	37.6	Very low	132 Å²	132	137.6 Å²	137.6	71%	0.706	71%	0.711	S	S	*	*			trans	78.7	141.9	142.2	-62	-16.7	0	0	0	119.2
686	E	40.5	Very low	38.5	Very low	132 Å²	132	138.3 Å²	138.3	62%	0.617	70%	0.702	S	S	*	*			cis	-162.4	163.6	-3.9	-127	-168.3	131	0	0	113.2
687	K	37.3	Very low	39.1	Very low	137 Å²	137	139.7 Å²	139.7	60%	0.596	70%	0.7	S	S	*	*			trans	65.8	117	148.5	-80.9	-165.2	171.5	88.7	0	120.2
688	Q	34.3	Very low	39.6	Very low	153 Å²	153	133.4 Å²	133.4	72%	0.715	68%	0.684	S	S	*	*				76.5	146.7	82.7	-78.8	-175.7	-16.1	0	0	113.7
689	L	32.5	Very low	40	Very low	131 Å²	131	133 Å²	133	69%	0.686	67%	0.67	S	S	*	*			cis	-175.6	156.7	-12	178.4	72.4	0	0	0	107
690	N	33.6	Very low	40.2	Very low	134 Å²	134	132 Å²	132	72%	0.717	66%	0.66	S	S	*	*			trans	82.3	151.5	165.3	-67	-26.7	0	0	0	121.1
691	D	39.9	Very low	40.4	Very low	140 Å²	140	134.1 Å²	134.1	75%	0.749	66%	0.659	S	S	*	*			trans	70.1	89.5	163	-65.5	-2.3	0	0	0	121
692	K	43.1	Very low	40.6	Very low	187 Å²	187	130.2 Å²	130.2	81%	0.813	65%	0.649	S	S	*	*				174.9	95.1	105	-90.5	153.1	-171.5	167.7	0	113.9	T694	K692-T694 VanDerWaalsContact C-N 3.33Å; K692-T694 PolarHBondContact O-N 3.48Å
693	N	37.4	Very low	40.7	Very low	155 Å²	155	129 Å²	129	83%	0.829	64%	0.643	S	S	*	*			trans	-76.1	77.4	167.9	-77.7	-20.5	0	0	0	111.7
694	T	42.2	Very low	41	Very low	131 Å²	131	128.8 Å²	128.8	80%	0.804	64%	0.644	S	S	*	*	S	Bend	trans	-154.7	21	167.4	-18.1	0	0	0	0	115.1	K692	K692-T694 VanDerWaalsContact C-N 3.33Å; K692-T694 PolarHBondContact O-N 3.48Å
695	L	44.4	Very low	41.2	Very low	107 Å²	107	130.4 Å²	130.4	56%	0.56	65%	0.648	S	S	*	*			trans	-139.4	23	-175.2	-137.9	133.8	0	0	0	114.1	T698 H699	L695-T698 PolarHBondContact O-OG1 2.76Å; L695-H699 PolarHBondContact O-CD2 3.17Å
696	T	48.5	Very low	41.2	Very low	84 Å²	84	130.8 Å²	130.8	52%	0.515	65%	0.646	S	S	.	*	H	α-helix	trans	-92.2	-22.3	-170.9	47.2	0	0	0	0	114.9	L700	T696-L700 VanDerWaalsContact O-CB 3.23Å; T696-L700 WeakPolarHBondContact O-CB 3.29Å; T696-L700 WeakPolarHBondContact O-CG 3.43Å; T696-L700 PolarHBondContact O-N 3.1Å
697	L	44.1	Very low	41	Very low	141 Å²	141	132.9 Å²	132.9	74%	0.738	65%	0.653	S	S	*	*	H	α-helix	trans	-78.3	-20	178.5	-152.5	99.2	0	0	0	113.7
698	T	49.1	Very low	41	Very low	85 Å²	85	133.6 Å²	133.6	52%	0.521	66%	0.658	S	S	.	*	H	α-helix	trans	-83.9	-42.7	169.4	37.5	0	0	0	0	111.2	L695 R701 Q702	L695-T698 PolarHBondContact O-OG1 2.76Å; T698-R701 PolarHBondContact O-N 3.24Å; T698-Q702 PolarHBondContact O-N 3.44Å
699	H	49.7	Very low	41.5	Very low	94 Å²	94	132.1 Å²	132.1	44%	0.435	66%	0.655	S	S	.	*	H	α-helix	trans	-67	-34.8	174.5	-87.2	-61.8	0	0	0	113.5	L695 R701 Q702 Q703	L695-H699 PolarHBondContact O-CD2 3.17Å; H699-R701 VanDerWaalsContact C-N 3.3Å; H699-R701 PolarHBondContact O-N 2.73Å; H699-Q702 PolarHBondContact ND1-OE1 3Å; H699-Q702 PolarHBondContact O-N 3.11Å; H699-Q703 WeakPolarHBondContact O-CB 3.45Å; H699-Q703 WeakPolarHBondContact O-CG 3.43Å; H699-Q703 PolarHBondContact O-N 3.16Å
700	L	46.1	Very low	42.2	Very low	96 Å²	96	133.5 Å²	133.5	50%	0.503	66%	0.658	S	S	.	*	H	α-helix	trans	-70.2	-25.6	173.5	-73.9	168.8	0	0	0	112.9	T696 Q704	T696-L700 VanDerWaalsContact O-CB 3.23Å; T696-L700 WeakPolarHBondContact O-CB 3.29Å; T696-L700 WeakPolarHBondContact O-CG 3.43Å; T696-L700 PolarHBondContact O-N 3.1Å; L700-Q704 WeakPolarHBondContact O-CB 3.45Å; L700-Q704 WeakPolarHBondContact O-CG 3.38Å; L700-Q704 PolarHBondContact O-N 2.97Å
701	R	41.8	Very low	43.2	Very low	180 Å²	180	134.2 Å²	134.2	68%	0.679	66%	0.657	S	S	*	*	H	α-helix	trans	-73.8	-36.8	169.6	-118.1	-179.4	-170.1	138.3	5.5	112.3	T698 H699 Q705	T698-R701 PolarHBondContact O-N 3.24Å; H699-R701 VanDerWaalsContact C-N 3.3Å; H699-R701 PolarHBondContact O-N 2.73Å; R701-Q705 PolarHBondContact O-N 3.31Å
702	Q	43.2	Very low	44.1	Very low	109 Å²	109	129.6 Å²	129.6	51%	0.509	64%	0.643	S	S	.	*	H	α-helix	trans	-71.2	-37	174.2	-72.2	175.5	-33.1	0	0	112.1	T698 H699 Q705 Q706	T698-Q702 PolarHBondContact O-N 3.44Å; H699-Q702 PolarHBondContact ND1-OE1 3Å; H699-Q702 PolarHBondContact O-N 3.11Å; Q702-Q705 PolarHBondContact O-N 3.17Å; Q702-Q705 VanDerWaalsContact O-N 3.14Å; Q702-Q706 PolarHBondContact O-N 3.42Å
703	Q	42.1	Very low	45	Very low	115 Å²	115	121.2 Å²	121.2	54%	0.537	61%	0.606	S	S	.	*	H	α-helix	trans	-74.7	-24.2	175.9	-74.8	179.7	-26.3	0	0	113.7	H699 Q705	H699-Q703 WeakPolarHBondContact O-CB 3.45Å; H699-Q703 WeakPolarHBondContact O-CG 3.43Å; H699-Q703 PolarHBondContact O-N 3.16Å; Q703-Q705 VanDerWaalsContact C-N 3.31Å
704	Q	39.6	Very low	46.8	Very low	150 Å²	150	117.8 Å²	117.8	70%	0.701	59%	0.588	S	S	*	*	H	α-helix	trans	-74.2	-22.9	166.3	-79.2	-175.7	-32.9	0	0	112.7	L700	L700-Q704 WeakPolarHBondContact O-CB 3.45Å; L700-Q704 WeakPolarHBondContact O-CG 3.38Å; L700-Q704 PolarHBondContact O-N 2.97Å
705	Q	38.6	Very low	48.7	Very low	146 Å²	146	115.8 Å²	115.8	68%	0.682	57%	0.572	S	S	*	*	H	α-helix	trans	-86.7	-17.9	175.3	-117.5	169.3	-29.2	0	0	113.9	R701 Q702 Q703 K707	R701-Q705 PolarHBondContact O-N 3.31Å; Q702-Q705 PolarHBondContact O-N 3.17Å; Q702-Q705 VanDerWaalsContact O-N 3.14Å; Q703-Q705 VanDerWaalsContact C-N 3.31Å; Q705-K707 VanDerWaalsContact C-N 3.35Å
706	Q	37.5	Very low	50.6	Low	140 Å²	140	115 Å²	115	65%	0.654	58%	0.575	S	S	*	*	S	Bend	trans	-88.1	5	170.5	-79.4	-175.1	-56.6	0	0	114	Q702	Q702-Q706 PolarHBondContact O-N 3.42Å
707	K	35.4	Very low	52.2	Low	176 Å²	176	112.7 Å²	112.7	77%	0.765	56%	0.563	S	S	*	*	S	Bend	trans	-113.1	9	-178.4	-144.4	179.1	-178.5	-179.1	0	114.3	Q705	Q705-K707 VanDerWaalsContact C-N 3.35Å
708	E	39.1	Very low	54.3	Low	152 Å²	152	106 Å²	106	71%	0.71	53%	0.527	S	S	*	.	S	Bend	trans	-100.2	-4.6	166.2	-65.6	-175.2	153.8	0	0	111.7	E710	E708-E710 VanDerWaalsContact C-N 3.34Å; E708-E710 PolarHBondContact O-N 3.3Å
709	D	43.2	Very low	56.2	Low	122 Å²	122	103.7 Å²	103.7	65%	0.652	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	1.7	-177.1	-62.8	-34.8	0	0	0	114.7
710	E	48.1	Very low	57.9	Low	160 Å²	160	105.9 Å²	105.9	75%	0.748	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	18.7	179.2	-68	-162.1	145.5	0	0	114	E708 G712	E708-E710 VanDerWaalsContact C-N 3.34Å; E708-E710 PolarHBondContact O-N 3.3Å; E710-G712 PolarHBondContact O-N 3.5Å
711	E	53.7	Low	59.9	Low	149 Å²	149	102 Å²	102	70%	0.696	50%	0.498	S	S	*	.			trans	-77.3	113.4	166.7	-65.9	-162	162.8	0	0	110.5
712	G	59.2	Low	62.2	Low	43 Å²	43	93.4 Å²	93.4	44%	0.443	47%	0.465	S	S	.	.			trans	-56.4	156.2	-178.1	0	0	0	0	0	114	E710 N714	E710-G712 PolarHBondContact O-N 3.5Å; G712-N714 PolarHBondContact O-N 2.87Å
713	M	62.7	Low	64.4	Low	10 Å²	10	92.5 Å²	92.5	5%	0.049	46%	0.457	C	S	.	.			trans	-40.8	110.2	-165.7	-70.4	-153.7	-66.3	0	0	114.3	L651 Y652 D655 P736 A741	L651-M713 HydrophobicContact CB-CE 3.95Å; L651-M713 WeakPolarHBondContact O-CE 3.48Å; Y652-M713 VanDerWaalsContact CD2-O 3.28Å; Y652-M713 WeakPolarHBondContact CD2-O 3.48Å; D655-M713 HydrophobicContact CB-CB 4.35Å; D655-M713 HydrophobicContact CB-CE 3.89Å; D655-M713 WeakPolarHBondContact OD2-CE 3.26Å; M713-P736 HydrophobicContact CE-CB 3.87Å; M713-P736 HydrophobicContact SD-CB 4.26Å; M713-A741 HydrophobicContact CE-CB 4.45Å
714	N	74.4	Confident	66.7	Low	84 Å²	84	87.2 Å²	87.2	45%	0.449	43%	0.434	S	S	.	.			trans	-68	152.9	169.1	-82.3	-54.6	0	0	0	110.3	G712 S716 S717 A718	G712-N714 PolarHBondContact O-N 2.87Å; N714-S716 PolarHBondContact O-N 3.33Å; N714-S717 PolarHBondContact N-OG 2.94Å; N714-S717 VanDerWaalsContact N-OG 3.11Å; N714-S717 PolarHBondContact O-N 2.89Å; N714-S717 PolarHBondContact O-OG 3.44Å; N714-A718 PolarHBondContact O-N 3.06Å
715	L	83.2	Confident	69	Low	89 Å²	89	80.8 Å²	80.8	47%	0.466	40%	0.404	S	S	.	.	H	α-helix	trans	-56.9	-37.1	179.7	-178.6	65	0	0	0	112	F649 Y652 V719	F649-L715 HydrophobicContact CD2-CD1 4.5Å; Y652-L715 HydrophobicContact CD1-CD1 4.4Å; Y652-L715 HydrophobicContact CD2-CB 4.15Å; Y652-L715 HydrophobicContact CE2-CB 4.4Å; Y652-L715 HydrophobicContact CG-CB 4.46Å; Y652-L715 HydrophobicContact CG-CD1 4.13Å; L715-V719 WeakPolarHBondContact O-CB 3.16Å; L715-V719 VanDerWaalsContact O-CG2 3.29Å; L715-V719 WeakPolarHBondContact O-CG2 3.32Å; L715-V719 PolarHBondContact O-N 3.44Å
716	S	83.4	Confident	71.5	Confident	90 Å²	90	74.5 Å²	74.5	63%	0.629	38%	0.375	S	S	*	.	H	α-helix	trans	-66.1	-38.9	175.2	49.4	0	0	0	0	113.2	N714 V719 Y720	N714-S716 PolarHBondContact O-N 3.33Å; S716-V719 PolarHBondContact O-N 3.47Å; S716-Y720 WeakPolarHBondContact O-CB 3.33Å; S716-Y720 PolarHBondContact O-N 2.78Å
717	S	83	Confident	74	Confident	35 Å²	35	73 Å²	73	25%	0.245	37%	0.372	C	S	.	.	H	α-helix	trans	-73.5	-34.3	177.1	65.6	0	0	0	0	111.6	N714 Y720 F721	N714-S717 PolarHBondContact N-OG 2.94Å; N714-S717 VanDerWaalsContact N-OG 3.11Å; N714-S717 PolarHBondContact O-N 2.89Å; N714-S717 PolarHBondContact O-OG 3.44Å; S717-Y720 PolarHBondContact O-N 3.23Å; S717-F721 VanDerWaalsContact O-CB 3.24Å; S717-F721 WeakPolarHBondContact O-CB 3.46Å; S717-F721 PolarHBondContact O-N 3.44Å
718	A	86.8	Confident	76.5	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-39.3	172.2	0	0	0	0	0	112.5	A648 L651 N714 A722	A648-A718 WeakPolarHBondContact CB-O 3.32Å; A648-A718 WeakPolarHBondContact O-CB 3.35Å; L651-A718 HydrophobicContact CB-CB 4.46Å; N714-A718 PolarHBondContact O-N 3.06Å; A718-A722 WeakPolarHBondContact O-CB 3.37Å; A718-A722 PolarHBondContact O-N 2.92Å
719	V	88.6	Confident	78.7	Confident	38 Å²	38	64.7 Å²	64.7	23%	0.23	35%	0.345	C	S	.	.	H	α-helix	trans	-66	-44.8	172.5	169.8	0	0	0	0	111	A648 L715 S716 A722 W723	A648-V719 HydrophobicContact CB-CB 4.21Å; A648-V719 HydrophobicContact CB-CG2 3.61Å; L715-V719 WeakPolarHBondContact O-CB 3.16Å; L715-V719 VanDerWaalsContact O-CG2 3.29Å; L715-V719 WeakPolarHBondContact O-CG2 3.32Å; L715-V719 PolarHBondContact O-N 3.44Å; S716-V719 PolarHBondContact O-N 3.47Å; V719-A722 PolarHBondContact O-N 3.2Å; V719-W723 PolarHBondContact O-N 3.09Å
720	Y	87.3	Confident	80.4	Confident	139 Å²	139	62.3 Å²	62.3	55%	0.545	35%	0.349	S	S	.	.	H	α-helix	trans	-61.3	-45	176.4	-177.4	-104.6	0	0	0	111.9	S716 S717 A722 W723 A724	S716-Y720 WeakPolarHBondContact O-CB 3.33Å; S716-Y720 PolarHBondContact O-N 2.78Å; S717-Y720 PolarHBondContact O-N 3.23Å; Y720-A722 PolarHBondContact O-N 2.83Å; Y720-W723 PolarHBondContact O-N 2.87Å; Y720-A724 VanDerWaalsContact O-CB 3.28Å; Y720-A724 WeakPolarHBondContact O-CB 3.26Å; Y720-A724 PolarHBondContact O-N 3Å
721	F	88	Confident	81.6	Confident	14 Å²	14	58.2 Å²	58.2	6%	0.061	33%	0.332	C	S	.	.	H	α-helix	trans	-58.1	-47.9	174.8	176.1	-90.4	0	0	0	111.9	L651 S717 W723 A724 V725 I731 P736	L651-F721 HydrophobicContact CD1-CD1 3.69Å; L651-F721 HydrophobicContact CD1-CE1 3.86Å; S717-F721 VanDerWaalsContact O-CB 3.24Å; S717-F721 WeakPolarHBondContact O-CB 3.46Å; S717-F721 PolarHBondContact O-N 3.44Å; F721-W723 VanDerWaalsContact C-N 3.34Å; F721-W723 PolarHBondContact O-N 2.8Å; F721-A724 PolarHBondContact O-N 2.79Å; F721-V725 HydrophobicContact CD1-CG2 4.43Å; F721-V725 HydrophobicContact CE1-CG2 4.1Å; F721-V725 HydrophobicContact CE2-CG2 4.37Å; F721-V725 HydrophobicContact CZ-CG2 4.06Å; F721-V725 WeakPolarHBondContact O-CG2 3.15Å; F721-V725 PolarHBondContact O-N 3.46Å; F721-I731 HydrophobicContact CD2-CD1 4.31Å; F721-I731 HydrophobicContact CD2-CG2 4.01Å; F721-I731 HydrophobicContact CE2-CD1 3.92Å; F721-I731 HydrophobicContact CE2-CG2 4.26Å; F721-P736 HydrophobicContact CE2-CG 4.43Å; F721-P736 HydrophobicContact CZ-CG 4.07Å
722	A	88.9	Confident	82.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-38.4	180	0	0	0	0	0	112.6	V644 A648 A718 V719 Y720 L726 W748	V644-A722 HydrophobicContact CG1-CB 3.83Å; A648-A722 HydrophobicContact CB-CB 3.98Å; A718-A722 WeakPolarHBondContact O-CB 3.37Å; A718-A722 PolarHBondContact O-N 2.92Å; V719-A722 PolarHBondContact O-N 3.2Å; Y720-A722 PolarHBondContact O-N 2.83Å; A722-L726 PolarHBondContact O-N 2.95Å; A722-W748 PolarHBondContact O-NE1 3.41Å
723	W	90.4	Very high	82.3	Confident	90 Å²	90	60.5 Å²	60.5	34%	0.341	35%	0.351	S	S	.	.	H	α-helix	trans	-70.7	-41.6	173	-85.8	109	0	0	0	113.2	V644 V719 Y720 F721 V725 L726 L727	V644-W723 HydrophobicContact CG1-CD2 3.96Å; V644-W723 HydrophobicContact CG1-CG 3.88Å; V644-W723 HydrophobicContact CG1-CZ2 4.47Å; V719-W723 PolarHBondContact O-N 3.09Å; Y720-W723 PolarHBondContact O-N 2.87Å; F721-W723 VanDerWaalsContact C-N 3.34Å; F721-W723 PolarHBondContact O-N 2.8Å; W723-V725 VanDerWaalsContact C-N 3.32Å; W723-V725 PolarHBondContact O-N 2.95Å; W723-L726 HydrophobicContact CE3-CD2 4.14Å; W723-L726 HydrophobicContact CZ3-CD2 3.95Å; W723-L726 PolarHBondContact O-N 2.84Å; W723-L726 VanDerWaalsContact O-N 3.15Å; W723-L727 HydrophobicContact CE3-CD1 4.14Å; W723-L727 HydrophobicContact CE3-CG 4.3Å; W723-L727 WeakPolarHBondContact O-CB 3.31Å; W723-L727 WeakPolarHBondContact O-CG 3.41Å; W723-L727 PolarHBondContact O-N 2.76Å
724	A	89.1	Confident	82.5	Confident	5 Å²	5	61.7 Å²	61.7	4%	0.041	37%	0.366	C	S	.	.	H	α-helix	trans	-61.7	-41.6	178.8	0	0	0	0	0	111.3	Y720 F721 L727 N728 S729 I731	Y720-A724 VanDerWaalsContact O-CB 3.28Å; Y720-A724 WeakPolarHBondContact O-CB 3.26Å; Y720-A724 PolarHBondContact O-N 3Å; F721-A724 PolarHBondContact O-N 2.79Å; A724-L727 PolarHBondContact O-N 2.99Å; A724-N728 PolarHBondContact O-N 3.33Å; A724-S729 PolarHBondContact O-N 3.36Å; A724-I731 HydrophobicContact CB-CG1 4.36Å
725	V	89.4	Confident	82.6	Confident	14 Å²	14	61.5 Å²	61.5	9%	0.085	37%	0.368	C	S	.	.	H	α-helix	trans	-63.1	-41.7	172.9	173.1	0	0	0	0	111.8	F721 W723 N728 I731 W748 A749 A752	F721-V725 HydrophobicContact CD1-CG2 4.43Å; F721-V725 HydrophobicContact CE1-CG2 4.1Å; F721-V725 HydrophobicContact CE2-CG2 4.37Å; F721-V725 HydrophobicContact CZ-CG2 4.06Å; F721-V725 WeakPolarHBondContact O-CG2 3.15Å; F721-V725 PolarHBondContact O-N 3.46Å; W723-V725 VanDerWaalsContact C-N 3.32Å; W723-V725 PolarHBondContact O-N 2.95Å; V725-N728 PolarHBondContact O-N 2.91Å; V725-I731 HydrophobicContact CG2-CD1 3.77Å; V725-W748 VanDerWaalsContact CG1-CD1 3.48Å; V725-W748 HydrophobicContact CG1-CG 4.36Å; V725-A749 VanDerWaalsContact CG1-CA 3.46Å; V725-A749 HydrophobicContact CG1-CB 3.78Å; V725-A752 HydrophobicContact CG1-CB 3.99Å
726	L	90.3	Very high	82.4	Confident	14 Å²	14	57.6 Å²	57.6	7%	0.073	35%	0.348	C	S	.	.	H	α-helix	trans	-66.5	-37.4	177.9	-176.7	65.3	0	0	0	112.8	V640 V644 A722 W723 N728 A752 I755 V756	V640-L726 HydrophobicContact CG1-CD1 4.49Å; V640-L726 HydrophobicContact CG1-CD2 3.8Å; V644-L726 HydrophobicContact CG2-CD2 3.61Å; A722-L726 PolarHBondContact O-N 2.95Å; W723-L726 HydrophobicContact CE3-CD2 4.14Å; W723-L726 HydrophobicContact CZ3-CD2 3.95Å; W723-L726 PolarHBondContact O-N 2.84Å; W723-L726 VanDerWaalsContact O-N 3.15Å; L726-N728 VanDerWaalsContact C-N 3.33Å; L726-A752 HydrophobicContact CD1-CB 4.17Å; L726-I755 HydrophobicContact CD1-CB 4.4Å; L726-I755 HydrophobicContact CD1-CD1 4.19Å; L726-I755 HydrophobicContact CD1-CG2 4.24Å; L726-V756 WeakPolarHBondContact O-CG2 3.35Å
727	L	89.8	Confident	81.9	Confident	109 Å²	109	58.3 Å²	58.3	57%	0.571	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	11.6	-177.1	-63.1	174.6	0	0	0	113.3	W723 A724 S729	W723-L727 HydrophobicContact CE3-CD1 4.14Å; W723-L727 HydrophobicContact CE3-CG 4.3Å; W723-L727 WeakPolarHBondContact O-CB 3.31Å; W723-L727 WeakPolarHBondContact O-CG 3.41Å; W723-L727 PolarHBondContact O-N 2.76Å; A724-L727 PolarHBondContact O-N 2.99Å; L727-S729 PolarHBondContact O-N 3.37Å; L727-S729 PolarHBondContact O-OG 2.96Å
728	N	87.8	Confident	81.8	Confident	96 Å²	96	56.9 Å²	56.9	51%	0.513	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	33.8	-175.3	-66.9	-33.9	0	0	0	113.6	A724 V725 L726	A724-N728 PolarHBondContact O-N 3.33Å; V725-N728 PolarHBondContact O-N 2.91Å; L726-N728 VanDerWaalsContact C-N 3.33Å
729	S	85.9	Confident	81.6	Confident	57 Å²	57	65 Å²	65	40%	0.399	37%	0.366	S	S	.	.			trans	-89.4	142.8	-177.6	-62.6	0	0	0	0	111.1	A724 L727 I731	A724-S729 PolarHBondContact O-N 3.36Å; L727-S729 PolarHBondContact O-N 3.37Å; L727-S729 PolarHBondContact O-OG 2.96Å; S729-I731 PolarHBondContact O-N 3.32Å
730	G	78.4	Confident	81.6	Confident	72 Å²	72	65.8 Å²	65.8	74%	0.742	37%	0.374	S	S	*	.			trans	-60.5	122.2	-178.2	0	0	0	0	0	112.9	G732	G730-G732 PolarHBondContact O-N 3.36Å
731	I	73.6	Confident	81.5	Confident	75 Å²	75	59.1 Å²	59.1	39%	0.385	35%	0.348	S	S	.	.			trans	-85.3	91.6	-178.3	-53.7	165.7	0	0	0	108.8	F721 A724 V725 S729 T735	F721-I731 HydrophobicContact CD2-CD1 4.31Å; F721-I731 HydrophobicContact CD2-CG2 4.01Å; F721-I731 HydrophobicContact CE2-CD1 3.92Å; F721-I731 HydrophobicContact CE2-CG2 4.26Å; A724-I731 HydrophobicContact CB-CG1 4.36Å; V725-I731 HydrophobicContact CG2-CD1 3.77Å; S729-I731 PolarHBondContact O-N 3.32Å; I731-T735 HydrophobicContact CG2-CG2 4.4Å
732	G	63.5	Low	81.5	Confident	75 Å²	75	64.5 Å²	64.5	77%	0.773	37%	0.368	S	S	*	.			trans	-84.7	-26.4	179.1	0	0	0	0	0	115	G730	G730-G732 PolarHBondContact O-N 3.36Å
733	E	63.9	Low	81.6	Confident	164 Å²	164	67.6 Å²	67.6	77%	0.766	39%	0.386	S	S	*	.	S	Bend	trans	-139.3	133.3	-168.4	-65.1	174.9	-177.9	0	0	110.5
734	G	67.7	Low	81.5	Confident	36 Å²	36	65.5 Å²	65.5	37%	0.371	38%	0.381	S	S	.	.			trans	78.4	58.7	168.7	0	0	0	0	0	117.3
735	T	75.2	Confident	81.5	Confident	80 Å²	80	65.6 Å²	65.6	49%	0.491	38%	0.383	S	S	.	.			trans	-75.1	145.8	169.6	62.8	0	0	0	0	112.4	I731 H737	I731-T735 HydrophobicContact CG2-CG2 4.4Å; T735-H737 PolarHBondContact O-CD2 2.92Å; T735-H737 PolarHBondContact O-N 3.24Å
736	P	79.6	Confident	81.4	Confident	7 Å²	7	71.7 Å²	71.7	5%	0.045	41%	0.412	C	S	.	.			trans	-58	132.7	178.5	18.9	-30.5	0	0	0	113.3	M713 F721 A741 R742	M713-P736 HydrophobicContact CE-CB 3.87Å; M713-P736 HydrophobicContact SD-CB 4.26Å; F721-P736 HydrophobicContact CE2-CG 4.43Å; F721-P736 HydrophobicContact CZ-CG 4.07Å; P736-A741 HydrophobicContact CB-CB 3.49Å; P736-A741 VanDerWaalsContact CB-CB 3.49Å; P736-R742 HydrophobicContact CB-CG 4.29Å; P736-R742 HydrophobicContact CG-CG 4.04Å; P736-R742 VanDerWaalsContact O-CG 3.26Å; P736-R742 WeakPolarHBondContact O-CG 3.34Å; P736-R742 PolarHBondContact O-NE 3.14Å
737	H	73.1	Confident	81.5	Confident	105 Å²	105	75.6 Å²	75.6	49%	0.486	44%	0.436	S	S	.	.			trans	-82.7	-42.7	-179.1	-77.3	-113.1	0	0	0	111.9	D655 T735	D655-H737 PolarHBondContact OD2-N 3.15Å; T735-H737 PolarHBondContact O-CD2 2.92Å; T735-H737 PolarHBondContact O-N 3.24Å
738	S	80.5	Confident	81.6	Confident	4 Å²	4	70.8 Å²	70.8	3%	0.028	41%	0.411	C	S	.	.	S	Bend	trans	-72.1	142.4	-178.2	72.1	0	0	0	0	111.9	D655 S658 S740 A741 R742	D655-S738 WeakPolarHBondContact OD1-CB 3.4Å; D655-S738 PolarHBondContact OD1-N 3.17Å; D655-S738 PolarHBondContact OD1-OG 2.98Å; S658-S738 WeakPolarHBondContact OG-CB 3.32Å; S738-S740 WeakPolarHBondContact CB-OG 3.45Å; S738-S740 PolarHBondContact O-N 2.7Å; S738-S740 PolarHBondContact OG-OG 2.93Å; S738-A741 PolarHBondContact O-N 3.25Å; S738-A741 VanDerWaalsContact O-N 3.1Å; S738-A741 WeakPolarHBondContact OG-CB 3.32Å; S738-A741 PolarHBondContact OG-N 2.94Å; S738-R742 WeakPolarHBondContact O-CG 3.27Å; S738-R742 PolarHBondContact O-N 2.61Å
739	F	83.9	Confident	81.7	Confident	170 Å²	170	68 Å²	68	75%	0.746	40%	0.401	S	S	*	.	H	α-helix	trans	-56.6	-39.1	174.3	-179	-98.8	0	0	0	111.4	R742 V743	F739-R742 PolarHBondContact O-N 3.24Å; F739-V743 HydrophobicContact CD1-CG2 4.27Å; F739-V743 HydrophobicContact CE1-CG2 3.85Å; F739-V743 HydrophobicContact CE2-CG2 4.44Å; F739-V743 HydrophobicContact CZ-CG2 3.94Å; F739-V743 WeakPolarHBondContact O-CG2 3.37Å; F739-V743 PolarHBondContact O-N 3.24Å
740	S	87.7	Confident	81.9	Confident	55 Å²	55	67.1 Å²	67.1	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-57.2	-47.7	172.4	35	0	0	0	0	113.3	S738 V743 L744	S738-S740 WeakPolarHBondContact CB-OG 3.45Å; S738-S740 PolarHBondContact O-N 2.7Å; S738-S740 PolarHBondContact OG-OG 2.93Å; S740-V743 PolarHBondContact O-N 3.21Å; S740-L744 WeakPolarHBondContact O-CB 3.2Å; S740-L744 PolarHBondContact O-N 3.17Å
741	A	85.2	Confident	82.6	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-73.3	-29.3	179.2	0	0	0	0	0	112.4	L651 L654 D655 M713 P736 S738 L744 G745	L651-A741 HydrophobicContact CD2-CB 3.8Å; L651-A741 WeakPolarHBondContact CD2-O 3.31Å; L654-A741 HydrophobicContact CB-CB 4.17Å; D655-A741 WeakPolarHBondContact OD1-CB 3.42Å; M713-A741 HydrophobicContact CE-CB 4.45Å; P736-A741 HydrophobicContact CB-CB 3.49Å; P736-A741 VanDerWaalsContact CB-CB 3.49Å; S738-A741 PolarHBondContact O-N 3.25Å; S738-A741 VanDerWaalsContact O-N 3.1Å; S738-A741 WeakPolarHBondContact OG-CB 3.32Å; S738-A741 PolarHBondContact OG-N 2.94Å; A741-L744 PolarHBondContact O-N 3.23Å; A741-G745 PolarHBondContact O-N 3.23Å
742	R	87.4	Confident	83.4	Confident	127 Å²	127	64.9 Å²	64.9	48%	0.479	37%	0.368	S	S	.	.	H	α-helix	trans	-64.4	-46.6	170.1	-71	178.6	-176.3	-177.7	2	112.1	P736 S738 F739 G745 M746	P736-R742 HydrophobicContact CB-CG 4.29Å; P736-R742 HydrophobicContact CG-CG 4.04Å; P736-R742 VanDerWaalsContact O-CG 3.26Å; P736-R742 WeakPolarHBondContact O-CG 3.34Å; P736-R742 PolarHBondContact O-NE 3.14Å; S738-R742 WeakPolarHBondContact O-CG 3.27Å; S738-R742 PolarHBondContact O-N 2.61Å; F739-R742 PolarHBondContact O-N 3.24Å; R742-G745 PolarHBondContact O-N 3.34Å; R742-M746 WeakPolarHBondContact O-CG 3.28Å; R742-M746 PolarHBondContact O-N 3.21Å
743	V	90.7	Very high	84.7	Confident	65 Å²	65	66.4 Å²	66.4	39%	0.394	36%	0.356	S	S	.	.	H	α-helix	trans	-61.8	-44.2	174.7	172.5	0	0	0	0	110.5	F739 S740 G745 M746 V747	F739-V743 HydrophobicContact CD1-CG2 4.27Å; F739-V743 HydrophobicContact CE1-CG2 3.85Å; F739-V743 HydrophobicContact CE2-CG2 4.44Å; F739-V743 HydrophobicContact CZ-CG2 3.94Å; F739-V743 WeakPolarHBondContact O-CG2 3.37Å; F739-V743 PolarHBondContact O-N 3.24Å; S740-V743 PolarHBondContact O-N 3.21Å; V743-G745 VanDerWaalsContact C-N 3.33Å; V743-G745 PolarHBondContact O-N 3.35Å; V743-M746 PolarHBondContact O-N 3.18Å; V743-V747 WeakPolarHBondContact O-CG2 3.38Å; V743-V747 PolarHBondContact O-N 2.98Å
744	L	90.1	Very high	86	Confident	45 Å²	45	63.8 Å²	63.8	24%	0.236	35%	0.346	C	S	.	.	H	α-helix	trans	-62.1	-40.2	175.3	-176.7	62.1	0	0	0	112	V650 L651 L654 S740 A741 V747 W748	V650-L744 HydrophobicContact CB-CD2 4.16Å; V650-L744 HydrophobicContact CG1-CD2 3.54Å; L651-L744 HydrophobicContact CD2-CB 4.16Å; L651-L744 HydrophobicContact CD2-CD2 3.89Å; L651-L744 HydrophobicContact CD2-CG 4.13Å; L651-L744 HydrophobicContact CG-CD2 4.02Å; L654-L744 HydrophobicContact CD1-CB 4.39Å; L654-L744 HydrophobicContact CD1-CD2 3.7Å; S740-L744 WeakPolarHBondContact O-CB 3.2Å; S740-L744 PolarHBondContact O-N 3.17Å; A741-L744 PolarHBondContact O-N 3.23Å; L744-V747 PolarHBondContact O-N 3.24Å; L744-W748 VanDerWaalsContact O-CB 3.29Å; L744-W748 WeakPolarHBondContact O-CB 3.49Å; L744-W748 PolarHBondContact O-N 3.45Å
745	G	87.5	Confident	87.1	Confident	7 Å²	7	62.9 Å²	62.9	7%	0.072	33%	0.333	C	S	.	.	H	α-helix	trans	-64.1	-38.4	174.9	0	0	0	0	0	113.4	A741 R742 V743 W748 A749	A741-G745 PolarHBondContact O-N 3.23Å; R742-G745 PolarHBondContact O-N 3.34Å; V743-G745 VanDerWaalsContact C-N 3.33Å; V743-G745 PolarHBondContact O-N 3.35Å; G745-W748 PolarHBondContact O-N 3.31Å; G745-A749 WeakPolarHBondContact O-CB 3.49Å; G745-A749 PolarHBondContact O-N 3.12Å
746	M	88.3	Confident	87.8	Confident	143 Å²	143	61.2 Å²	61.2	70%	0.704	32%	0.322	S	S	*	.	H	α-helix	trans	-66.4	-43.1	173.2	-70.9	175.2	-178.8	0	0	112	R742 V743 W748 A749 G750	R742-M746 WeakPolarHBondContact O-CG 3.28Å; R742-M746 PolarHBondContact O-N 3.21Å; V743-M746 PolarHBondContact O-N 3.18Å; M746-W748 VanDerWaalsContact C-N 3.34Å; M746-A749 PolarHBondContact O-N 2.73Å; M746-G750 PolarHBondContact O-N 3.44Å
747	V	92	Very high	88.5	Confident	95 Å²	95	63.4 Å²	63.4	58%	0.576	34%	0.341	S	S	*	.	H	α-helix	trans	-64.4	-41.2	175	172.3	0	0	0	0	110.7	V743 L744 G750 F751	V743-V747 WeakPolarHBondContact O-CG2 3.38Å; V743-V747 PolarHBondContact O-N 2.98Å; L744-V747 PolarHBondContact O-N 3.24Å; V747-G750 PolarHBondContact O-N 3.47Å; V747-F751 PolarHBondContact O-N 2.74Å
748	W	92	Very high	89.4	Confident	9 Å²	9	60.5 Å²	60.5	3%	0.034	33%	0.332	C	S	.	.	H	α-helix	trans	-62.9	-41.9	174.7	-178.2	-116.2	0	0	0	112.1	S643 V644 V647 A722 V725 L744 G745 M746 G750 F751 A752	S643-W748 WeakPolarHBondContact OG-CH2 3.45Å; V644-W748 HydrophobicContact CB-CZ2 4.34Å; V644-W748 HydrophobicContact CG2-CH2 4.08Å; V644-W748 HydrophobicContact CG2-CZ2 3.75Å; V647-W748 HydrophobicContact CB-CD2 4.28Å; V647-W748 HydrophobicContact CB-CE3 4.18Å; V647-W748 HydrophobicContact CB-CZ3 4.44Å; V647-W748 HydrophobicContact CG1-CB 4.18Å; V647-W748 HydrophobicContact CG1-CD2 3.85Å; V647-W748 HydrophobicContact CG1-CE3 4.11Å; V647-W748 HydrophobicContact CG1-CG 3.86Å; V647-W748 HydrophobicContact CG2-CD2 4.26Å; V647-W748 HydrophobicContact CG2-CE3 3.67Å; V647-W748 HydrophobicContact CG2-CZ3 3.84Å; A722-W748 PolarHBondContact O-NE1 3.41Å; V725-W748 VanDerWaalsContact CG1-CD1 3.48Å; V725-W748 HydrophobicContact CG1-CG 4.36Å; L744-W748 VanDerWaalsContact O-CB 3.29Å; L744-W748 WeakPolarHBondContact O-CB 3.49Å; L744-W748 PolarHBondContact O-N 3.45Å; G745-W748 PolarHBondContact O-N 3.31Å; M746-W748 VanDerWaalsContact C-N 3.34Å; W748-G750 PolarHBondContact O-N 3.4Å; W748-F751 AromaticContact CE3-CD1 3.93Å; W748-F751 HydrophobicContact CE3-CD1 3.93Å; W748-F751 HydrophobicContact CH2-CD1 4.3Å; W748-F751 AromaticContact CZ3-CD1 3.53Å; W748-F751 HydrophobicContact CZ3-CD1 3.53Å; W748-F751 AromaticContact CZ3-CE1 3.98Å; W748-F751 HydrophobicContact CZ3-CE1 3.98Å; W748-F751 PolarHBondContact O-N 2.89Å; W748-A752 VanDerWaalsContact O-CB 3.28Å; W748-A752 WeakPolarHBondContact O-CB 3.5Å; W748-A752 PolarHBondContact O-N 3.33Å
749	A	89.8	Confident	89.9	Confident	38 Å²	38	63 Å²	63	31%	0.314	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-40.2	174.2	0	0	0	0	0	112.5	V725 G745 M746 A752 M753	V725-A749 VanDerWaalsContact CG1-CA 3.46Å; V725-A749 HydrophobicContact CG1-CB 3.78Å; G745-A749 WeakPolarHBondContact O-CB 3.49Å; G745-A749 PolarHBondContact O-N 3.12Å; M746-A749 PolarHBondContact O-N 2.73Å; A749-A752 PolarHBondContact O-N 3.11Å; A749-M753 WeakPolarHBondContact O-CB 3.5Å; A749-M753 WeakPolarHBondContact O-CG 3.21Å; A749-M753 PolarHBondContact O-N 3.36Å
750	G	91	Very high	90.2	Very high	37 Å²	37	58.3 Å²	58.3	38%	0.381	33%	0.327	S	S	.	.	H	α-helix	trans	-60.3	-44.6	171.8	0	0	0	0	0	112.6	M746 V747 W748 M753 I754	M746-G750 PolarHBondContact O-N 3.44Å; V747-G750 PolarHBondContact O-N 3.47Å; W748-G750 PolarHBondContact O-N 3.4Å; G750-M753 PolarHBondContact O-N 3.09Å; G750-I754 WeakPolarHBondContact O-CD1 3.45Å; G750-I754 VanDerWaalsContact O-CG1 3.31Å; G750-I754 WeakPolarHBondContact O-CG1 3.5Å; G750-I754 PolarHBondContact O-N 3.41Å; G750-I754 VanDerWaalsContact O-N 3.15Å
751	F	91.1	Very high	90.4	Very high	100 Å²	100	58.3 Å²	58.3	44%	0.439	33%	0.33	S	S	.	.	H	α-helix	trans	-69.2	-40.3	178.3	-172.7	-111.9	0	0	0	113	V747 W748 I754 I755	V747-F751 PolarHBondContact O-N 2.74Å; W748-F751 AromaticContact CE3-CD1 3.93Å; W748-F751 HydrophobicContact CE3-CD1 3.93Å; W748-F751 HydrophobicContact CH2-CD1 4.3Å; W748-F751 AromaticContact CZ3-CD1 3.53Å; W748-F751 HydrophobicContact CZ3-CD1 3.53Å; W748-F751 AromaticContact CZ3-CE1 3.98Å; W748-F751 HydrophobicContact CZ3-CE1 3.98Å; W748-F751 PolarHBondContact O-N 2.89Å; F751-I754 WeakPolarHBondContact O-CB 3.44Å; F751-I754 PolarHBondContact O-N 3.18Å; F751-I754 VanDerWaalsContact O-N 3.16Å; F751-I755 HydrophobicContact CD1-CD1 3.65Å; F751-I755 HydrophobicContact CD1-CG1 4.43Å; F751-I755 HydrophobicContact CE1-CD1 3.41Å; F751-I755 VanDerWaalsContact CE1-CD1 3.41Å; F751-I755 HydrophobicContact CE1-CG1 4.2Å; F751-I755 HydrophobicContact CG-CD1 4.47Å; F751-I755 HydrophobicContact CZ-CD1 4.03Å; F751-I755 HydrophobicContact CZ-CG1 4.38Å; F751-I755 WeakPolarHBondContact O-CG1 3.47Å; F751-I755 PolarHBondContact O-N 3.14Å
752	A	90.9	Very high	90.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-59.3	-46.1	173.2	0	0	0	0	0	111.8	V725 L726 W748 A749 I754 I755 V756	V725-A752 HydrophobicContact CG1-CB 3.99Å; L726-A752 HydrophobicContact CD1-CB 4.17Å; W748-A752 VanDerWaalsContact O-CB 3.28Å; W748-A752 WeakPolarHBondContact O-CB 3.5Å; W748-A752 PolarHBondContact O-N 3.33Å; A749-A752 PolarHBondContact O-N 3.11Å; A752-I754 VanDerWaalsContact C-N 3.27Å; A752-I754 PolarHBondContact O-N 2.73Å; A752-I755 PolarHBondContact O-N 2.74Å; A752-I755 VanDerWaalsContact O-N 3.15Å; A752-V756 WeakPolarHBondContact O-CG2 3.39Å; A752-V756 PolarHBondContact O-N 3.34Å
753	M	90.3	Very high	90.4	Very high	107 Å²	107	58.1 Å²	58.1	53%	0.527	34%	0.339	S	S	.	.	H	α-helix	trans	-59.9	-37	174.3	-76.7	-64.2	-63.9	0	0	112.3	A749 G750 A757	A749-M753 WeakPolarHBondContact O-CB 3.5Å; A749-M753 WeakPolarHBondContact O-CG 3.21Å; A749-M753 PolarHBondContact O-N 3.36Å; G750-M753 PolarHBondContact O-N 3.09Å; M753-A757 WeakPolarHBondContact O-CB 3.27Å; M753-A757 PolarHBondContact O-N 3.36Å
754	I	92.2	Very high	90	Very high	109 Å²	109	57.6 Å²	57.6	56%	0.559	34%	0.341	S	S	*	.	H	α-helix	trans	-67.6	-41.6	174.2	-67.3	163	0	0	0	111.5	G750 F751 A752 S758	G750-I754 WeakPolarHBondContact O-CD1 3.45Å; G750-I754 VanDerWaalsContact O-CG1 3.31Å; G750-I754 WeakPolarHBondContact O-CG1 3.5Å; G750-I754 PolarHBondContact O-N 3.41Å; G750-I754 VanDerWaalsContact O-N 3.15Å; F751-I754 WeakPolarHBondContact O-CB 3.44Å; F751-I754 PolarHBondContact O-N 3.18Å; F751-I754 VanDerWaalsContact O-N 3.16Å; A752-I754 VanDerWaalsContact C-N 3.27Å; A752-I754 PolarHBondContact O-N 2.73Å; I754-S758 WeakPolarHBondContact O-CB 3.47Å; I754-S758 PolarHBondContact O-N 2.8Å; I754-S758 PolarHBondContact O-OG 3.45Å
755	I	91.1	Very high	89.7	Confident	18 Å²	18	57.8 Å²	57.8	9%	0.092	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-48.1	175.2	-68.6	164.3	0	0	0	110.6	F632 V640 L726 F751 A752 S758 Y759	F632-I755 HydrophobicContact CE2-CG2 4.11Å; F632-I755 HydrophobicContact CZ-CG2 4.34Å; V640-I755 HydrophobicContact CG1-CD1 4.49Å; V640-I755 HydrophobicContact CG2-CD1 4.15Å; V640-I755 HydrophobicContact CG2-CG2 4.31Å; L726-I755 HydrophobicContact CD1-CB 4.4Å; L726-I755 HydrophobicContact CD1-CD1 4.19Å; L726-I755 HydrophobicContact CD1-CG2 4.24Å; F751-I755 HydrophobicContact CD1-CD1 3.65Å; F751-I755 HydrophobicContact CD1-CG1 4.43Å; F751-I755 HydrophobicContact CE1-CD1 3.41Å; F751-I755 VanDerWaalsContact CE1-CD1 3.41Å; F751-I755 HydrophobicContact CE1-CG1 4.2Å; F751-I755 HydrophobicContact CG-CD1 4.47Å; F751-I755 HydrophobicContact CZ-CD1 4.03Å; F751-I755 HydrophobicContact CZ-CG1 4.38Å; F751-I755 WeakPolarHBondContact O-CG1 3.47Å; F751-I755 PolarHBondContact O-N 3.14Å; A752-I755 PolarHBondContact O-N 2.74Å; A752-I755 VanDerWaalsContact O-N 3.15Å; I755-S758 WeakPolarHBondContact CA-OG 3.3Å; I755-S758 PolarHBondContact O-N 3.27Å; I755-S758 PolarHBondContact O-OG 3.05Å; I755-Y759 WeakPolarHBondContact O-CB 3.45Å; I755-Y759 PolarHBondContact O-N 3.13Å
756	V	90.5	Very high	89.2	Confident	44 Å²	44	59.4 Å²	59.4	27%	0.267	35%	0.354	S	S	.	.	H	α-helix	trans	-65.3	-43.1	-179.7	175	0	0	0	0	111	L726 A752 Y759 T760	L726-V756 WeakPolarHBondContact O-CG2 3.35Å; A752-V756 WeakPolarHBondContact O-CG2 3.39Å; A752-V756 PolarHBondContact O-N 3.34Å; V756-Y759 PolarHBondContact O-N 3.08Å; V756-T760 WeakPolarHBondContact O-CG2 3.46Å; V756-T760 PolarHBondContact O-N 3Å; V756-T760 PolarHBondContact O-OG1 3.22Å
757	A	92.7	Very high	88.5	Confident	53 Å²	53	55.1 Å²	55.1	44%	0.438	33%	0.334	S	S	.	.	H	α-helix	trans	-66	-36.1	177.6	0	0	0	0	0	113.2	M753 T760 A761	M753-A757 WeakPolarHBondContact O-CB 3.27Å; M753-A757 PolarHBondContact O-N 3.36Å; A757-T760 PolarHBondContact O-OG1 2.73Å; A757-A761 WeakPolarHBondContact O-CB 3.38Å; A757-A761 PolarHBondContact O-N 3.01Å
758	S	92.3	Very high	87.5	Confident	44 Å²	44	55.4 Å²	55.4	31%	0.308	34%	0.335	S	S	.	.	H	α-helix	trans	-72.9	-36.9	175	51.7	0	0	0	0	112.3	I754 I755 N762	I754-S758 WeakPolarHBondContact O-CB 3.47Å; I754-S758 PolarHBondContact O-N 2.8Å; I754-S758 PolarHBondContact O-OG 3.45Å; I755-S758 WeakPolarHBondContact CA-OG 3.3Å; I755-S758 PolarHBondContact O-N 3.27Å; I755-S758 PolarHBondContact O-OG 3.05Å; S758-N762 WeakPolarHBondContact O-CB 3.17Å; S758-N762 VanDerWaalsContact O-CG 3.27Å; S758-N762 PolarHBondContact O-N 3.39Å; S758-N762 PolarHBondContact O-OD1 2.84Å
759	Y	91.3	Very high	86.4	Confident	56 Å²	56	61.3 Å²	61.3	22%	0.22	37%	0.367	C	S	.	.	H	α-helix	trans	-60.5	-49	171.2	175.1	-99.4	0	0	0	111.8	F628 P631 F632 W637 I755 V756 N762 L763	F628-Y759 PolarHBondContact O-OH 3.2Å; P631-Y759 HydrophobicContact CB-CD2 4.05Å; P631-Y759 HydrophobicContact CB-CE2 4.02Å; P631-Y759 HydrophobicContact CG-CE2 4.02Å; F632-Y759 AromaticContact CD2-CD2 4Å; F632-Y759 HydrophobicContact CD2-CD2 4Å; F632-Y759 AromaticContact CE2-CD2 3.99Å; F632-Y759 HydrophobicContact CE2-CD2 3.99Å; F632-Y759 HydrophobicContact CE2-CG 4.28Å; W637-Y759 HydrophobicContact CH2-CE2 4.47Å; W637-Y759 HydrophobicContact CZ2-CD2 4.31Å; W637-Y759 HydrophobicContact CZ2-CE2 4.07Å; I755-Y759 WeakPolarHBondContact O-CB 3.45Å; I755-Y759 PolarHBondContact O-N 3.13Å; V756-Y759 PolarHBondContact O-N 3.08Å; Y759-N762 PolarHBondContact O-N 2.88Å; Y759-L763 HydrophobicContact CE1-CD2 4.14Å; Y759-L763 WeakPolarHBondContact O-CB 3.46Å; Y759-L763 PolarHBondContact O-N 2.92Å
760	T	90.3	Very high	85.1	Confident	73 Å²	73	62.7 Å²	62.7	45%	0.448	37%	0.369	S	S	.	.	H	α-helix	trans	-68.4	-35.7	-179.4	55.3	0	0	0	0	112.3	V756 A757 A764	V756-T760 WeakPolarHBondContact O-CG2 3.46Å; V756-T760 PolarHBondContact O-N 3Å; V756-T760 PolarHBondContact O-OG1 3.22Å; A757-T760 PolarHBondContact O-OG1 2.73Å; T760-A764 VanDerWaalsContact O-CB 3.29Å; T760-A764 WeakPolarHBondContact O-CB 3.48Å; T760-A764 PolarHBondContact O-N 2.99Å
761	A	91.4	Very high	83.7	Confident	54 Å²	54	70.5 Å²	70.5	45%	0.446	39%	0.387	S	S	.	.	H	α-helix	trans	-63	-46.3	172.4	0	0	0	0	0	112.1	A757 A764 A765	A757-A761 WeakPolarHBondContact O-CB 3.38Å; A757-A761 PolarHBondContact O-N 3.01Å; A761-A764 PolarHBondContact O-N 3.33Å; A761-A765 WeakPolarHBondContact O-CB 3.05Å; A761-A765 PolarHBondContact O-N 2.92Å
762	N	89.2	Confident	82.2	Confident	75 Å²	75	70 Å²	70	40%	0.401	39%	0.394	S	S	.	.	H	α-helix	trans	-66	-40.2	177.9	-73.5	3.1	0	0	0	112	P631 S758 Y759 A765 F766	P631-N762 HydrophobicContact CB-CB 3.8Å; P631-N762 PolarHBondContact O-ND2 3.07Å; S758-N762 WeakPolarHBondContact O-CB 3.17Å; S758-N762 VanDerWaalsContact O-CG 3.27Å; S758-N762 PolarHBondContact O-N 3.39Å; S758-N762 PolarHBondContact O-OD1 2.84Å; Y759-N762 PolarHBondContact O-N 2.88Å; N762-A765 PolarHBondContact O-N 3.38Å; N762-F766 WeakPolarHBondContact O-CB 3.4Å; N762-F766 PolarHBondContact O-N 3.46Å
763	L	83.6	Confident	80.6	Confident	49 Å²	49	78.3 Å²	78.3	26%	0.257	43%	0.433	S	S	.	.	H	α-helix	trans	-63.6	-43.4	175.3	-178.3	66.2	0	0	0	111.5	P631 Y759 F766 L767	P631-L763 HydrophobicContact CG-CB 4.05Å; P631-L763 HydrophobicContact CG-CD1 3.93Å; Y759-L763 HydrophobicContact CE1-CD2 4.14Å; Y759-L763 WeakPolarHBondContact O-CB 3.46Å; Y759-L763 PolarHBondContact O-N 2.92Å; L763-F766 PolarHBondContact O-N 3.33Å; L763-L767 HydrophobicContact CG-CD1 4.28Å; L763-L767 WeakPolarHBondContact O-CG 3.18Å; L763-L767 PolarHBondContact O-N 3.03Å; L763-L767 VanDerWaalsContact O-N 3.07Å
764	A	82.6	Confident	79.3	Confident	54 Å²	54	75.5 Å²	75.5	45%	0.446	43%	0.427	S	S	.	.	H	α-helix	trans	-64.4	-42	175.9	0	0	0	0	0	112	T760 A761 F766 L767 V768	T760-A764 VanDerWaalsContact O-CB 3.29Å; T760-A764 WeakPolarHBondContact O-CB 3.48Å; T760-A764 PolarHBondContact O-N 2.99Å; A761-A764 PolarHBondContact O-N 3.33Å; A764-F766 VanDerWaalsContact C-N 3.34Å; A764-F766 PolarHBondContact O-N 3.25Å; A764-L767 PolarHBondContact O-N 3.15Å; A764-V768 WeakPolarHBondContact O-CG2 3.34Å; A764-V768 PolarHBondContact O-N 3.12Å
765	A	83.3	Confident	78.4	Confident	49 Å²	49	71.7 Å²	71.7	41%	0.405	41%	0.41	S	S	.	.	H	α-helix	trans	-60.9	-42.4	175.1	0	0	0	0	0	111.9	A761 N762 V768 L769	A761-A765 WeakPolarHBondContact O-CB 3.05Å; A761-A765 PolarHBondContact O-N 2.92Å; N762-A765 PolarHBondContact O-N 3.38Å; A765-V768 PolarHBondContact O-N 3.17Å; A765-L769 WeakPolarHBondContact O-CG 3.49Å; A765-L769 PolarHBondContact O-N 2.63Å
766	F	77.2	Confident	78.1	Confident	41 Å²	41	71 Å²	71	18%	0.18	41%	0.406	C	S	.	.	H	α-helix	trans	-60.9	-47.5	176.4	-172.6	-98.7	0	0	0	112.1	Q630 N762 L763 A764 V768 L769 D770	Q630-F766 VanDerWaalsContact NE2-CE2 3.28Å; N762-F766 WeakPolarHBondContact O-CB 3.4Å; N762-F766 PolarHBondContact O-N 3.46Å; L763-F766 PolarHBondContact O-N 3.33Å; A764-F766 VanDerWaalsContact C-N 3.34Å; A764-F766 PolarHBondContact O-N 3.25Å; F766-V768 PolarHBondContact O-N 2.91Å; F766-L769 PolarHBondContact O-N 2.88Å; F766-D770 VanDerWaalsContact CE1-OD2 3.29Å; F766-D770 WeakPolarHBondContact CE1-OD2 3.41Å; F766-D770 PolarHBondContact O-N 3.49Å
767	L	73.1	Confident	77.8	Confident	53 Å²	53	73.3 Å²	73.3	28%	0.277	42%	0.424	S	S	.	.	H	α-helix	trans	-64.8	-20.3	178.4	-66.7	168.3	0	0	0	114.3	L763 A764 L922	L763-L767 HydrophobicContact CG-CD1 4.28Å; L763-L767 WeakPolarHBondContact O-CG 3.18Å; L763-L767 PolarHBondContact O-N 3.03Å; L763-L767 VanDerWaalsContact O-N 3.07Å; A764-L767 PolarHBondContact O-N 3.15Å; L767-L922 HydrophobicContact CD1-CD1 3.87Å; L767-L922 HydrophobicContact CD2-CD1 4.04Å; L767-L922 HydrophobicContact CD2-CD2 3.87Å; L767-L922 HydrophobicContact CD2-CG 4.07Å
768	V	72.5	Confident	77.5	Confident	100 Å²	100	71.2 Å²	71.2	61%	0.606	41%	0.408	S	S	*	.	H	α-helix	trans	-84.8	-27.6	174.4	172	0	0	0	0	112	A764 A765 F766	A764-V768 WeakPolarHBondContact O-CG2 3.34Å; A764-V768 PolarHBondContact O-N 3.12Å; A765-V768 PolarHBondContact O-N 3.17Å; F766-V768 PolarHBondContact O-N 2.91Å
769	L	67.4	Low	77.4	Confident	133 Å²	133	70 Å²	70	70%	0.696	40%	0.398	S	S	*	.	H	α-helix	trans	-80.5	-24.4	-177.5	-76.3	164.2	0	0	0	114.1	A765 F766 R771	A765-L769 WeakPolarHBondContact O-CG 3.49Å; A765-L769 PolarHBondContact O-N 2.63Å; F766-L769 PolarHBondContact O-N 2.88Å; L769-R771 PolarHBondContact O-N 2.83Å
770	D	62.6	Low	77.2	Confident	68 Å²	68	72.4 Å²	72.4	36%	0.364	42%	0.415	S	S	.	.			trans	-71.7	31.9	-178	-82.4	-12.7	0	0	0	114.5	F766 P772	F766-D770 VanDerWaalsContact CE1-OD2 3.29Å; F766-D770 WeakPolarHBondContact CE1-OD2 3.41Å; F766-D770 PolarHBondContact O-N 3.49Å; D770-P772 WeakPolarHBondContact O-CD 3.39Å
771	R	61.4	Low	77.2	Confident	200 Å²	200	70 Å²	70	76%	0.755	40%	0.399	S	S	*	.			trans	-74	120.5	169.5	-69	-175.5	-179.2	-173.3	-1.4	109	L769 E773	L769-R771 PolarHBondContact O-N 2.83Å; R771-E773 PolarHBondContact O-N 2.93Å
772	P	59.4	Low	77	Confident	91 Å²	91	72.9 Å²	72.9	59%	0.591	41%	0.41	S	S	*	.			trans	-72	96.8	170.4	30	-32.2	0	0	0	108.6	E619 D770	E619-P772 WeakPolarHBondContact O-CB 3.43Å; D770-P772 WeakPolarHBondContact O-CD 3.39Å
773	E	59.2	Low	76.9	Confident	174 Å²	174	75.5 Å²	75.5	81%	0.813	42%	0.415	S	S	*	.			trans	-61.4	145.9	166	-65.6	-177.2	166.8	0	0	109.2	R771 S775	R771-E773 PolarHBondContact O-N 2.93Å; E773-S775 PolarHBondContact O-N 2.71Å
774	A	63	Low	77.2	Confident	47 Å²	47	73.1 Å²	73.1	39%	0.388	40%	0.403	S	S	.	.			trans	-58.8	141.5	168.3	0	0	0	0	0	108.7	I776 A861	A774-I776 PolarHBondContact O-N 2.73Å; A774-A861 HydrophobicContact CB-CB 4.27Å
775	S	73.1	Confident	77.5	Confident	30 Å²	30	73.9 Å²	73.9	21%	0.21	39%	0.394	C	S	.	.	S	Bend	trans	-62.5	-5	-176.2	65.9	0	0	0	0	114.9	E773 R783	E773-S775 PolarHBondContact O-N 2.71Å; S775-R783 PolarHBondContact O-NH1 3.32Å
776	I	83.2	Confident	77.6	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.015	40%	0.404	C	S	.	.			trans	-144.6	137.9	-179.6	-46.1	171.3	0	0	0	107.3	I614 V616 A774 G778 D781 L784 F791 A840 A861	I614-I776 HydrophobicContact CG2-CD1 3.97Å; V616-I776 HydrophobicContact CG1-CD1 3.48Å; V616-I776 VanDerWaalsContact CG1-CD1 3.48Å; V616-I776 HydrophobicContact CG1-CG1 4.19Å; A774-I776 PolarHBondContact O-N 2.73Å; I776-G778 WeakPolarHBondContact CG2-O 3.47Å; I776-D781 VanDerWaalsContact CA-OD2 3.32Å; I776-D781 WeakPolarHBondContact CA-OD2 3.47Å; I776-D781 HydrophobicContact CG2-CB 3.6Å; I776-D781 WeakPolarHBondContact CG2-OD2 3.37Å; I776-L784 HydrophobicContact CG2-CD1 3.73Å; I776-L784 HydrophobicContact CG2-CG 4.43Å; I776-F791 HydrophobicContact CD1-CE2 4.49Å; I776-F791 HydrophobicContact CD1-CZ 3.65Å; I776-F791 HydrophobicContact CG1-CE2 4.44Å; I776-F791 HydrophobicContact CG1-CZ 3.9Å; I776-A840 HydrophobicContact CD1-CB 3.63Å; I776-A861 HydrophobicContact CB-CB 4.34Å
777	S	84	Confident	77.9	Confident	93 Å²	93	76.8 Å²	76.8	65%	0.65	41%	0.406	S	S	*	.			trans	-77.8	-30.8	175.4	56.5	0	0	0	0	113.9	D781 G862	S777-D781 PolarHBondContact N-OD2 3.42Å; S777-G862 WeakPolarHBondContact O-CA 3.45Å
778	G	87.2	Confident	78.3	Confident	9 Å²	9	80.9 Å²	80.9	9%	0.093	42%	0.424	C	S	.	.	S	Bend	trans	160.9	-162.9	-177.6	0	0	0	0	0	110.9	I776 D780 D781 L784	I776-G778 WeakPolarHBondContact CG2-O 3.47Å; G778-D780 VanDerWaalsContact C-N 3.25Å; G778-D780 PolarHBondContact O-N 3.17Å; G778-D781 WeakPolarHBondContact O-CB 3.25Å; G778-D781 PolarHBondContact O-N 2.91Å; G778-L784 WeakPolarHBondContact O-CD1 3.4Å
779	I	89.6	Confident	78.6	Confident	19 Å²	19	85.6 Å²	85.6	10%	0.097	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-27.7	-176.3	-169.6	56.1	0	0	0	113.9	D781 F805 F811 M814 F865	I779-D781 VanDerWaalsContact C-N 3.31Å; I779-D781 PolarHBondContact O-N 3.44Å; I779-F805 HydrophobicContact CD1-CE1 4.21Å; I779-F805 HydrophobicContact CD1-CZ 4.29Å; I779-F811 HydrophobicContact CD1-CE1 4.1Å; I779-F811 HydrophobicContact CD1-CZ 4.5Å; I779-F811 HydrophobicContact CG1-CE1 3.59Å; I779-F811 HydrophobicContact CG1-CZ 3.69Å; I779-M814 HydrophobicContact CD1-CE 3.63Å; I779-M814 HydrophobicContact CD1-SD 4.01Å; I779-F865 HydrophobicContact CB-CD1 3.88Å; I779-F865 HydrophobicContact CB-CE1 3.8Å; I779-F865 HydrophobicContact CB-CE2 4.44Å; I779-F865 HydrophobicContact CB-CG 4.25Å; I779-F865 HydrophobicContact CB-CZ 4.09Å; I779-F865 HydrophobicContact CD1-CE1 4.15Å; I779-F865 HydrophobicContact CD1-CE2 4Å; I779-F865 HydrophobicContact CD1-CZ 3.63Å; I779-F865 HydrophobicContact CG1-CD1 4.4Å; I779-F865 HydrophobicContact CG1-CD2 4.24Å; I779-F865 HydrophobicContact CG1-CE1 4.11Å; I779-F865 HydrophobicContact CG1-CE2 3.93Å; I779-F865 HydrophobicContact CG1-CG 4.47Å; I779-F865 HydrophobicContact CG1-CZ 3.85Å; I779-F865 HydrophobicContact CG2-CB 4.47Å; I779-F865 HydrophobicContact CG2-CD1 4.1Å; I779-F865 HydrophobicContact CG2-CG 4.14Å
780	D	88	Confident	79.4	Confident	106 Å²	106	86 Å²	86	57%	0.567	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	9	178.9	-63.9	-52.5	0	0	0	114.7	G778 V782 R785	G778-D780 VanDerWaalsContact C-N 3.25Å; G778-D780 PolarHBondContact O-N 3.17Å; D780-V782 PolarHBondContact O-N 3.18Å; D780-R785 IonicContact OD1-CZ 3.49Å; D780-R785 IonicContact OD1-NE 2.75Å; D780-R785 PolarHBondContact OD1-NE 3.18Å; D780-R785 IonicContact OD1-NH2 2.7Å; D780-R785 PolarHBondContact OD1-NH2 3.47Å
781	D	90.2	Very high	80.6	Confident	23 Å²	23	84 Å²	84	12%	0.123	43%	0.427	C	S	.	.			trans	-59.2	131.5	171.2	-167.1	-35.3	0	0	0	110.3	I776 S777 G778 I779 R783 L784 R785	I776-D781 VanDerWaalsContact CA-OD2 3.32Å; I776-D781 WeakPolarHBondContact CA-OD2 3.47Å; I776-D781 HydrophobicContact CG2-CB 3.6Å; I776-D781 WeakPolarHBondContact CG2-OD2 3.37Å; S777-D781 PolarHBondContact N-OD2 3.42Å; G778-D781 WeakPolarHBondContact O-CB 3.25Å; G778-D781 PolarHBondContact O-N 2.91Å; I779-D781 VanDerWaalsContact C-N 3.31Å; I779-D781 PolarHBondContact O-N 3.44Å; D781-R783 PolarHBondContact O-N 3.23Å; D781-R783 VanDerWaalsContact O-N 3.08Å; D781-R783 WeakPolarHBondContact OD1-CB 3.38Å; D781-R783 WeakPolarHBondContact OD1-CG 3.45Å; D781-R783 PolarHBondContact OD1-N 2.95Å; D781-L784 HydrophobicContact CB-CD1 4.49Å; D781-L784 PolarHBondContact O-N 2.73Å; D781-R785 PolarHBondContact O-N 3.47Å
782	V	88	Confident	81.9	Confident	113 Å²	113	77.6 Å²	77.6	69%	0.685	41%	0.408	S	S	*	.	H	α-helix	trans	-52.4	-31.1	175.2	-176.5	0	0	0	0	111.6	D780 L784 N786	D780-V782 PolarHBondContact O-N 3.18Å; V782-L784 VanDerWaalsContact C-N 3.32Å; V782-L784 PolarHBondContact O-N 3.07Å; V782-N786 WeakPolarHBondContact O-CB 3.21Å; V782-N786 PolarHBondContact O-N 3.46Å
783	R	86	Confident	83.5	Confident	130 Å²	130	73.2 Å²	73.2	49%	0.491	38%	0.379	S	S	.	.	H	α-helix	trans	-64.4	-31.4	176.1	-66.4	172.7	173	-175.9	-1.4	113.6	S775 D781 F791	S775-R783 PolarHBondContact O-NH1 3.32Å; D781-R783 PolarHBondContact O-N 3.23Å; D781-R783 VanDerWaalsContact O-N 3.08Å; D781-R783 WeakPolarHBondContact OD1-CB 3.38Å; D781-R783 WeakPolarHBondContact OD1-CG 3.45Å; D781-R783 PolarHBondContact OD1-N 2.95Å; R783-F791 HydrophobicContact CB-CD1 4.36Å; R783-F791 HydrophobicContact CB-CE1 4.37Å
784	L	89.2	Confident	85.2	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-88.8	-47.2	177.8	-75.1	168.1	0	0	0	111.6	I614 I776 G778 D781 V782 N786 F791 F793 M814	I614-L784 HydrophobicContact CD1-CD1 3.6Å; I776-L784 HydrophobicContact CG2-CD1 3.73Å; I776-L784 HydrophobicContact CG2-CG 4.43Å; G778-L784 WeakPolarHBondContact O-CD1 3.4Å; D781-L784 HydrophobicContact CB-CD1 4.49Å; D781-L784 PolarHBondContact O-N 2.73Å; V782-L784 VanDerWaalsContact C-N 3.32Å; V782-L784 PolarHBondContact O-N 3.07Å; L784-N786 VanDerWaalsContact C-N 3.28Å; L784-N786 PolarHBondContact O-N 3.06Å; L784-F791 HydrophobicContact CD2-CE1 3.81Å; L784-F791 HydrophobicContact CG-CE1 4.21Å; L784-F793 HydrophobicContact CD2-CB 4.3Å; L784-F793 HydrophobicContact CD2-CD1 3.57Å; L784-F793 HydrophobicContact CD2-CE1 3.97Å; L784-F793 HydrophobicContact CD2-CG 3.9Å; L784-M814 HydrophobicContact CB-SD 3.96Å; L784-M814 HydrophobicContact CD2-SD 4.25Å
785	R	88.8	Confident	86.7	Confident	69 Å²	69	62.7 Å²	62.7	26%	0.26	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-32.7	178.6	-67.6	-74.5	-163.5	160.2	3.1	112.1	D780 D781 E810 T813	D780-R785 IonicContact OD1-CZ 3.49Å; D780-R785 IonicContact OD1-NE 2.75Å; D780-R785 PolarHBondContact OD1-NE 3.18Å; D780-R785 IonicContact OD1-NH2 2.7Å; D780-R785 PolarHBondContact OD1-NH2 3.47Å; D781-R785 PolarHBondContact O-N 3.47Å; R785-E810 IonicContact CZ-OE2 3.9Å; R785-E810 VanDerWaalsContact NH1-CB 3.35Å; R785-E810 PolarHBondContact NH1-O 3.14Å; R785-E810 VanDerWaalsContact NH1-O 3.17Å; R785-E810 IonicContact NH1-OE2 3.71Å; R785-E810 PolarHBondContact NH1-OE2 3.07Å; R785-E810 IonicContact NH2-OE2 2.85Å; R785-E810 PolarHBondContact NH2-OE2 3.38Å; R785-T813 PolarHBondContact O-OG1 3.48Å
786	N	87.1	Confident	87.7	Confident	117 Å²	117	62 Å²	62	63%	0.626	32%	0.316	S	S	*	.	S	Bend	trans	-126.9	80	176.1	-172.2	26.6	0	0	0	112	V782 L784 Q788	V782-N786 WeakPolarHBondContact O-CB 3.21Å; V782-N786 PolarHBondContact O-N 3.46Å; L784-N786 VanDerWaalsContact C-N 3.28Å; L784-N786 PolarHBondContact O-N 3.06Å; N786-Q788 PolarHBondContact O-N 3.41Å
787	P	82	Confident	88	Confident	35 Å²	35	67.9 Å²	67.9	23%	0.227	34%	0.338	C	S	.	.			trans	-59.3	124.6	-172.6	17.5	-29.3	0	0	0	114.2	F793 V817	P787-F793 HydrophobicContact CB-CE1 3.87Å; P787-F793 HydrophobicContact CB-CZ 4.12Å; P787-F793 HydrophobicContact CG-CZ 4.41Å; P787-V817 HydrophobicContact CB-CB 4.46Å; P787-V817 HydrophobicContact CB-CG1 4.23Å; P787-V817 HydrophobicContact CB-CG2 4.09Å; P787-V817 HydrophobicContact CG-CB 4.18Å; P787-V817 HydrophobicContact CG-CG1 4.48Å; P787-V817 HydrophobicContact CG-CG2 3.52Å
788	Q	81.3	Confident	88	Confident	138 Å²	138	65.1 Å²	65.1	65%	0.645	33%	0.325	S	S	*	.			trans	-84.5	150.3	165	-65.4	-172.2	-16.9	0	0	110.4	N786 D790 F791	N786-Q788 PolarHBondContact O-N 3.41Å; Q788-D790 PolarHBondContact O-N 2.86Å; Q788-D790 VanDerWaalsContact O-N 3.1Å; Q788-F791 PolarHBondContact O-N 3.41Å
789	K	79.7	Confident	88	Confident	200 Å²	200	65 Å²	65	87%	0.87	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.4	-178.5	-69.6	-173.1	176	-175.4	0	114.4	F791	K789-F791 VanDerWaalsContact C-N 3.33Å
790	D	83.3	Confident	88.1	Confident	141 Å²	141	65.1 Å²	65.1	75%	0.754	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-7.3	-178.4	-53.8	-24.4	0	0	0	112.5	Q788	Q788-D790 PolarHBondContact O-N 2.86Å; Q788-D790 VanDerWaalsContact O-N 3.1Å
791	F	87.8	Confident	88.3	Confident	26 Å²	26	60.2 Å²	60.2	11%	0.114	30%	0.298	C	S	.	.			trans	-111.3	80.2	-177.1	-167	-96.3	0	0	0	110.7	I776 R783 L784 Q788 K789 F793 K839 A840	I776-F791 HydrophobicContact CD1-CE2 4.49Å; I776-F791 HydrophobicContact CD1-CZ 3.65Å; I776-F791 HydrophobicContact CG1-CE2 4.44Å; I776-F791 HydrophobicContact CG1-CZ 3.9Å; R783-F791 HydrophobicContact CB-CD1 4.36Å; R783-F791 HydrophobicContact CB-CE1 4.37Å; L784-F791 HydrophobicContact CD2-CE1 3.81Å; L784-F791 HydrophobicContact CG-CE1 4.21Å; Q788-F791 PolarHBondContact O-N 3.41Å; K789-F791 VanDerWaalsContact C-N 3.33Å; F791-F793 AromaticContact CD1-CD1 3.9Å; F791-F793 HydrophobicContact CD1-CD1 3.9Å; F791-F793 HydrophobicContact CD1-CE1 4.43Å; F791-F793 AromaticContact CE1-CD1 3.94Å; F791-F793 HydrophobicContact CE1-CD1 3.94Å; F791-K839 HydrophobicContact CD2-CB 3.86Å; F791-K839 HydrophobicContact CD2-CG 4.06Å; F791-K839 HydrophobicContact CE2-CB 3.66Å; F791-K839 HydrophobicContact CE2-CG 4.31Å; F791-K839 HydrophobicContact CZ-CB 4.2Å; F791-A840 HydrophobicContact CZ-CB 4.17Å
792	L	90.5	Very high	88.4	Confident	65 Å²	65	60.4 Å²	60.4	34%	0.34	30%	0.298	S	S	.	.			trans	-81.6	129.5	178.2	-61.9	176.3	0	0	0	111.2	L838 K839 A840	L792-L838 HydrophobicContact CB-CD1 4.31Å; L792-L838 WeakPolarHBondContact O-CD1 3.16Å; L792-K839 WeakPolarHBondContact O-CB 3.38Å; L792-K839 PolarHBondContact O-N 2.8Å; L792-A840 PolarHBondContact O-N 2.88Å
793	F	93	Very high	88.4	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	154.6	169.2	56	-100.5	0	0	0	110.9	L784 P787 F791 M814 V817 M818 A840	L784-F793 HydrophobicContact CD2-CB 4.3Å; L784-F793 HydrophobicContact CD2-CD1 3.57Å; L784-F793 HydrophobicContact CD2-CE1 3.97Å; L784-F793 HydrophobicContact CD2-CG 3.9Å; P787-F793 HydrophobicContact CB-CE1 3.87Å; P787-F793 HydrophobicContact CB-CZ 4.12Å; P787-F793 HydrophobicContact CG-CZ 4.41Å; F791-F793 AromaticContact CD1-CD1 3.9Å; F791-F793 HydrophobicContact CD1-CD1 3.9Å; F791-F793 HydrophobicContact CD1-CE1 4.43Å; F791-F793 AromaticContact CE1-CD1 3.94Å; F791-F793 HydrophobicContact CE1-CD1 3.94Å; F793-M814 HydrophobicContact CD2-CG 4.29Å; F793-M814 HydrophobicContact CE1-CG 4.32Å; F793-M814 HydrophobicContact CE2-CB 4.48Å; F793-M814 HydrophobicContact CE2-CG 3.35Å; F793-M814 HydrophobicContact CE2-SD 4.41Å; F793-M814 HydrophobicContact CZ-CB 4.4Å; F793-M814 HydrophobicContact CZ-CG 3.36Å; F793-M814 HydrophobicContact CZ-SD 4.47Å; F793-V817 HydrophobicContact CE1-CG1 4.47Å; F793-V817 HydrophobicContact CE2-CB 4.31Å; F793-V817 HydrophobicContact CE2-CG1 4.25Å; F793-V817 HydrophobicContact CZ-CB 4.05Å; F793-V817 HydrophobicContact CZ-CG1 3.96Å; F793-M818 HydrophobicContact CD2-CB 4.47Å; F793-M818 HydrophobicContact CD2-CE 4.16Å; F793-M818 HydrophobicContact CE2-CB 4.18Å; F793-M818 HydrophobicContact CE2-CE 4.21Å; F793-A840 WeakPolarHBondContact CA-O 3.34Å; F793-A840 HydrophobicContact CB-CB 3.98Å; F793-A840 WeakPolarHBondContact CB-O 3.4Å
794	A	94.2	Very high	88.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	162	-174.5	0	0	0	0	0	111.5	N821 Y823 L838 A840 F841 I842	A794-N821 VanDerWaalsContact CB-O 3.28Å; A794-N821 WeakPolarHBondContact CB-O 3.28Å; A794-Y823 HydrophobicContact CB-CD2 3.83Å; A794-Y823 HydrophobicContact CB-CE2 4Å; A794-L838 HydrophobicContact CB-CD1 3.79Å; A794-L838 HydrophobicContact CB-CD2 4.11Å; A794-A840 PolarHBondContact N-O 3.45Å; A794-F841 WeakPolarHBondContact O-CD2 3.3Å; A794-I842 PolarHBondContact O-N 2.84Å
795	T	94.8	Very high	88.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.267	C	S	.	.			trans	-128.9	-165.6	161.6	-162	0	0	0	0	109	V801 E802 M818 N822 Y823 I842	T795-V801 HydrophobicContact CG2-CG1 4.43Å; T795-V801 VanDerWaalsContact OG1-CG1 3.32Å; T795-V801 WeakPolarHBondContact OG1-CG1 3.45Å; T795-E802 HydrophobicContact CG2-CB 3.89Å; T795-M818 HydrophobicContact CG2-CG 3.9Å; T795-M818 HydrophobicContact CG2-SD 3.47Å; T795-M818 WeakPolarHBondContact CG2-SD 3.11Å; T795-N822 PolarHBondContact N-OD1 3.46Å; T795-N822 WeakPolarHBondContact O-CA 3.33Å; T795-N822 WeakPolarHBondContact O-CB 3.37Å; T795-N822 PolarHBondContact O-OD1 2.04Å; T795-Y823 PolarHBondContact O-N 3.36Å; T795-Y823 VanDerWaalsContact O-N 3.08Å; T795-I842 WeakPolarHBondContact CB-O 3.39Å; T795-I842 PolarHBondContact OG1-O 3.49Å
796	I	93.4	Very high	89	Confident	15 Å²	15	56.6 Å²	56.6	8%	0.077	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-98.9	140.8	177.3	-64.8	162.3	0	0	0	110.8	S799 Y823 V826 F841 W843	I796-S799 WeakPolarHBondContact O-CB 3.23Å; I796-S799 PolarHBondContact O-N 2.84Å; I796-S799 PolarHBondContact O-OG 2.92Å; I796-Y823 VanDerWaalsContact CA-O 3.27Å; I796-Y823 WeakPolarHBondContact CA-O 3.27Å; I796-V826 HydrophobicContact CD1-CB 3.88Å; I796-V826 HydrophobicContact CD1-CG1 4.26Å; I796-V826 HydrophobicContact CD1-CG2 3.43Å; I796-V826 VanDerWaalsContact CD1-CG2 3.43Å; I796-F841 HydrophobicContact CD1-CE2 4.46Å; I796-F841 HydrophobicContact CD1-CZ 4.01Å; I796-F841 HydrophobicContact CG1-CE2 4.16Å; I796-F841 HydrophobicContact CG1-CZ 4.21Å; I796-W843 HydrophobicContact CB-CE3 4.35Å; I796-W843 HydrophobicContact CB-CH2 3.86Å; I796-W843 HydrophobicContact CB-CZ3 3.63Å; I796-W843 HydrophobicContact CD1-CD2 4.04Å; I796-W843 HydrophobicContact CD1-CE3 3.96Å; I796-W843 HydrophobicContact CD1-CH2 3.66Å; I796-W843 HydrophobicContact CD1-CZ2 3.73Å; I796-W843 HydrophobicContact CD1-CZ3 3.78Å; I796-W843 HydrophobicContact CG1-CE3 4.28Å; I796-W843 HydrophobicContact CG1-CH2 4.26Å; I796-W843 HydrophobicContact CG1-CZ3 4.01Å; I796-W843 HydrophobicContact CG2-CH2 4.48Å
797	R	89	Confident	89.2	Confident	126 Å²	126	56.2 Å²	56.2	48%	0.475	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	143.3	178	-59.7	-170.3	-165.7	125.5	4.6	112.4	S799 E802 N822 Y823 D824	R797-S799 PolarHBondContact O-N 2.96Å; R797-E802 WeakPolarHBondContact CA-OE2 3.03Å; R797-N822 HydrophobicContact CG-CB 3.58Å; R797-N822 VanDerWaalsContact CZ-O 3.24Å; R797-N822 PolarHBondContact NE-O 2.76Å; R797-N822 PolarHBondContact NH2-O 3.14Å; R797-Y823 PolarHBondContact N-O 3.46Å; R797-D824 WeakPolarHBondContact CD-OD1 3.5Å; R797-D824 IonicContact CZ-OD1 3.64Å; R797-D824 IonicContact CZ-OD2 2.66Å; R797-D824 IonicContact NE-OD1 2.65Å; R797-D824 IonicContact NH1-OD1 3.65Å; R797-D824 PolarHBondContact NH1-OD1 2.96Å; R797-D824 IonicContact NH1-OD2 2.71Å; R797-D824 PolarHBondContact NH1-OD2 3.12Å
798	G	83.9	Confident	89.6	Confident	36 Å²	36	58.4 Å²	58.4	37%	0.371	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	17.7	-178.6	0	0	0	0	0	113.8	E802	G798-E802 PolarHBondContact N-OE2 3.47Å
799	S	88.8	Confident	90.2	Very high	6 Å²	6	57.8 Å²	57.8	4%	0.042	28%	0.28	C	S	.	.			trans	-90.8	156.6	-175	68.7	0	0	0	0	113.2	I796 R797 V801 E802 M803 W843	I796-S799 WeakPolarHBondContact O-CB 3.23Å; I796-S799 PolarHBondContact O-N 2.84Å; I796-S799 PolarHBondContact O-OG 2.92Å; R797-S799 PolarHBondContact O-N 2.96Å; S799-V801 PolarHBondContact O-N 2.86Å; S799-E802 PolarHBondContact O-N 2.71Å; S799-E802 WeakPolarHBondContact OG-CB 3.41Å; S799-E802 PolarHBondContact OG-N 3.46Å; S799-M803 WeakPolarHBondContact O-CG 3.18Å; S799-M803 PolarHBondContact O-N 2.7Å; S799-W843 VanDerWaalsContact CB-CH2 3.48Å; S799-W843 VanDerWaalsContact CB-CZ3 3.41Å
800	P	90.2	Very high	90.7	Very high	22 Å²	22	54.4 Å²	54.4	14%	0.143	27%	0.268	C	S	.	.	H	α-helix	trans	-57.2	-31	168.2	-26.3	37.2	0	0	0	113.2	T594 M803 Y804	T594-P800 HydrophobicContact CG2-CB 4.14Å; T594-P800 HydrophobicContact CG2-CG 4.36Å; P800-M803 PolarHBondContact O-N 2.61Å; P800-Y804 WeakPolarHBondContact O-CB 3.44Å; P800-Y804 PolarHBondContact O-N 2.97Å
801	V	92.7	Very high	91.1	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-69.1	-44.2	177.1	-179.1	0	0	0	0	111.2	I612 T795 S799 Y804 F805 I842 W843	I612-V801 HydrophobicContact CD1-CG1 4.28Å; I612-V801 HydrophobicContact CD1-CG2 4.46Å; I612-V801 HydrophobicContact CG1-CG2 4.32Å; I612-V801 HydrophobicContact CG2-CG1 4.16Å; T795-V801 HydrophobicContact CG2-CG1 4.43Å; T795-V801 VanDerWaalsContact OG1-CG1 3.32Å; T795-V801 WeakPolarHBondContact OG1-CG1 3.45Å; S799-V801 PolarHBondContact O-N 2.86Å; V801-Y804 WeakPolarHBondContact O-CB 2.99Å; V801-Y804 PolarHBondContact O-N 2.82Å; V801-F805 HydrophobicContact CG1-CD2 4.14Å; V801-F805 HydrophobicContact CG1-CE2 3.72Å; V801-F805 WeakPolarHBondContact O-CD2 3.36Å; V801-F805 PolarHBondContact O-N 2.8Å; V801-I842 HydrophobicContact CG1-CG2 4.12Å; V801-W843 HydrophobicContact CB-CE3 4.24Å; V801-W843 HydrophobicContact CB-CZ3 4.14Å; V801-W843 HydrophobicContact CG2-CE3 3.88Å; V801-W843 HydrophobicContact CG2-CZ3 3.95Å
802	E	92.2	Very high	91.3	Very high	28 Å²	28	48.7 Å²	48.7	13%	0.131	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-44.4	172.7	-174.4	175.6	-135.8	0	0	111.3	T795 R797 G798 S799 Y804 F805 K806 Y815 N822	T795-E802 HydrophobicContact CG2-CB 3.89Å; R797-E802 WeakPolarHBondContact CA-OE2 3.03Å; G798-E802 PolarHBondContact N-OE2 3.47Å; S799-E802 PolarHBondContact O-N 2.71Å; S799-E802 WeakPolarHBondContact OG-CB 3.41Å; S799-E802 PolarHBondContact OG-N 3.46Å; E802-Y804 VanDerWaalsContact C-N 3.28Å; E802-Y804 PolarHBondContact O-N 3.2Å; E802-F805 PolarHBondContact O-N 2.96Å; E802-K806 WeakPolarHBondContact O-CB 3.5Å; E802-K806 PolarHBondContact O-N 2.73Å; E802-Y815 HydrophobicContact CG-CE2 3.82Å; E802-N822 PolarHBondContact OE1-ND2 3.49Å
803	M	88.8	Confident	91.3	Very high	50 Å²	50	49 Å²	49	25%	0.246	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-30.4	176.5	-74.4	-69.5	-168.2	0	0	113.3	S799 P800 K806 R807	S799-M803 WeakPolarHBondContact O-CG 3.18Å; S799-M803 PolarHBondContact O-N 2.7Å; P800-M803 PolarHBondContact O-N 2.61Å; M803-K806 HydrophobicContact SD-CD 4.08Å; M803-R807 WeakPolarHBondContact O-CG 2.97Å; M803-R807 PolarHBondContact O-N 3.21Å; M803-R807 PolarHBondContact O-NE 2.99Å
804	Y	92	Very high	91.3	Very high	66 Å²	66	49 Å²	49	26%	0.259	25%	0.247	S	C	.	.	H	α-helix	trans	-65	-49.8	172.7	179.2	-97.8	0	0	0	110.8	I612 P800 V801 E802 K806 R807 Q808 F811 F865	I612-Y804 HydrophobicContact CD1-CD1 3.72Å; I612-Y804 HydrophobicContact CD1-CE1 4.18Å; I612-Y804 HydrophobicContact CD1-CG 3.95Å; P800-Y804 WeakPolarHBondContact O-CB 3.44Å; P800-Y804 PolarHBondContact O-N 2.97Å; V801-Y804 WeakPolarHBondContact O-CB 2.99Å; V801-Y804 PolarHBondContact O-N 2.82Å; E802-Y804 VanDerWaalsContact C-N 3.28Å; E802-Y804 PolarHBondContact O-N 3.2Å; Y804-K806 VanDerWaalsContact C-N 3.3Å; Y804-K806 PolarHBondContact O-N 2.79Å; Y804-R807 PolarHBondContact O-N 3.13Å; Y804-Q808 HydrophobicContact CD1-CG 4.49Å; Y804-Q808 HydrophobicContact CD2-CG 4.39Å; Y804-Q808 HydrophobicContact CE1-CG 4.21Å; Y804-Q808 HydrophobicContact CE2-CG 4.1Å; Y804-Q808 WeakPolarHBondContact O-CG 3.35Å; Y804-Q808 PolarHBondContact O-N 2.88Å; Y804-F811 HydrophobicContact CE1-CE2 4.32Å; Y804-F865 HydrophobicContact CE1-CD2 4.25Å; Y804-F865 HydrophobicContact CE1-CE2 4.3Å
805	F	93.1	Very high	91.2	Very high	1 Å²	1	50.8 Å²	50.8	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-68.1	-26	176.8	-67.2	-58.4	0	0	0	114.1	I779 V801 E802 F811 M814 Y815 M818 I842 F865	I779-F805 HydrophobicContact CD1-CE1 4.21Å; I779-F805 HydrophobicContact CD1-CZ 4.29Å; V801-F805 HydrophobicContact CG1-CD2 4.14Å; V801-F805 HydrophobicContact CG1-CE2 3.72Å; V801-F805 WeakPolarHBondContact O-CD2 3.36Å; V801-F805 PolarHBondContact O-N 2.8Å; E802-F805 PolarHBondContact O-N 2.96Å; F805-F811 HydrophobicContact CD1-CB 3.71Å; F805-F811 AromaticContact CD1-CD2 3.88Å; F805-F811 HydrophobicContact CD1-CD2 3.88Å; F805-F811 AromaticContact CD1-CG 3.83Å; F805-F811 HydrophobicContact CD1-CG 3.83Å; F805-F811 HydrophobicContact CE1-CB 4.38Å; F805-F811 HydrophobicContact CE1-CD1 4.46Å; F805-F811 AromaticContact CE1-CD2 3.99Å; F805-F811 HydrophobicContact CE1-CD2 3.99Å; F805-F811 HydrophobicContact CE1-CE2 4.42Å; F805-F811 HydrophobicContact CE1-CG 4.04Å; F805-M814 HydrophobicContact CD1-CE 3.45Å; F805-M814 VanDerWaalsContact CD1-CE 3.45Å; F805-M814 HydrophobicContact CE1-CE 3.08Å; F805-M814 HydrophobicContact CE2-CE 4.27Å; F805-M814 HydrophobicContact CG-CE 4.19Å; F805-M814 HydrophobicContact CZ-CE 3.54Å; F805-Y815 HydrophobicContact CB-CD2 4.04Å; F805-M818 HydrophobicContact CB-SD 4.36Å; F805-M818 HydrophobicContact CD2-CE 3.53Å; F805-M818 HydrophobicContact CD2-SD 3.49Å; F805-M818 WeakPolarHBondContact CD2-SD 3.5Å; F805-M818 HydrophobicContact CE2-CE 3.72Å; F805-M818 HydrophobicContact CE2-SD 4.1Å; F805-M818 HydrophobicContact CG-CE 4Å; F805-M818 HydrophobicContact CG-SD 4.13Å; F805-M818 HydrophobicContact CZ-CE 4.34Å; F805-I842 HydrophobicContact CE2-CB 4.48Å; F805-I842 HydrophobicContact CE2-CD1 4.43Å; F805-I842 HydrophobicContact CE2-CG2 3.74Å; F805-I842 HydrophobicContact CZ-CD1 4.33Å; F805-I842 HydrophobicContact CZ-CG2 3.9Å; F805-F865 HydrophobicContact CE1-CE2 4.13Å; F805-F865 AromaticContact CZ-CE2 3.72Å; F805-F865 HydrophobicContact CZ-CE2 3.72Å; F805-F865 AromaticContact CZ-CZ 3.99Å; F805-F865 HydrophobicContact CZ-CZ 3.99Å
806	K	91.6	Very high	91.1	Very high	115 Å²	115	59 Å²	59	50%	0.5	29%	0.285	S	S	.	.	H	α-helix	trans	-69.7	-33.1	173.1	-171.3	178.1	-178.8	179.1	0	112.8	E802 M803 Y804 Y815	E802-K806 WeakPolarHBondContact O-CB 3.5Å; E802-K806 PolarHBondContact O-N 2.73Å; M803-K806 HydrophobicContact SD-CD 4.08Å; Y804-K806 VanDerWaalsContact C-N 3.3Å; Y804-K806 PolarHBondContact O-N 2.79Å; K806-Y815 HydrophobicContact CB-CD2 4.38Å; K806-Y815 HydrophobicContact CB-CE1 4.31Å; K806-Y815 HydrophobicContact CB-CE2 3.92Å; K806-Y815 HydrophobicContact CG-CE1 4.11Å; K806-Y815 HydrophobicContact CG-CE2 4.44Å
807	R	90.3	Very high	90.9	Very high	109 Å²	109	60.1 Å²	60.1	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-81.5	-44.1	178.2	-71.9	173.5	-135.6	-147.7	-2.4	112.9	E596 M803 Y804 V809	E596-R807 IonicContact OE1-CZ 3.51Å; E596-R807 IonicContact OE1-NH1 3.46Å; E596-R807 PolarHBondContact OE1-NH1 2.97Å; E596-R807 IonicContact OE1-NH2 3.86Å; E596-R807 PolarHBondContact OE1-NH2 2.64Å; E596-R807 IonicContact OE2-CZ 3.91Å; E596-R807 IonicContact OE2-NH1 3.82Å; E596-R807 IonicContact OE2-NH2 3.77Å; E596-R807 PolarHBondContact OE2-NH2 2.69Å; M803-R807 WeakPolarHBondContact O-CG 2.97Å; M803-R807 PolarHBondContact O-N 3.21Å; M803-R807 PolarHBondContact O-NE 2.99Å; Y804-R807 PolarHBondContact O-N 3.13Å; R807-V809 PolarHBondContact O-N 2.83Å; R807-V809 VanDerWaalsContact O-N 3.11Å
808	Q	91.2	Very high	91	Very high	80 Å²	80	54.1 Å²	54.1	37%	0.374	27%	0.27	S	S	.	.			trans	-74.2	104.9	-171	-70.7	-63.6	-10.7	0	0	111.3	Y804 E810 F811	Y804-Q808 HydrophobicContact CD1-CG 4.49Å; Y804-Q808 HydrophobicContact CD2-CG 4.39Å; Y804-Q808 HydrophobicContact CE1-CG 4.21Å; Y804-Q808 HydrophobicContact CE2-CG 4.1Å; Y804-Q808 WeakPolarHBondContact O-CG 3.35Å; Y804-Q808 PolarHBondContact O-N 2.88Å; Q808-E810 PolarHBondContact O-N 3.04Å; Q808-E810 VanDerWaalsContact O-N 3.17Å; Q808-F811 HydrophobicContact CB-CD2 3.69Å; Q808-F811 HydrophobicContact CB-CE2 4.44Å; Q808-F811 HydrophobicContact CG-CD2 4.4Å; Q808-F811 PolarHBondContact O-N 2.99Å
809	V	92.9	Very high	91.4	Very high	126 Å²	126	57.5 Å²	57.5	76%	0.764	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-58.1	-33.3	-174.4	-174.5	0	0	0	0	111.9	R807 F811 A812	R807-V809 PolarHBondContact O-N 2.83Å; R807-V809 VanDerWaalsContact O-N 3.11Å; V809-F811 PolarHBondContact O-N 2.9Å; V809-A812 VanDerWaalsContact O-CB 3.26Å; V809-A812 WeakPolarHBondContact O-CB 3.4Å; V809-A812 PolarHBondContact O-N 3.1Å
810	E	90.9	Very high	91.4	Very high	129 Å²	129	62 Å²	62	60%	0.603	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-63.8	-25.4	177.8	-50.6	-164.9	164.5	0	0	114.7	R785 Q808	R785-E810 IonicContact CZ-OE2 3.9Å; R785-E810 VanDerWaalsContact NH1-CB 3.35Å; R785-E810 PolarHBondContact NH1-O 3.14Å; R785-E810 VanDerWaalsContact NH1-O 3.17Å; R785-E810 IonicContact NH1-OE2 3.71Å; R785-E810 PolarHBondContact NH1-OE2 3.07Å; R785-E810 IonicContact NH2-OE2 2.85Å; R785-E810 PolarHBondContact NH2-OE2 3.38Å; Q808-E810 PolarHBondContact O-N 3.04Å; Q808-E810 VanDerWaalsContact O-N 3.17Å
811	F	91.8	Very high	91.5	Very high	12 Å²	12	63.4 Å²	63.4	5%	0.053	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-99.4	8.4	-179.4	-62.6	-59.6	0	0	0	112.5	I779 Y804 F805 Q808 V809 T813 M814 Y815	I779-F811 HydrophobicContact CD1-CE1 4.1Å; I779-F811 HydrophobicContact CD1-CZ 4.5Å; I779-F811 HydrophobicContact CG1-CE1 3.59Å; I779-F811 HydrophobicContact CG1-CZ 3.69Å; Y804-F811 HydrophobicContact CE1-CE2 4.32Å; F805-F811 HydrophobicContact CD1-CB 3.71Å; F805-F811 AromaticContact CD1-CD2 3.88Å; F805-F811 HydrophobicContact CD1-CD2 3.88Å; F805-F811 AromaticContact CD1-CG 3.83Å; F805-F811 HydrophobicContact CD1-CG 3.83Å; F805-F811 HydrophobicContact CE1-CB 4.38Å; F805-F811 HydrophobicContact CE1-CD1 4.46Å; F805-F811 AromaticContact CE1-CD2 3.99Å; F805-F811 HydrophobicContact CE1-CD2 3.99Å; F805-F811 HydrophobicContact CE1-CE2 4.42Å; F805-F811 HydrophobicContact CE1-CG 4.04Å; Q808-F811 HydrophobicContact CB-CD2 3.69Å; Q808-F811 HydrophobicContact CB-CE2 4.44Å; Q808-F811 HydrophobicContact CG-CD2 4.4Å; Q808-F811 PolarHBondContact O-N 2.99Å; V809-F811 PolarHBondContact O-N 2.9Å; F811-T813 PolarHBondContact O-N 2.58Å; F811-T813 VanDerWaalsContact O-N 3.11Å; F811-M814 HydrophobicContact CB-CE 4.36Å; F811-M814 HydrophobicContact CD1-CE 3.97Å; F811-M814 HydrophobicContact CG-CE 4.29Å; F811-M814 CarbonylContact O-C 3.55Å; F811-M814 WeakPolarHBondContact O-CA 3.04Å; F811-M814 WeakPolarHBondContact O-CB 3.02Å; F811-M814 PolarHBondContact O-N 2.97Å; F811-Y815 PolarHBondContact O-N 2.65Å
812	A	91.9	Very high	91.5	Very high	35 Å²	35	63.5 Å²	63.5	29%	0.289	31%	0.31	S	S	.	.	H	α-helix	trans	-59	-26.3	-177.6	0	0	0	0	0	114.3	V809 R816	V809-A812 VanDerWaalsContact O-CB 3.26Å; V809-A812 WeakPolarHBondContact O-CB 3.4Å; V809-A812 PolarHBondContact O-N 3.1Å; A812-R816 WeakPolarHBondContact O-CG 3.25Å; A812-R816 PolarHBondContact O-N 2.83Å
813	T	90.8	Very high	91.6	Very high	72 Å²	72	64.7 Å²	64.7	44%	0.442	31%	0.314	S	S	.	.	H	α-helix	trans	-70.1	-42.1	171.1	51.4	0	0	0	0	111.9	R785 F811	R785-T813 PolarHBondContact O-OG1 3.48Å; F811-T813 PolarHBondContact O-N 2.58Å; F811-T813 VanDerWaalsContact O-N 3.11Å
814	M	92	Very high	91.6	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-70.9	-43.2	-179.5	-159.8	175.8	67.7	0	0	110.9	I779 L784 F793 F805 F811 R816 V817 M818 I842	I779-M814 HydrophobicContact CD1-CE 3.63Å; I779-M814 HydrophobicContact CD1-SD 4.01Å; L784-M814 HydrophobicContact CB-SD 3.96Å; L784-M814 HydrophobicContact CD2-SD 4.25Å; F793-M814 HydrophobicContact CD2-CG 4.29Å; F793-M814 HydrophobicContact CE1-CG 4.32Å; F793-M814 HydrophobicContact CE2-CB 4.48Å; F793-M814 HydrophobicContact CE2-CG 3.35Å; F793-M814 HydrophobicContact CE2-SD 4.41Å; F793-M814 HydrophobicContact CZ-CB 4.4Å; F793-M814 HydrophobicContact CZ-CG 3.36Å; F793-M814 HydrophobicContact CZ-SD 4.47Å; F805-M814 HydrophobicContact CD1-CE 3.45Å; F805-M814 VanDerWaalsContact CD1-CE 3.45Å; F805-M814 HydrophobicContact CE1-CE 3.08Å; F805-M814 HydrophobicContact CE2-CE 4.27Å; F805-M814 HydrophobicContact CG-CE 4.19Å; F805-M814 HydrophobicContact CZ-CE 3.54Å; F811-M814 HydrophobicContact CB-CE 4.36Å; F811-M814 HydrophobicContact CD1-CE 3.97Å; F811-M814 HydrophobicContact CG-CE 4.29Å; F811-M814 CarbonylContact O-C 3.55Å; F811-M814 WeakPolarHBondContact O-CA 3.04Å; F811-M814 WeakPolarHBondContact O-CB 3.02Å; F811-M814 PolarHBondContact O-N 2.97Å; M814-R816 PolarHBondContact O-N 2.86Å; M814-V817 PolarHBondContact O-N 3.33Å; M814-V817 VanDerWaalsContact O-N 3.13Å; M814-M818 HydrophobicContact CE-CE 3.88Å; M814-M818 HydrophobicContact CG-CE 4.3Å; M814-M818 WeakPolarHBondContact O-CB 3.41Å; M814-M818 PolarHBondContact O-N 3.19Å; M814-I842 HydrophobicContact CE-CD1 4.25Å; M814-I842 HydrophobicContact SD-CD1 4.46Å
815	Y	93.1	Very high	91.5	Very high	37 Å²	37	66.2 Å²	66.2	15%	0.145	33%	0.331	C	S	.	.	H	α-helix	trans	-55.5	-45.2	176.2	179.6	-114	0	0	0	112.5	E802 F805 K806 F811 V817 M818 E819	E802-Y815 HydrophobicContact CG-CE2 3.82Å; F805-Y815 HydrophobicContact CB-CD2 4.04Å; K806-Y815 HydrophobicContact CB-CD2 4.38Å; K806-Y815 HydrophobicContact CB-CE1 4.31Å; K806-Y815 HydrophobicContact CB-CE2 3.92Å; K806-Y815 HydrophobicContact CG-CE1 4.11Å; K806-Y815 HydrophobicContact CG-CE2 4.44Å; F811-Y815 PolarHBondContact O-N 2.65Å; Y815-V817 PolarHBondContact O-N 3.18Å; Y815-M818 WeakPolarHBondContact O-CB 3.5Å; Y815-M818 PolarHBondContact O-N 3.21Å; Y815-M818 VanDerWaalsContact O-N 3.16Å; Y815-E819 WeakPolarHBondContact O-CB 3.5Å; Y815-E819 PolarHBondContact O-N 3.16Å
816	R	91.8	Very high	91.4	Very high	171 Å²	171	67 Å²	67	65%	0.645	34%	0.336	S	S	*	.	H	α-helix	trans	-60.9	-28.4	178.3	-74.3	172.2	-178	152.5	5.2	114.4	A812 M814	A812-R816 WeakPolarHBondContact O-CG 3.25Å; A812-R816 PolarHBondContact O-N 2.83Å; M814-R816 PolarHBondContact O-N 2.86Å
817	V	90.5	Very high	91.5	Very high	39 Å²	39	65.8 Å²	65.8	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-85.5	-39	175.6	173.6	0	0	0	0	110.5	P787 F793 M814 Y815 T820 N821	P787-V817 HydrophobicContact CB-CB 4.46Å; P787-V817 HydrophobicContact CB-CG1 4.23Å; P787-V817 HydrophobicContact CB-CG2 4.09Å; P787-V817 HydrophobicContact CG-CB 4.18Å; P787-V817 HydrophobicContact CG-CG1 4.48Å; P787-V817 HydrophobicContact CG-CG2 3.52Å; F793-V817 HydrophobicContact CE1-CG1 4.47Å; F793-V817 HydrophobicContact CE2-CB 4.31Å; F793-V817 HydrophobicContact CE2-CG1 4.25Å; F793-V817 HydrophobicContact CZ-CB 4.05Å; F793-V817 HydrophobicContact CZ-CG1 3.96Å; M814-V817 PolarHBondContact O-N 3.33Å; M814-V817 VanDerWaalsContact O-N 3.13Å; Y815-V817 PolarHBondContact O-N 3.18Å; V817-T820 PolarHBondContact O-N 2.02Å; V817-T820 PolarHBondContact O-OG1 2.86Å; V817-N821 PolarHBondContact O-ND2 3.03Å
818	M	91.5	Very high	91.6	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58.9	-50.7	176	-170.6	176.9	-59.9	0	0	111.9	F793 T795 F805 M814 Y815 T820 N821 N822 I842	F793-M818 HydrophobicContact CD2-CB 4.47Å; F793-M818 HydrophobicContact CD2-CE 4.16Å; F793-M818 HydrophobicContact CE2-CB 4.18Å; F793-M818 HydrophobicContact CE2-CE 4.21Å; T795-M818 HydrophobicContact CG2-CG 3.9Å; T795-M818 HydrophobicContact CG2-SD 3.47Å; T795-M818 WeakPolarHBondContact CG2-SD 3.11Å; F805-M818 HydrophobicContact CB-SD 4.36Å; F805-M818 HydrophobicContact CD2-CE 3.53Å; F805-M818 HydrophobicContact CD2-SD 3.49Å; F805-M818 WeakPolarHBondContact CD2-SD 3.5Å; F805-M818 HydrophobicContact CE2-CE 3.72Å; F805-M818 HydrophobicContact CE2-SD 4.1Å; F805-M818 HydrophobicContact CG-CE 4Å; F805-M818 HydrophobicContact CG-SD 4.13Å; F805-M818 HydrophobicContact CZ-CE 4.34Å; M814-M818 HydrophobicContact CE-CE 3.88Å; M814-M818 HydrophobicContact CG-CE 4.3Å; M814-M818 WeakPolarHBondContact O-CB 3.41Å; M814-M818 PolarHBondContact O-N 3.19Å; Y815-M818 WeakPolarHBondContact O-CB 3.5Å; Y815-M818 PolarHBondContact O-N 3.21Å; Y815-M818 VanDerWaalsContact O-N 3.16Å; M818-T820 PolarHBondContact O-N 3.37Å; M818-T820 VanDerWaalsContact O-N 3.09Å; M818-N821 CarbonylContact O-C 3.57Å; M818-N821 PolarHBondContact O-N 2.8Å; M818-N822 WeakPolarHBondContact CG-OD1 3.4Å; M818-N822 PolarHBondContact O-N 2.96Å; M818-N822 PolarHBondContact O-OD1 3.19Å; M818-I842 HydrophobicContact CE-CD1 3.89Å
819	E	90.6	Very high	91.8	Very high	107 Å²	107	61.7 Å²	61.7	50%	0.5	32%	0.318	S	S	.	.	H	α-helix	trans	-48.2	-40.9	178.4	-176.9	179.9	-155.5	0	0	112.6	Y815	Y815-E819 WeakPolarHBondContact O-CB 3.5Å; Y815-E819 PolarHBondContact O-N 3.16Å
820	T	90.3	Very high	91.9	Very high	101 Å²	101	56 Å²	56	62%	0.62	28%	0.282	S	S	*	.	H	α-helix	trans	-76.2	-19.3	-180	63.9	0	0	0	0	115.1	V817 M818	V817-T820 PolarHBondContact O-N 2.02Å; V817-T820 PolarHBondContact O-OG1 2.86Å; M818-T820 PolarHBondContact O-N 3.37Å; M818-T820 VanDerWaalsContact O-N 3.09Å
821	N	91.1	Very high	92	Very high	52 Å²	52	55.4 Å²	55.4	28%	0.278	28%	0.28	S	S	.	.	H	α-helix	trans	-119.6	2.4	-171.5	-62.6	-64.1	0	0	0	113.8	A794 V817 M818	A794-N821 VanDerWaalsContact CB-O 3.28Å; A794-N821 WeakPolarHBondContact CB-O 3.28Å; V817-N821 PolarHBondContact O-ND2 3.03Å; M818-N821 CarbonylContact O-C 3.57Å; M818-N821 PolarHBondContact O-N 2.8Å
822	N	93.7	Very high	92.2	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.016	28%	0.28	C	S	.	.			trans	-64.4	144.3	-179.3	-77.2	-15.5	0	0	0	112.9	T795 R797 E802 M818	T795-N822 PolarHBondContact N-OD1 3.46Å; T795-N822 WeakPolarHBondContact O-CA 3.33Å; T795-N822 WeakPolarHBondContact O-CB 3.37Å; T795-N822 PolarHBondContact O-OD1 2.04Å; R797-N822 HydrophobicContact CG-CB 3.58Å; R797-N822 VanDerWaalsContact CZ-O 3.24Å; R797-N822 PolarHBondContact NE-O 2.76Å; R797-N822 PolarHBondContact NH2-O 3.14Å; E802-N822 PolarHBondContact OE1-ND2 3.49Å; M818-N822 WeakPolarHBondContact CG-OD1 3.4Å; M818-N822 PolarHBondContact O-N 2.96Å; M818-N822 PolarHBondContact O-OD1 3.19Å
823	Y	93.7	Very high	92.3	Very high	53 Å²	53	53.5 Å²	53.5	21%	0.208	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-98.8	164.7	178	-71.5	-90.7	0	0	0	111.2	A794 T795 I796 R797 E828 A829 A832 L838	A794-Y823 HydrophobicContact CB-CD2 3.83Å; A794-Y823 HydrophobicContact CB-CE2 4Å; T795-Y823 PolarHBondContact O-N 3.36Å; T795-Y823 VanDerWaalsContact O-N 3.08Å; I796-Y823 VanDerWaalsContact CA-O 3.27Å; I796-Y823 WeakPolarHBondContact CA-O 3.27Å; R797-Y823 PolarHBondContact N-O 3.46Å; Y823-E828 HydrophobicContact CD1-CB 4.23Å; Y823-E828 HydrophobicContact CD1-CG 3.69Å; Y823-E828 HydrophobicContact CE1-CG 4Å; Y823-A829 HydrophobicContact CD2-CB 4.04Å; Y823-A829 HydrophobicContact CG-CB 4.13Å; Y823-A832 HydrophobicContact CE1-CB 4.33Å; Y823-A832 HydrophobicContact CE2-CB 4.34Å; Y823-A832 WeakPolarHBondContact OH-CB 3.44Å; Y823-L838 HydrophobicContact CE2-CD1 4.35Å; Y823-L838 HydrophobicContact CE2-CD2 4.11Å
824	D	88.7	Confident	92.4	Very high	106 Å²	106	52.6 Å²	52.6	57%	0.567	26%	0.256	S	S	*	.	S	Bend	trans	-96.2	-18.3	179.1	-61.1	-48.8	0	0	0	112.9	R797	R797-D824 WeakPolarHBondContact CD-OD1 3.5Å; R797-D824 IonicContact CZ-OD1 3.64Å; R797-D824 IonicContact CZ-OD2 2.66Å; R797-D824 IonicContact NE-OD1 2.65Å; R797-D824 IonicContact NH1-OD1 3.65Å; R797-D824 PolarHBondContact NH1-OD1 2.96Å; R797-D824 IonicContact NH1-OD2 2.71Å; R797-D824 PolarHBondContact NH1-OD2 3.12Å
825	S	90	Very high	92.4	Very high	42 Å²	42	56.2 Å²	56.2	29%	0.294	28%	0.282	S	S	.	.			trans	-133.6	148.9	179.3	150.8	0	0	0	0	112.1	E827 A829	S825-E827 VanDerWaalsContact C-N 3.32Å; S825-E827 PolarHBondContact OG-N 3Å; S825-E827 VanDerWaalsContact OG-N 3.13Å; S825-E827 PolarHBondContact OG-OE2 3.01Å; S825-A829 PolarHBondContact O-N 3.24Å
826	V	92.1	Very high	92.2	Very high	17 Å²	17	56 Å²	56	10%	0.103	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-40.3	175.5	-158.2	0	0	0	0	111	I796 E828 A829 I830 F841 R847	I796-V826 HydrophobicContact CD1-CB 3.88Å; I796-V826 HydrophobicContact CD1-CG1 4.26Å; I796-V826 HydrophobicContact CD1-CG2 3.43Å; I796-V826 VanDerWaalsContact CD1-CG2 3.43Å; V826-E828 VanDerWaalsContact C-N 3.34Å; V826-E828 PolarHBondContact O-N 3.13Å; V826-A829 PolarHBondContact O-N 2.92Å; V826-I830 HydrophobicContact CB-CD1 4.49Å; V826-I830 HydrophobicContact CG1-CD1 3.71Å; V826-I830 HydrophobicContact CG1-CG1 4.34Å; V826-I830 WeakPolarHBondContact O-CB 3.33Å; V826-I830 WeakPolarHBondContact O-CD1 3.26Å; V826-I830 VanDerWaalsContact O-CG1 3.27Å; V826-I830 WeakPolarHBondContact O-CG1 3.07Å; V826-I830 PolarHBondContact O-N 3.33Å; V826-F841 HydrophobicContact CG1-CE1 3.84Å; V826-F841 HydrophobicContact CG1-CZ 3.93Å; V826-R847 HydrophobicContact CG1-CG 4.01Å
827	E	91.9	Very high	92.2	Very high	91 Å²	91	51.9 Å²	51.9	43%	0.425	29%	0.285	S	S	.	.	H	α-helix	trans	-66	-39.7	-174.3	-65.5	58.1	-130	0	0	110.6	S825 Q831 R847	S825-E827 VanDerWaalsContact C-N 3.32Å; S825-E827 PolarHBondContact OG-N 3Å; S825-E827 VanDerWaalsContact OG-N 3.13Å; S825-E827 PolarHBondContact OG-OE2 3.01Å; E827-Q831 WeakPolarHBondContact O-CB 3.27Å; E827-Q831 PolarHBondContact O-N 3.02Å; E827-R847 IonicContact OE1-CZ 3.54Å; E827-R847 IonicContact OE1-NE 2.8Å; E827-R847 IonicContact OE1-NH2 2.73Å; E827-R847 PolarHBondContact OE1-NH2 3.46Å
828	E	93.8	Very high	92.3	Very high	103 Å²	103	50.2 Å²	50.2	48%	0.481	28%	0.275	S	S	.	.	H	α-helix	trans	-65.1	-46	173.8	-167.1	-178.8	-171.4	0	0	111.6	Y823 V826 I830 Q831 A832	Y823-E828 HydrophobicContact CD1-CB 4.23Å; Y823-E828 HydrophobicContact CD1-CG 3.69Å; Y823-E828 HydrophobicContact CE1-CG 4Å; V826-E828 VanDerWaalsContact C-N 3.34Å; V826-E828 PolarHBondContact O-N 3.13Å; E828-I830 PolarHBondContact O-N 3.48Å; E828-Q831 PolarHBondContact O-N 3.44Å; E828-A832 PolarHBondContact O-N 2.88Å
829	A	94.5	Very high	92.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-41.3	178.3	0	0	0	0	0	112.6	Y823 S825 V826 Q831 A832 I833 F841	Y823-A829 HydrophobicContact CD2-CB 4.04Å; Y823-A829 HydrophobicContact CG-CB 4.13Å; S825-A829 PolarHBondContact O-N 3.24Å; V826-A829 PolarHBondContact O-N 2.92Å; A829-Q831 VanDerWaalsContact C-N 3.34Å; A829-Q831 PolarHBondContact O-N 3.46Å; A829-A832 WeakPolarHBondContact O-CB 3.41Å; A829-A832 PolarHBondContact O-N 2.9Å; A829-I833 WeakPolarHBondContact O-CG1 3.38Å; A829-I833 PolarHBondContact O-N 3.46Å; A829-I833 VanDerWaalsContact O-N 3.12Å; A829-F841 HydrophobicContact CB-CD1 4.43Å; A829-F841 HydrophobicContact CB-CD2 3.62Å; A829-F841 HydrophobicContact CB-CE1 4.26Å; A829-F841 HydrophobicContact CB-CE2 3.43Å; A829-F841 VanDerWaalsContact CB-CE2 3.43Å; A829-F841 HydrophobicContact CB-CG 4.14Å; A829-F841 HydrophobicContact CB-CZ 3.78Å
830	I	94.4	Very high	92.4	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-62	-42.5	174.1	-69.5	159.9	0	0	0	110.5	L615 V826 E828 A832 I833 K834 F841 E851	L615-I830 HydrophobicContact CD2-CG1 4.25Å; V826-I830 HydrophobicContact CB-CD1 4.49Å; V826-I830 HydrophobicContact CG1-CD1 3.71Å; V826-I830 HydrophobicContact CG1-CG1 4.34Å; V826-I830 WeakPolarHBondContact O-CB 3.33Å; V826-I830 WeakPolarHBondContact O-CD1 3.26Å; V826-I830 VanDerWaalsContact O-CG1 3.27Å; V826-I830 WeakPolarHBondContact O-CG1 3.07Å; V826-I830 PolarHBondContact O-N 3.33Å; E828-I830 PolarHBondContact O-N 3.48Å; I830-A832 VanDerWaalsContact C-N 3.3Å; I830-A832 PolarHBondContact O-N 2.73Å; I830-I833 PolarHBondContact O-N 3.11Å; I830-K834 HydrophobicContact CG2-CD 4.07Å; I830-K834 WeakPolarHBondContact O-CG 3.42Å; I830-K834 PolarHBondContact O-N 2.9Å; I830-F841 HydrophobicContact CG1-CE1 4.4Å; I830-E851 HydrophobicContact CD1-CG 3.74Å
831	Q	94	Very high	92.7	Very high	117 Å²	117	44.7 Å²	44.7	55%	0.547	24%	0.24	S	C	.	.	H	α-helix	trans	-66.5	-32	176.8	-172	62.4	8.7	0	0	112.4	E827 E828 A829 K834 S835	E827-Q831 WeakPolarHBondContact O-CB 3.27Å; E827-Q831 PolarHBondContact O-N 3.02Å; E828-Q831 PolarHBondContact O-N 3.44Å; A829-Q831 VanDerWaalsContact C-N 3.34Å; A829-Q831 PolarHBondContact O-N 3.46Å; Q831-K834 PolarHBondContact O-N 3.23Å; Q831-S835 WeakPolarHBondContact O-CB 3.38Å; Q831-S835 PolarHBondContact O-N 3.08Å; Q831-S835 PolarHBondContact O-OG 3Å
832	A	95.1	Very high	92.9	Very high	7 Å²	7	42.2 Å²	42.2	6%	0.058	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-38.7	172.2	0	0	0	0	0	112.4	Y823 E828 A829 I830 S835 G836 T837 L838	Y823-A832 HydrophobicContact CE1-CB 4.33Å; Y823-A832 HydrophobicContact CE2-CB 4.34Å; Y823-A832 WeakPolarHBondContact OH-CB 3.44Å; E828-A832 PolarHBondContact O-N 2.88Å; A829-A832 WeakPolarHBondContact O-CB 3.41Å; A829-A832 PolarHBondContact O-N 2.9Å; I830-A832 VanDerWaalsContact C-N 3.3Å; I830-A832 PolarHBondContact O-N 2.73Å; A832-S835 WeakPolarHBondContact CA-OG 3.26Å; A832-S835 PolarHBondContact O-OG 3.15Å; A832-S835 VanDerWaalsContact O-OG 3.09Å; A832-G836 PolarHBondContact O-N 3.47Å; A832-T837 WeakPolarHBondContact CA-OG1 3.49Å; A832-T837 WeakPolarHBondContact CB-OG1 3.46Å; A832-T837 PolarHBondContact O-N 3.17Å; A832-T837 PolarHBondContact O-OG1 3.01Å; A832-T837 VanDerWaalsContact O-OG1 3.11Å; A832-L838 HydrophobicContact CB-CB 3.73Å; A832-L838 HydrophobicContact CB-CD2 4.44Å; A832-L838 PolarHBondContact O-N 2.89Å
833	I	94.5	Very high	92.9	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-67.4	-46.1	172.3	-54.7	161.8	0	0	0	110.9	L615 K617 A829 I830 S835 G836 L838 F841 L858	L615-I833 HydrophobicContact CB-CD1 3.92Å; L615-I833 HydrophobicContact CD2-CD1 3.44Å; L615-I833 VanDerWaalsContact CD2-CD1 3.44Å; L615-I833 HydrophobicContact CG-CD1 3.71Å; K617-I833 HydrophobicContact CB-CG2 4.05Å; A829-I833 WeakPolarHBondContact O-CG1 3.38Å; A829-I833 PolarHBondContact O-N 3.46Å; A829-I833 VanDerWaalsContact O-N 3.12Å; I830-I833 PolarHBondContact O-N 3.11Å; I833-S835 VanDerWaalsContact C-N 3.3Å; I833-S835 PolarHBondContact O-N 2.71Å; I833-G836 WeakPolarHBondContact O-CA 3.34Å; I833-G836 PolarHBondContact O-N 3.22Å; I833-L838 HydrophobicContact CG1-CB 4.37Å; I833-L838 HydrophobicContact CG1-CD2 4.1Å; I833-L838 HydrophobicContact CG1-CG 4.48Å; I833-F841 HydrophobicContact CD1-CB 3.3Å; I833-F841 HydrophobicContact CD1-CD1 4.14Å; I833-F841 HydrophobicContact CD1-CG 4.09Å; I833-F841 HydrophobicContact CG1-CB 3.95Å; I833-L858 HydrophobicContact CG2-CD2 3.82Å
834	K	92.8	Very high	93	Very high	52 Å²	52	41.3 Å²	41.3	23%	0.226	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-41.9	-178.9	-72.4	174.7	-174.1	176.5	0	111.4	K617 I830 Q831 E851 D855 L858	K617-K834 PolarHBondContact NZ-O 2.93Å; I830-K834 HydrophobicContact CG2-CD 4.07Å; I830-K834 WeakPolarHBondContact O-CG 3.42Å; I830-K834 PolarHBondContact O-N 2.9Å; Q831-K834 PolarHBondContact O-N 3.23Å; K834-E851 IonicContact NZ-OE2 2.62Å; K834-E851 PolarHBondContact NZ-OE2 2.8Å; K834-D855 WeakPolarHBondContact CE-OD2 3.05Å; K834-D855 IonicContact NZ-OD2 3.31Å; K834-D855 PolarHBondContact NZ-OD2 3.29Å; K834-L858 HydrophobicContact CG-CD2 4.38Å
835	S	92.7	Very high	93.2	Very high	77 Å²	77	36.8 Å²	36.8	54%	0.538	20%	0.2	S	C	.	.	H	α-helix	trans	-76	-17.9	174.2	60.7	0	0	0	0	114.4	Q831 A832 I833 T837	Q831-S835 WeakPolarHBondContact O-CB 3.38Å; Q831-S835 PolarHBondContact O-N 3.08Å; Q831-S835 PolarHBondContact O-OG 3Å; A832-S835 WeakPolarHBondContact CA-OG 3.26Å; A832-S835 PolarHBondContact O-OG 3.15Å; A832-S835 VanDerWaalsContact O-OG 3.09Å; I833-S835 VanDerWaalsContact C-N 3.3Å; I833-S835 PolarHBondContact O-N 2.71Å; S835-T837 PolarHBondContact OG-OG1 2.86Å
836	G	89.4	Confident	93.4	Very high	33 Å²	33	34.9 Å²	34.9	34%	0.34	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	11.8	177.1	0	0	0	0	0	115.1	A832 I833	A832-G836 PolarHBondContact O-N 3.47Å; I833-G836 WeakPolarHBondContact O-CA 3.34Å; I833-G836 PolarHBondContact O-N 3.22Å
837	T	90.9	Very high	93.4	Very high	84 Å²	84	34.4 Å²	34.4	52%	0.515	18%	0.184	S	C	.	.	S	Bend	trans	-72.2	-36.6	172	56.4	0	0	0	0	111.4	A832 S835	A832-T837 WeakPolarHBondContact CA-OG1 3.49Å; A832-T837 WeakPolarHBondContact CB-OG1 3.46Å; A832-T837 PolarHBondContact O-N 3.17Å; A832-T837 PolarHBondContact O-OG1 3.01Å; A832-T837 VanDerWaalsContact O-OG1 3.11Å; S835-T837 PolarHBondContact OG-OG1 2.86Å
838	L	92.2	Very high	93.5	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.021	16%	0.163	C	C	.	.			trans	-99.9	135.4	171.8	-167.8	66.4	0	0	0	109.5	L792 A794 Y823 A832 I833 A840 F841	L792-L838 HydrophobicContact CB-CD1 4.31Å; L792-L838 WeakPolarHBondContact O-CD1 3.16Å; A794-L838 HydrophobicContact CB-CD1 3.79Å; A794-L838 HydrophobicContact CB-CD2 4.11Å; Y823-L838 HydrophobicContact CE2-CD1 4.35Å; Y823-L838 HydrophobicContact CE2-CD2 4.11Å; A832-L838 HydrophobicContact CB-CB 3.73Å; A832-L838 HydrophobicContact CB-CD2 4.44Å; A832-L838 PolarHBondContact O-N 2.89Å; I833-L838 HydrophobicContact CG1-CB 4.37Å; I833-L838 HydrophobicContact CG1-CD2 4.1Å; I833-L838 HydrophobicContact CG1-CG 4.48Å; L838-A840 WeakPolarHBondContact CG-O 3.16Å; L838-F841 HydrophobicContact CD2-CB 3.9Å; L838-F841 HydrophobicContact CD2-CD2 4.41Å
839	K	91.7	Very high	93.4	Very high	92 Å²	92	27.5 Å²	27.5	40%	0.4	15%	0.153	S	C	.	.	S	Bend	trans	-89.2	-37.2	178.2	-64.8	-57.5	-171.6	-178.3	0	112.6	F791 L792	F791-K839 HydrophobicContact CD2-CB 3.86Å; F791-K839 HydrophobicContact CD2-CG 4.06Å; F791-K839 HydrophobicContact CE2-CB 3.66Å; F791-K839 HydrophobicContact CE2-CG 4.31Å; F791-K839 HydrophobicContact CZ-CB 4.2Å; L792-K839 WeakPolarHBondContact O-CB 3.38Å; L792-K839 PolarHBondContact O-N 2.8Å
840	A	93.3	Very high	93.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	137.7	-178.8	0	0	0	0	0	111.1	I614 V616 I776 F791 L792 F793 A794 L838	I614-A840 HydrophobicContact CG2-CB 3.72Å; V616-A840 HydrophobicContact CG1-CB 4.26Å; I776-A840 HydrophobicContact CD1-CB 3.63Å; F791-A840 HydrophobicContact CZ-CB 4.17Å; L792-A840 PolarHBondContact O-N 2.88Å; F793-A840 WeakPolarHBondContact CA-O 3.34Å; F793-A840 HydrophobicContact CB-CB 3.98Å; F793-A840 WeakPolarHBondContact CB-O 3.4Å; A794-A840 PolarHBondContact N-O 3.45Å; L838-A840 WeakPolarHBondContact CG-O 3.16Å
841	F	95.5	Very high	93.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.1	174.1	174.8	-127	0	0	0	109.3	I614 L615 A794 I796 V826 A829 I830 I833 L838 W843 L848	I614-F841 CarbonylContact C-O 3.51Å; I614-F841 WeakPolarHBondContact CA-O 3.35Å; L615-F841 HydrophobicContact CB-CB 4.37Å; L615-F841 HydrophobicContact CB-CD1 4.45Å; L615-F841 HydrophobicContact CD2-CD1 4.49Å; L615-F841 PolarHBondContact N-O 2.84Å; L615-F841 PolarHBondContact O-N 2.78Å; A794-F841 WeakPolarHBondContact O-CD2 3.3Å; I796-F841 HydrophobicContact CD1-CE2 4.46Å; I796-F841 HydrophobicContact CD1-CZ 4.01Å; I796-F841 HydrophobicContact CG1-CE2 4.16Å; I796-F841 HydrophobicContact CG1-CZ 4.21Å; V826-F841 HydrophobicContact CG1-CE1 3.84Å; V826-F841 HydrophobicContact CG1-CZ 3.93Å; A829-F841 HydrophobicContact CB-CD1 4.43Å; A829-F841 HydrophobicContact CB-CD2 3.62Å; A829-F841 HydrophobicContact CB-CE1 4.26Å; A829-F841 HydrophobicContact CB-CE2 3.43Å; A829-F841 VanDerWaalsContact CB-CE2 3.43Å; A829-F841 HydrophobicContact CB-CG 4.14Å; A829-F841 HydrophobicContact CB-CZ 3.78Å; I830-F841 HydrophobicContact CG1-CE1 4.4Å; I833-F841 HydrophobicContact CD1-CB 3.3Å; I833-F841 HydrophobicContact CD1-CD1 4.14Å; I833-F841 HydrophobicContact CD1-CG 4.09Å; I833-F841 HydrophobicContact CG1-CB 3.95Å; L838-F841 HydrophobicContact CD2-CB 3.9Å; L838-F841 HydrophobicContact CD2-CD2 4.41Å; F841-W843 HydrophobicContact CD1-CB 4.08Å; F841-W843 HydrophobicContact CE1-CB 3.53Å; F841-W843 AromaticContact CE1-CG 3.83Å; F841-W843 HydrophobicContact CE1-CG 3.83Å; F841-W843 HydrophobicContact CE2-CB 4.36Å; F841-W843 HydrophobicContact CZ-CB 3.69Å; F841-W843 HydrophobicContact CZ-CD2 4.01Å; F841-W843 HydrophobicContact CZ-CE3 4.28Å; F841-W843 AromaticContact CZ-CG 3.73Å; F841-W843 HydrophobicContact CZ-CG 3.73Å; F841-L848 HydrophobicContact CD1-CD2 3.91Å; F841-L848 HydrophobicContact CE1-CD2 3.95Å
842	I	95.5	Very high	93.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	113.9	-174.1	-52.8	-176.6	0	0	0	108.6	I612 I614 A794 T795 V801 F805 M814 M818 F865	I612-I842 HydrophobicContact CG2-CG2 3.31Å; I614-I842 HydrophobicContact CG1-CG1 4.36Å; I614-I842 HydrophobicContact CG2-CG1 4.41Å; A794-I842 PolarHBondContact O-N 2.84Å; T795-I842 WeakPolarHBondContact CB-O 3.39Å; T795-I842 PolarHBondContact OG1-O 3.49Å; V801-I842 HydrophobicContact CG1-CG2 4.12Å; F805-I842 HydrophobicContact CE2-CB 4.48Å; F805-I842 HydrophobicContact CE2-CD1 4.43Å; F805-I842 HydrophobicContact CE2-CG2 3.74Å; F805-I842 HydrophobicContact CZ-CD1 4.33Å; F805-I842 HydrophobicContact CZ-CG2 3.9Å; M814-I842 HydrophobicContact CE-CD1 4.25Å; M814-I842 HydrophobicContact SD-CD1 4.46Å; M818-I842 HydrophobicContact CE-CD1 3.89Å; I842-F865 HydrophobicContact CG2-CZ 3.98Å
843	W	95.2	Very high	92.7	Very high	30 Å²	30	25.7 Å²	25.7	11%	0.114	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	175.6	-172.6	-159.1	-112.9	0	0	0	113.8	T613 I796 S799 V801 F841 S845 L848	T613-W843 PolarHBondContact N-O 3.3Å; T613-W843 PolarHBondContact O-N 2.84Å; T613-W843 VanDerWaalsContact O-O 3.11Å; I796-W843 HydrophobicContact CB-CE3 4.35Å; I796-W843 HydrophobicContact CB-CH2 3.86Å; I796-W843 HydrophobicContact CB-CZ3 3.63Å; I796-W843 HydrophobicContact CD1-CD2 4.04Å; I796-W843 HydrophobicContact CD1-CE3 3.96Å; I796-W843 HydrophobicContact CD1-CH2 3.66Å; I796-W843 HydrophobicContact CD1-CZ2 3.73Å; I796-W843 HydrophobicContact CD1-CZ3 3.78Å; I796-W843 HydrophobicContact CG1-CE3 4.28Å; I796-W843 HydrophobicContact CG1-CH2 4.26Å; I796-W843 HydrophobicContact CG1-CZ3 4.01Å; I796-W843 HydrophobicContact CG2-CH2 4.48Å; S799-W843 VanDerWaalsContact CB-CH2 3.48Å; S799-W843 VanDerWaalsContact CB-CZ3 3.41Å; V801-W843 HydrophobicContact CB-CE3 4.24Å; V801-W843 HydrophobicContact CB-CZ3 4.14Å; V801-W843 HydrophobicContact CG2-CE3 3.88Å; V801-W843 HydrophobicContact CG2-CZ3 3.95Å; F841-W843 HydrophobicContact CD1-CB 4.08Å; F841-W843 HydrophobicContact CE1-CB 3.53Å; F841-W843 AromaticContact CE1-CG 3.83Å; F841-W843 HydrophobicContact CE1-CG 3.83Å; F841-W843 HydrophobicContact CE2-CB 4.36Å; F841-W843 HydrophobicContact CZ-CB 3.69Å; F841-W843 HydrophobicContact CZ-CD2 4.01Å; F841-W843 HydrophobicContact CZ-CE3 4.28Å; F841-W843 AromaticContact CZ-CG 3.73Å; F841-W843 HydrophobicContact CZ-CG 3.73Å; W843-S845 PolarHBondContact O-N 2.85Å; W843-L848 HydrophobicContact CB-CD1 3.9Å; W843-L848 HydrophobicContact CB-CD2 4.03Å; W843-L848 HydrophobicContact CB-CG 4.07Å
844	D	94.5	Very high	92.3	Very high	6 Å²	6	28.9 Å²	28.9	3%	0.032	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	123.6	179.8	-75.1	-18.4	0	0	0	112.7	L610 A846 R847 L848 Y870	L610-D844 HydrophobicContact CD1-CB 3.51Å; L610-D844 WeakPolarHBondContact CD1-OD1 3.31Å; D844-A846 VanDerWaalsContact C-N 3.27Å; D844-A846 PolarHBondContact O-N 2.91Å; D844-A846 VanDerWaalsContact O-N 3.15Å; D844-R847 WeakPolarHBondContact O-CB 3.03Å; D844-R847 PolarHBondContact O-N 3.05Å; D844-L848 PolarHBondContact O-N 3.47Å; D844-Y870 WeakPolarHBondContact CB-OH 3.48Å; D844-Y870 PolarHBondContact OD2-OH 2.94Å
845	S	94.2	Very high	92.1	Very high	11 Å²	11	29.1 Å²	29.1	8%	0.077	17%	0.166	C	C	.	.	H	α-helix	trans	-58.8	-32.3	-172	65.6	0	0	0	0	114.3	G611 W843 R847 L848 N849	G611-S845 PolarHBondContact N-OG 3.04Å; G611-S845 VanDerWaalsContact O-CB 3.28Å; G611-S845 WeakPolarHBondContact O-CB 3.5Å; G611-S845 PolarHBondContact O-N 2.89Å; G611-S845 PolarHBondContact O-OG 3.08Å; W843-S845 PolarHBondContact O-N 2.85Å; S845-R847 VanDerWaalsContact C-N 3.31Å; S845-R847 PolarHBondContact O-N 3.32Å; S845-L848 PolarHBondContact O-N 3.31Å; S845-N849 VanDerWaalsContact O-CB 3.23Å; S845-N849 WeakPolarHBondContact O-CB 3.37Å; S845-N849 PolarHBondContact O-N 2.84Å; S845-N849 PolarHBondContact O-ND2 2.94Å
846	A	92.7	Very high	91.7	Very high	3 Å²	3	26.9 Å²	26.9	3%	0.025	15%	0.15	C	C	.	.	H	α-helix	trans	-64	-34.1	177.6	0	0	0	0	0	113	F484 D844 Y870 I905	F484-A846 HydrophobicContact CZ-CB 3.86Å; D844-A846 VanDerWaalsContact C-N 3.27Å; D844-A846 PolarHBondContact O-N 2.91Å; D844-A846 VanDerWaalsContact O-N 3.15Å; A846-Y870 HydrophobicContact CB-CE2 4.45Å; A846-I905 HydrophobicContact CB-CD1 4.32Å
847	R	92.8	Very high	91.6	Very high	7 Å²	7	29.7 Å²	29.7	3%	0.026	16%	0.155	C	C	.	.	H	α-helix	trans	-74.7	-43.2	174.2	178	72.2	178.3	111.5	-4.3	110.9	V482 V826 E827 D844 S845 Y850 E851	V482-R847 WeakPolarHBondContact O-CD 3.16Å; V482-R847 VanDerWaalsContact O-CZ 3.28Å; V482-R847 PolarHBondContact O-NE 3.09Å; V482-R847 PolarHBondContact O-NH1 3.09Å; V826-R847 HydrophobicContact CG1-CG 4.01Å; E827-R847 IonicContact OE1-CZ 3.54Å; E827-R847 IonicContact OE1-NE 2.8Å; E827-R847 IonicContact OE1-NH2 2.73Å; E827-R847 PolarHBondContact OE1-NH2 3.46Å; D844-R847 WeakPolarHBondContact O-CB 3.03Å; D844-R847 PolarHBondContact O-N 3.05Å; S845-R847 VanDerWaalsContact C-N 3.31Å; S845-R847 PolarHBondContact O-N 3.32Å; R847-Y850 WeakPolarHBondContact O-CB 3.34Å; R847-Y850 PolarHBondContact O-N 3.19Å; R847-E851 IonicContact CZ-OE1 3.7Å; R847-E851 IonicContact NH1-OE1 3.67Å; R847-E851 PolarHBondContact NH1-OE1 3.43Å; R847-E851 IonicContact NH2-OE1 3.01Å; R847-E851 PolarHBondContact O-N 2.56Å
848	L	94.2	Very high	91.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-71.3	-39.5	-175.8	-60.1	-174.1	0	0	0	112.5	T613 L615 F841 W843 D844 S845 Y850 E851 V852 T860	T613-L848 HydrophobicContact CG2-CB 4.22Å; T613-L848 HydrophobicContact CG2-CD1 3.64Å; T613-L848 HydrophobicContact CG2-CG 4.45Å; T613-L848 WeakPolarHBondContact O-CD1 3.3Å; L615-L848 HydrophobicContact CB-CD1 3.89Å; L615-L848 HydrophobicContact CB-CD2 3.86Å; L615-L848 HydrophobicContact CB-CG 4.33Å; L615-L848 HydrophobicContact CD2-CD2 3.82Å; L615-L848 HydrophobicContact CG-CD2 4.31Å; F841-L848 HydrophobicContact CD1-CD2 3.91Å; F841-L848 HydrophobicContact CE1-CD2 3.95Å; W843-L848 HydrophobicContact CB-CD1 3.9Å; W843-L848 HydrophobicContact CB-CD2 4.03Å; W843-L848 HydrophobicContact CB-CG 4.07Å; D844-L848 PolarHBondContact O-N 3.47Å; S845-L848 PolarHBondContact O-N 3.31Å; L848-Y850 VanDerWaalsContact C-N 3.27Å; L848-Y850 PolarHBondContact O-N 2.99Å; L848-E851 PolarHBondContact O-N 3.48Å; L848-V852 WeakPolarHBondContact O-CG2 3.46Å; L848-V852 PolarHBondContact O-N 3.37Å; L848-T860 HydrophobicContact CB-CG2 4.05Å
849	N	92.2	Very high	91.4	Very high	48 Å²	48	27.2 Å²	27.2	26%	0.257	14%	0.138	S	C	.	.	H	α-helix	trans	-61.4	-34.9	175.6	-73.4	-13.8	0	0	0	112.4	S845 S853 I905	S845-N849 VanDerWaalsContact O-CB 3.23Å; S845-N849 WeakPolarHBondContact O-CB 3.37Å; S845-N849 PolarHBondContact O-N 2.84Å; S845-N849 PolarHBondContact O-ND2 2.94Å; N849-S853 WeakPolarHBondContact O-CB 3.1Å; N849-S853 PolarHBondContact O-N 3.02Å; N849-I905 HydrophobicContact CB-CG2 4.04Å
850	Y	92.9	Very high	91.3	Very high	26 Å²	26	24.8 Å²	24.8	10%	0.102	13%	0.131	C	C	.	.	H	α-helix	trans	-63.9	-49.5	173.1	169	-97.5	0	0	0	111.7	V482 P483 R847 L848 V852 S853 I854 W904 I907	V482-Y850 HydrophobicContact CG1-CD1 4.13Å; V482-Y850 HydrophobicContact CG1-CE1 3.3Å; P483-Y850 HydrophobicContact CB-CD1 4.28Å; P483-Y850 HydrophobicContact CB-CD2 3.61Å; P483-Y850 HydrophobicContact CB-CE1 4.32Å; P483-Y850 HydrophobicContact CB-CE2 3.62Å; P483-Y850 HydrophobicContact CB-CG 3.91Å; P483-Y850 HydrophobicContact CG-CD1 4.34Å; P483-Y850 HydrophobicContact CG-CD2 3.84Å; P483-Y850 HydrophobicContact CG-CE2 4.35Å; P483-Y850 HydrophobicContact CG-CG 3.78Å; R847-Y850 WeakPolarHBondContact O-CB 3.34Å; R847-Y850 PolarHBondContact O-N 3.19Å; L848-Y850 VanDerWaalsContact C-N 3.27Å; L848-Y850 PolarHBondContact O-N 2.99Å; Y850-V852 VanDerWaalsContact C-N 3.35Å; Y850-V852 PolarHBondContact O-N 3.49Å; Y850-S853 WeakPolarHBondContact O-CB 3.41Å; Y850-S853 PolarHBondContact O-N 3.49Å; Y850-S853 VanDerWaalsContact O-N 3.09Å; Y850-S853 PolarHBondContact O-OG 3.22Å; Y850-I854 HydrophobicContact CD1-CD1 4.35Å; Y850-I854 HydrophobicContact CD2-CD1 4.25Å; Y850-I854 HydrophobicContact CE1-CD1 3.66Å; Y850-I854 HydrophobicContact CE2-CD1 3.57Å; Y850-I854 HydrophobicContact CE2-CG1 4.49Å; Y850-I854 PolarHBondContact O-N 2.61Å; Y850-I854 WeakPolarHBondContact OH-CD1 3.44Å; Y850-W904 WeakPolarHBondContact CD2-O 3.46Å; Y850-I907 HydrophobicContact CD2-CD1 4.17Å; Y850-I907 HydrophobicContact CE2-CD1 3.7Å
851	E	92.3	Very high	91.1	Very high	19 Å²	19	24.9 Å²	24.9	9%	0.089	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-42	178.1	-68	-68.1	137.8	0	0	111.8	I830 K834 R847 L848 S853 I854 D855 L858	I830-E851 HydrophobicContact CD1-CG 3.74Å; K834-E851 IonicContact NZ-OE2 2.62Å; K834-E851 PolarHBondContact NZ-OE2 2.8Å; R847-E851 IonicContact CZ-OE1 3.7Å; R847-E851 IonicContact NH1-OE1 3.67Å; R847-E851 PolarHBondContact NH1-OE1 3.43Å; R847-E851 IonicContact NH2-OE1 3.01Å; R847-E851 PolarHBondContact O-N 2.56Å; L848-E851 PolarHBondContact O-N 3.48Å; E851-S853 VanDerWaalsContact C-N 3.28Å; E851-S853 PolarHBondContact O-N 2.88Å; E851-I854 PolarHBondContact O-N 3.17Å; E851-D855 PolarHBondContact O-N 3.31Å; E851-L858 HydrophobicContact CB-CD1 4.29Å
852	V	90.2	Very high	90.7	Very high	28 Å²	28	26.6 Å²	26.6	17%	0.17	15%	0.149	C	C	.	.	H	α-helix	trans	-65.9	-28.6	175.5	174.2	0	0	0	0	112.5	L615 L848 Y850 I854 L858 T860	L615-V852 HydrophobicContact CD1-CG2 3.52Å; L848-V852 WeakPolarHBondContact O-CG2 3.46Å; L848-V852 PolarHBondContact O-N 3.37Å; Y850-V852 VanDerWaalsContact C-N 3.35Å; Y850-V852 PolarHBondContact O-N 3.49Å; V852-I854 VanDerWaalsContact C-N 3.33Å; V852-L858 HydrophobicContact CG2-CB 4.02Å; V852-T860 HydrophobicContact CG2-CG2 4.22Å
853	S	86.6	Confident	90.4	Very high	19 Å²	19	34.1 Å²	34.1	13%	0.133	18%	0.184	C	C	.	.	H	α-helix	trans	-72.8	-24.9	176.1	81.7	0	0	0	0	113.7	N849 Y850 E851 I905 S909	N849-S853 WeakPolarHBondContact O-CB 3.1Å; N849-S853 PolarHBondContact O-N 3.02Å; Y850-S853 WeakPolarHBondContact O-CB 3.41Å; Y850-S853 PolarHBondContact O-N 3.49Å; Y850-S853 VanDerWaalsContact O-N 3.09Å; Y850-S853 PolarHBondContact O-OG 3.22Å; E851-S853 VanDerWaalsContact C-N 3.28Å; E851-S853 PolarHBondContact O-N 2.88Å; S853-I905 PolarHBondContact OG-O 2.82Å; S853-S909 VanDerWaalsContact O-CB 3.31Å; S853-S909 WeakPolarHBondContact O-CB 3.36Å
854	I	86.6	Confident	90.3	Very high	67 Å²	67	36.1 Å²	36.1	34%	0.344	20%	0.2	S	C	.	.	H	α-helix	trans	-92.9	-51.8	178.8	-67.1	-180	0	0	0	110.4	Y850 E851 V852	Y850-I854 HydrophobicContact CD1-CD1 4.35Å; Y850-I854 HydrophobicContact CD2-CD1 4.25Å; Y850-I854 HydrophobicContact CE1-CD1 3.66Å; Y850-I854 HydrophobicContact CE2-CD1 3.57Å; Y850-I854 HydrophobicContact CE2-CG1 4.49Å; Y850-I854 PolarHBondContact O-N 2.61Å; Y850-I854 WeakPolarHBondContact OH-CD1 3.44Å; E851-I854 PolarHBondContact O-N 3.17Å; V852-I854 VanDerWaalsContact C-N 3.33Å
855	D	87.6	Confident	90.1	Very high	57 Å²	57	37.1 Å²	37.1	31%	0.305	20%	0.204	S	C	.	.			trans	-105.1	96.7	-172.5	-75.2	-27.2	0	0	0	111.9	K834 E851 E857 L858	K834-D855 WeakPolarHBondContact CE-OD2 3.05Å; K834-D855 IonicContact NZ-OD2 3.31Å; K834-D855 PolarHBondContact NZ-OD2 3.29Å; E851-D855 PolarHBondContact O-N 3.31Å; D855-E857 PolarHBondContact O-N 3.31Å; D855-L858 HydrophobicContact CB-CD1 4.16Å; D855-L858 HydrophobicContact CB-CG 4.35Å; D855-L858 PolarHBondContact O-N 3Å
856	C	85	Confident	89.9	Confident	30 Å²	30	37.4 Å²	37.4	20%	0.203	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	3	179.3	-23.7	0	0	0	0	114.9	R618 R620 C912	R618-C856 PolarHBondContact NE-O 2.86Å; R620-C856 PolarHBondContact NH2-O 3.07Å; C856-C912 HydrophobicContact CB-CB 3.99Å; C856-C912 WeakPolarHBondContact CB-SG 3.17Å; C856-C912 WeakPolarHBondContact SG-CA 3.19Å; C856-C912 WeakPolarHBondContact SG-CB 3.23Å; C856-C912 CovalentContact SG-SG 2.04Å; C856-C912 PolarHBondContact SG-SG 2.91Å
857	E	86.7	Confident	89.8	Confident	93 Å²	93	45.9 Å²	45.9	44%	0.435	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-14.9	167.1	-67.8	-154	169.3	0	0	113.1	K617 R618 D855	K617-E857 WeakPolarHBondContact CE-OE2 3.38Å; K617-E857 IonicContact NZ-OE2 2.81Å; K617-E857 PolarHBondContact NZ-OE2 3.12Å; R618-E857 VanDerWaalsContact CB-O 3.24Å; R618-E857 WeakPolarHBondContact CB-O 3.31Å; R618-E857 PolarHBondContact N-O 2.86Å; D855-E857 PolarHBondContact O-N 3.31Å
858	L	89.7	Confident	89.7	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	160.4	-179.8	-60.1	176	0	0	0	111	L615 R618 I833 K834 E851 V852 D855	L615-L858 HydrophobicContact CD1-CB 3.96Å; L615-L858 HydrophobicContact CD1-CD1 4.39Å; L615-L858 HydrophobicContact CD2-CD1 4.09Å; R618-L858 PolarHBondContact NH2-O 3.03Å; I833-L858 HydrophobicContact CG2-CD2 3.82Å; K834-L858 HydrophobicContact CG-CD2 4.38Å; E851-L858 HydrophobicContact CB-CD1 4.29Å; V852-L858 HydrophobicContact CG2-CB 4.02Å; D855-L858 HydrophobicContact CB-CD1 4.16Å; D855-L858 HydrophobicContact CB-CG 4.35Å; D855-L858 PolarHBondContact O-N 3Å
859	I	89.4	Confident	89.8	Confident	34 Å²	34	48.4 Å²	48.4	17%	0.174	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	147.3	171.7	-167.6	166.2	0	0	0	109.7	V616 R618	V616-I859 HydrophobicContact CG2-CG2 3.56Å; V616-I859 PolarHBondContact N-O 2.81Å; V616-I859 PolarHBondContact O-N 2.82Å; R618-I859 HydrophobicContact CB-CG2 4.32Å
860	T	91.2	Very high	89.9	Confident	42 Å²	42	46.5 Å²	46.5	26%	0.258	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	132.8	169.1	44.6	0	0	0	0	109.9	T613 I614 L848 V852	T613-T860 HydrophobicContact CG2-CG2 3.81Å; I614-T860 CarbonylContact O-C 3.53Å; I614-T860 WeakPolarHBondContact O-CA 3.39Å; L848-T860 HydrophobicContact CB-CG2 4.05Å; V852-T860 HydrophobicContact CG2-CG2 4.22Å
861	A	89.3	Confident	90.1	Very high	2 Å²	2	45.2 Å²	45.2	2%	0.017	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	136.2	-178.8	0	0	0	0	0	111.7	I614 V616 A774 I776	I614-A861 HydrophobicContact CB-CB 4.45Å; I614-A861 PolarHBondContact O-N 3.12Å; V616-A861 HydrophobicContact CG1-CB 4.23Å; V616-A861 HydrophobicContact CG2-CB 4.07Å; A774-A861 HydrophobicContact CB-CB 4.27Å; I776-A861 HydrophobicContact CB-CB 4.34Å
862	G	86.3	Confident	90.2	Very high	35 Å²	35	44.3 Å²	44.3	36%	0.361	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75.2	175.1	-179.7	0	0	0	0	0	115.2	S777	S777-G862 WeakPolarHBondContact O-CA 3.45Å
863	E	89.5	Confident	90.5	Very high	159 Å²	159	43 Å²	43	74%	0.743	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71	161	171.5	-65.4	-176.7	-177.3	0	0	111.5	F865	E863-F865 PolarHBondContact O-N 3.21Å
864	V	91.5	Very high	90.8	Very high	72 Å²	72	42.1 Å²	42.1	44%	0.436	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	115.6	179.3	-164.5	0	0	0	0	109.2	G611 I612	G611-V864 VanDerWaalsContact CA-CG1 3.43Å; I612-V864 WeakPolarHBondContact O-CA 3.11Å; I612-V864 WeakPolarHBondContact O-CG1 3.19Å
865	F	92.2	Very high	91	Very high	27 Å²	27	43.9 Å²	43.9	12%	0.118	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	172.3	179.9	65.9	-84.9	0	0	0	110.8	I612 I614 I779 Y804 F805 I842 E863 R867	I612-F865 WeakPolarHBondContact CA-O 3.44Å; I612-F865 HydrophobicContact CB-CD2 4.16Å; I612-F865 HydrophobicContact CB-CE1 4.3Å; I612-F865 HydrophobicContact CB-CE2 3.82Å; I612-F865 HydrophobicContact CB-CZ 3.9Å; I612-F865 WeakPolarHBondContact CB-O 3.42Å; I612-F865 HydrophobicContact CD1-CE2 4.23Å; I612-F865 HydrophobicContact CG2-CE1 4.04Å; I612-F865 HydrophobicContact CG2-CE2 3.71Å; I612-F865 HydrophobicContact CG2-CZ 3.43Å; I612-F865 VanDerWaalsContact CG2-CZ 3.43Å; I612-F865 PolarHBondContact N-O 3.46Å; I612-F865 WeakPolarHBondContact O-CD1 3.45Å; I612-F865 PolarHBondContact O-N 3.47Å; I614-F865 HydrophobicContact CD1-CE1 4.44Å; I614-F865 HydrophobicContact CG1-CE1 4.16Å; I779-F865 HydrophobicContact CB-CD1 3.88Å; I779-F865 HydrophobicContact CB-CE1 3.8Å; I779-F865 HydrophobicContact CB-CE2 4.44Å; I779-F865 HydrophobicContact CB-CG 4.25Å; I779-F865 HydrophobicContact CB-CZ 4.09Å; I779-F865 HydrophobicContact CD1-CE1 4.15Å; I779-F865 HydrophobicContact CD1-CE2 4Å; I779-F865 HydrophobicContact CD1-CZ 3.63Å; I779-F865 HydrophobicContact CG1-CD1 4.4Å; I779-F865 HydrophobicContact CG1-CD2 4.24Å; I779-F865 HydrophobicContact CG1-CE1 4.11Å; I779-F865 HydrophobicContact CG1-CE2 3.93Å; I779-F865 HydrophobicContact CG1-CG 4.47Å; I779-F865 HydrophobicContact CG1-CZ 3.85Å; I779-F865 HydrophobicContact CG2-CB 4.47Å; I779-F865 HydrophobicContact CG2-CD1 4.1Å; I779-F865 HydrophobicContact CG2-CG 4.14Å; Y804-F865 HydrophobicContact CE1-CD2 4.25Å; Y804-F865 HydrophobicContact CE1-CE2 4.3Å; F805-F865 HydrophobicContact CE1-CE2 4.13Å; F805-F865 AromaticContact CZ-CE2 3.72Å; F805-F865 HydrophobicContact CZ-CE2 3.72Å; F805-F865 AromaticContact CZ-CZ 3.99Å; F805-F865 HydrophobicContact CZ-CZ 3.99Å; I842-F865 HydrophobicContact CG2-CZ 3.98Å; E863-F865 PolarHBondContact O-N 3.21Å; F865-R867 PolarHBondContact O-N 3Å
866	G	89.1	Confident	90.9	Very high	16 Å²	16	45 Å²	45	17%	0.165	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.5	57.3	178.9	0	0	0	0	0	112.6	N868	G866-N868 PolarHBondContact O-N 3.46Å
867	R	91	Very high	90.4	Very high	181 Å²	181	47.8 Å²	47.8	68%	0.683	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-53.8	132.8	-177.2	-67	-179.3	179.4	-179.9	-1.1	110.2	F865	F865-R867 PolarHBondContact O-N 3Å
868	N	91	Very high	90.3	Very high	37 Å²	37	44.3 Å²	44.3	20%	0.198	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	169	-179.2	-157.8	-28	0	0	0	109.2	I593 L610 G866	I593-N868 PolarHBondContact O-OD1 2.95Å; I593-N868 VanDerWaalsContact O-OD1 3.12Å; L610-N868 CarbonylContact C-O 3.52Å; L610-N868 WeakPolarHBondContact CG-O 3.38Å; L610-N868 PolarHBondContact N-O 2.82Å; L610-N868 PolarHBondContact O-N 3.4Å; G866-N868 PolarHBondContact O-N 3.46Å
869	S	94.9	Very high	89.8	Confident	24 Å²	24	46.2 Å²	46.2	17%	0.168	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	147.6	-177	-55.5	0	0	0	0	111.5	S592 I593 P606 K608 Y609	S592-S869 WeakPolarHBondContact CA-O 3.25Å; I593-S869 WeakPolarHBondContact CG1-O 3.24Å; I593-S869 PolarHBondContact N-O 2.93Å; P606-S869 VanDerWaalsContact CB-CB 3.49Å; K608-S869 CarbonylContact O-C 3.56Å; K608-S869 WeakPolarHBondContact O-CA 3.28Å; Y609-S869 WeakPolarHBondContact CD1-OG 3.5Å
870	Y	95.7	Very high	89.7	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.027	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	132.6	166	-59.4	-35.2	0	0	0	110.7	F484 P590 V591 P606 F607 K608 L610 D844 A846	F484-Y870 HydrophobicContact CE1-CD2 4.18Å; F484-Y870 HydrophobicContact CE1-CE2 4Å; F484-Y870 AromaticContact CE2-CE2 3.95Å; F484-Y870 HydrophobicContact CE2-CE2 3.95Å; F484-Y870 HydrophobicContact CZ-CD2 4.15Å; F484-Y870 AromaticContact CZ-CE2 3.51Å; F484-Y870 HydrophobicContact CZ-CE2 3.51Å; P590-Y870 HydrophobicContact CB-CD1 4.36Å; P590-Y870 HydrophobicContact CB-CD2 3.9Å; P590-Y870 HydrophobicContact CB-CE1 4.16Å; P590-Y870 HydrophobicContact CB-CE2 3.68Å; P590-Y870 HydrophobicContact CB-CG 4.24Å; V591-Y870 WeakPolarHBondContact O-CA 3.46Å; P606-Y870 CarbonylContact C-O 3.5Å; P606-Y870 VanDerWaalsContact CA-O 3.28Å; P606-Y870 WeakPolarHBondContact CA-O 3.37Å; P606-Y870 WeakPolarHBondContact CB-O 3.42Å; F607-Y870 WeakPolarHBondContact CD1-O 3.47Å; F607-Y870 HydrophobicContact CE2-CD2 4.44Å; F607-Y870 VanDerWaalsContact CZ-CB 3.46Å; F607-Y870 HydrophobicContact CZ-CD2 4.24Å; F607-Y870 HydrophobicContact CZ-CG 4.28Å; F607-Y870 PolarHBondContact N-O 2.94Å; K608-Y870 HydrophobicContact CB-CD2 4.17Å; K608-Y870 HydrophobicContact CG-CD2 4.4Å; K608-Y870 PolarHBondContact O-N 3.24Å; L610-Y870 HydrophobicContact CD1-CE1 3.94Å; L610-Y870 HydrophobicContact CD1-CE2 4.33Å; L610-Y870 HydrophobicContact CD2-CD1 3.7Å; L610-Y870 HydrophobicContact CD2-CD2 3.74Å; L610-Y870 HydrophobicContact CD2-CE1 3.78Å; L610-Y870 HydrophobicContact CD2-CE2 3.81Å; L610-Y870 HydrophobicContact CD2-CG 3.68Å; D844-Y870 WeakPolarHBondContact CB-OH 3.48Å; D844-Y870 PolarHBondContact OD2-OH 2.94Å; A846-Y870 HydrophobicContact CB-CE2 4.45Å
871	G	95.5	Very high	89.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.228	C	C	.	.			trans	-127.7	157.3	177.5	0	0	0	0	0	112.1	V591	V591-G871 PolarHBondContact O-N 2.94Å
872	L	95.8	Very high	89.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.258	C	S	.	.			trans	-78.7	139.3	170.8	-47.7	178.6	0	0	0	108.7	L532 L536 L586 V588 F603 T604 F607 V888	L532-L872 HydrophobicContact CD2-CD2 4.28Å; L536-L872 HydrophobicContact CD1-CD1 3.54Å; L586-L872 HydrophobicContact CD1-CB 4.19Å; V588-L872 HydrophobicContact CB-CD2 4.37Å; V588-L872 HydrophobicContact CG1-CD2 3.92Å; V588-L872 HydrophobicContact CG2-CD2 4.22Å; F603-L872 WeakPolarHBondContact CA-O 3.32Å; T604-L872 HydrophobicContact CG2-CB 3.83Å; T604-L872 HydrophobicContact CG2-CD1 4.26Å; T604-L872 HydrophobicContact CG2-CG 4.36Å; T604-L872 PolarHBondContact N-O 3.1Å; T604-L872 WeakPolarHBondContact OG1-CB 3.31Å; T604-L872 PolarHBondContact OG1-N 3.49Å; T604-L872 VanDerWaalsContact OG1-N 3.16Å; F607-L872 HydrophobicContact CD1-CD2 3.77Å; F607-L872 HydrophobicContact CD1-CG 4.31Å; F607-L872 HydrophobicContact CE1-CD2 4.01Å; L872-V888 HydrophobicContact CD1-CG2 4.16Å
873	V	96.1	Very high	89.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134	-171.9	-162.2	0	0	0	0	111.4	I576 L586 A587 V591 V601 F603	I576-V873 HydrophobicContact CD1-CG1 4.02Å; L586-V873 CarbonylContact C-O 3.47Å; L586-V873 WeakPolarHBondContact CA-O 3.39Å; A587-V873 HydrophobicContact CB-CB 3.84Å; A587-V873 HydrophobicContact CB-CG2 4.13Å; A587-V873 PolarHBondContact N-O 3.26Å; A587-V873 PolarHBondContact O-N 3Å; V591-V873 HydrophobicContact CB-CG2 3.86Å; V591-V873 HydrophobicContact CG1-CG2 3.87Å; V591-V873 HydrophobicContact CG2-CG2 3.92Å; V601-V873 HydrophobicContact CB-CG1 3.62Å; V601-V873 HydrophobicContact CG1-CG1 3.99Å; V601-V873 HydrophobicContact CG2-CG1 3.6Å; F603-V873 HydrophobicContact CD1-CG2 4.01Å; F603-V873 HydrophobicContact CE1-CG1 4.46Å; F603-V873 HydrophobicContact CE1-CG2 3.67Å
874	M	93.6	Very high	89.5	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	165.5	172.6	-75.8	172.1	-74.1	0	0	111.4	L586 V601 E602 T604 N878 W880 L881 L884	L586-M874 HydrophobicContact CD1-CE 4.46Å; L586-M874 HydrophobicContact CD1-CG 3.64Å; L586-M874 HydrophobicContact CD1-SD 4.05Å; V601-M874 WeakPolarHBondContact CB-O 3.42Å; E602-M874 PolarHBondContact N-O 3.31Å; E602-M874 PolarHBondContact O-N 3.11Å; T604-M874 HydrophobicContact CG2-CE 3.54Å; M874-N878 HydrophobicContact CB-CB 3.95Å; M874-N878 HydrophobicContact CG-CB 4.45Å; M874-N878 HydrophobicContact SD-CB 4.14Å; M874-W880 HydrophobicContact SD-CB 3.93Å; M874-L881 HydrophobicContact CE-CB 4.17Å; M874-L881 HydrophobicContact CE-CD1 3.75Å; M874-L884 HydrophobicContact CE-CD1 3.96Å; M874-L884 HydrophobicContact SD-CD1 3.78Å
875	K	90	Very high	89.6	Confident	103 Å²	103	42.7 Å²	42.7	45%	0.448	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	142.7	168.7	-173.4	167.1	-177.6	163.5	0	110.4	I579 N877 N878	I579-K875 HydrophobicContact CG2-CB 4.21Å; K875-N877 PolarHBondContact O-N 3.22Å; K875-N878 VanDerWaalsContact O-CB 3.27Å; K875-N878 WeakPolarHBondContact O-CB 3.44Å; K875-N878 PolarHBondContact O-N 3.34Å
876	K	84.6	Confident	89.5	Confident	82 Å²	82	44.6 Å²	44.6	36%	0.357	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	134.2	-178.9	-79.2	-170.1	169	-166.2	0	114.2	A598 A599 V601 E602	A598-K876 WeakPolarHBondContact O-CE 3.4Å; A598-K876 PolarHBondContact O-NZ 3.31Å; A599-K876 WeakPolarHBondContact O-CE 3.31Å; A599-K876 PolarHBondContact O-NZ 2.67Å; V601-K876 WeakPolarHBondContact O-CE 3.39Å; E602-K876 HydrophobicContact CB-CG 4.09Å; E602-K876 WeakPolarHBondContact OE2-CA 3.3Å
877	N	75.9	Confident	89.4	Confident	88 Å²	88	44 Å²	44	47%	0.471	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	28.3	-173.9	-48	47.8	0	0	0	113.9	K186 E602 K875	K186-N877 PolarHBondContact NZ-OD1 3.37Å; E602-N877 WeakPolarHBondContact OE2-CA 3.43Å; E602-N877 PolarHBondContact OE2-N 3.09Å; K875-N877 PolarHBondContact O-N 3.22Å
878	N	83.3	Confident	89.4	Confident	20 Å²	20	35.4 Å²	35.4	11%	0.107	17%	0.171	C	C	.	.			trans	-69	125.6	177.5	-174.3	-22.2	0	0	0	110.6	D585 M874 K875 W880 L881	D585-N878 PolarHBondContact O-ND2 2.78Å; M874-N878 HydrophobicContact CB-CB 3.95Å; M874-N878 HydrophobicContact CG-CB 4.45Å; M874-N878 HydrophobicContact SD-CB 4.14Å; K875-N878 VanDerWaalsContact O-CB 3.27Å; K875-N878 WeakPolarHBondContact O-CB 3.44Å; K875-N878 PolarHBondContact O-N 3.34Å; N878-W880 PolarHBondContact O-N 2.83Å; N878-W880 WeakPolarHBondContact OD1-CB 3.32Å; N878-W880 PolarHBondContact OD1-N 3.07Å; N878-L881 VanDerWaalsContact O-CB 3.27Å; N878-L881 WeakPolarHBondContact O-CB 3.41Å; N878-L881 PolarHBondContact O-N 2.89Å
879	P	81	Confident	89.5	Confident	41 Å²	41	36.5 Å²	36.5	27%	0.266	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-15.7	-179.8	24.4	-35.6	0	0	0	114.7	K470 L881	K470-P879 HydrophobicContact CG-CG 4.41Å; P879-L881 VanDerWaalsContact C-N 3.34Å
880	W	86.3	Confident	89.2	Confident	4 Å²	4	35.8 Å²	35.8	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-76.1	-15.9	173.4	-74.3	105.6	0	0	0	114.3	K470 K471 L474 T547 F549 M874 N878 Y882 E883 L884	K470-W880 HydrophobicContact CD-CZ2 4.3Å; K470-W880 VanDerWaalsContact CE-CZ2 3.44Å; K470-W880 HydrophobicContact CG-CZ2 4.39Å; K471-W880 WeakPolarHBondContact O-CZ2 3.48Å; K471-W880 PolarHBondContact O-NE1 3.27Å; L474-W880 HydrophobicContact CD1-CD2 4.44Å; L474-W880 HydrophobicContact CD1-CG 4.46Å; T547-W880 WeakPolarHBondContact O-CH2 3.25Å; T547-W880 WeakPolarHBondContact O-CZ3 3.45Å; T547-W880 WeakPolarHBondContact OG1-CH2 3.33Å; T547-W880 WeakPolarHBondContact OG1-CZ3 3.38Å; F549-W880 HydrophobicContact CB-CH2 3.73Å; F549-W880 HydrophobicContact CB-CZ2 3.78Å; F549-W880 AromaticContact CD1-CH2 3.98Å; F549-W880 HydrophobicContact CD1-CH2 3.98Å; F549-W880 HydrophobicContact CD1-CZ3 4.02Å; F549-W880 HydrophobicContact CG-CH2 4.29Å; F549-W880 HydrophobicContact CG-CZ2 4.49Å; M874-W880 HydrophobicContact SD-CB 3.93Å; N878-W880 PolarHBondContact O-N 2.83Å; N878-W880 WeakPolarHBondContact OD1-CB 3.32Å; N878-W880 PolarHBondContact OD1-N 3.07Å; W880-Y882 PolarHBondContact O-N 3.34Å; W880-E883 HydrophobicContact CE3-CB 4.5Å; W880-E883 VanDerWaalsContact CZ3-OE2 3.32Å; W880-E883 WeakPolarHBondContact CZ3-OE2 3.49Å; W880-E883 PolarHBondContact O-N 3.42Å; W880-L884 HydrophobicContact CB-CD1 4.02Å; W880-L884 HydrophobicContact CB-CG 4.39Å; W880-L884 WeakPolarHBondContact O-CB 3.36Å; W880-L884 WeakPolarHBondContact O-CG 3.25Å; W880-L884 PolarHBondContact O-N 2.87Å
881	L	88.8	Confident	88.9	Confident	37 Å²	37	36 Å²	36	19%	0.194	17%	0.172	C	C	.	.	H	α-helix	trans	-54.3	-51.3	-174.1	-179.9	75.8	0	0	0	113.4	E602 F603 T604 M874 N878 P879 S885	E602-L881 HydrophobicContact CB-CD1 4.47Å; E602-L881 HydrophobicContact CG-CD1 3.89Å; E602-L881 HydrophobicContact CG-CD2 3.76Å; E602-L881 HydrophobicContact CG-CG 4.43Å; E602-L881 WeakPolarHBondContact OE1-CD2 3.4Å; F603-L881 WeakPolarHBondContact O-CD1 3.44Å; T604-L881 HydrophobicContact CG2-CD1 4.44Å; M874-L881 HydrophobicContact CE-CB 4.17Å; M874-L881 HydrophobicContact CE-CD1 3.75Å; N878-L881 VanDerWaalsContact O-CB 3.27Å; N878-L881 WeakPolarHBondContact O-CB 3.41Å; N878-L881 PolarHBondContact O-N 2.89Å; P879-L881 VanDerWaalsContact C-N 3.34Å; L881-S885 WeakPolarHBondContact O-CB 3.5Å; L881-S885 PolarHBondContact O-N 3.2Å; L881-S885 PolarHBondContact O-OG 3.21Å
882	Y	87.1	Confident	88.7	Confident	166 Å²	166	39 Å²	39	65%	0.651	19%	0.186	S	C	*	.	H	α-helix	trans	-64.6	-47.5	-177.1	-179	-98.1	0	0	0	110.8	W880 S885 Q886	W880-Y882 PolarHBondContact O-N 3.34Å; Y882-S885 PolarHBondContact O-N 3.46Å; Y882-Q886 HydrophobicContact CD1-CG 4.25Å; Y882-Q886 HydrophobicContact CE1-CG 3.92Å; Y882-Q886 HydrophobicContact CE2-CG 4.21Å; Y882-Q886 WeakPolarHBondContact O-CB 3.45Å; Y882-Q886 VanDerWaalsContact O-CG 3.24Å; Y882-Q886 WeakPolarHBondContact O-CG 3.48Å; Y882-Q886 PolarHBondContact O-N 3.42Å
883	E	86.8	Confident	88.5	Confident	44 Å²	44	46.6 Å²	46.6	21%	0.206	22%	0.221	C	C	.	.	H	α-helix	trans	-63.7	-43.4	-179.5	-67.6	177.4	-151.2	0	0	112.6	K470 T547 W880 A887	K470-E883 IonicContact NZ-OE1 3.7Å; K470-E883 PolarHBondContact NZ-OE1 2.93Å; K470-E883 IonicContact NZ-OE2 2.79Å; K470-E883 PolarHBondContact NZ-OE2 2.64Å; T547-E883 PolarHBondContact OG1-OE2 2.77Å; W880-E883 HydrophobicContact CE3-CB 4.5Å; W880-E883 VanDerWaalsContact CZ3-OE2 3.32Å; W880-E883 WeakPolarHBondContact CZ3-OE2 3.49Å; W880-E883 PolarHBondContact O-N 3.42Å; E883-A887 WeakPolarHBondContact O-CB 3.44Å; E883-A887 PolarHBondContact O-N 2.92Å
884	L	89.9	Confident	88.2	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-69.9	-37.9	177.3	-69.1	175.3	0	0	0	111.9	L536 F549 L586 T604 M874 W880 A887 V888	L536-L884 HydrophobicContact CB-CD2 4.5Å; L536-L884 HydrophobicContact CD2-CD2 4.17Å; F549-L884 HydrophobicContact CE1-CD2 4.18Å; L586-L884 HydrophobicContact CD1-CD1 3.95Å; L586-L884 HydrophobicContact CD2-CD1 4.14Å; T604-L884 HydrophobicContact CG2-CB 3.9Å; M874-L884 HydrophobicContact CE-CD1 3.96Å; M874-L884 HydrophobicContact SD-CD1 3.78Å; W880-L884 HydrophobicContact CB-CD1 4.02Å; W880-L884 HydrophobicContact CB-CG 4.39Å; W880-L884 WeakPolarHBondContact O-CB 3.36Å; W880-L884 WeakPolarHBondContact O-CG 3.25Å; W880-L884 PolarHBondContact O-N 2.87Å; L884-A887 PolarHBondContact O-N 3.44Å; L884-V888 WeakPolarHBondContact O-CG2 3.47Å; L884-V888 PolarHBondContact O-N 3.15Å
885	S	92.3	Very high	88	Confident	15 Å²	15	53.3 Å²	53.3	11%	0.105	25%	0.252	C	S	.	.	H	α-helix	trans	-64.8	-42.6	175.2	-62.1	0	0	0	0	111.9	T604 K605 L881 Y882 A887 V888 L889	T604-S885 WeakPolarHBondContact CA-OG 3.27Å; K605-S885 PolarHBondContact N-OG 3Å; L881-S885 WeakPolarHBondContact O-CB 3.5Å; L881-S885 PolarHBondContact O-N 3.2Å; L881-S885 PolarHBondContact O-OG 3.21Å; Y882-S885 PolarHBondContact O-N 3.46Å; S885-A887 VanDerWaalsContact C-N 3.34Å; S885-V888 PolarHBondContact O-N 2.88Å; S885-L889 WeakPolarHBondContact O-CG 3.37Å; S885-L889 PolarHBondContact O-N 2.86Å
886	Q	90.1	Very high	88	Confident	67 Å²	67	49.9 Å²	49.9	31%	0.313	24%	0.239	S	C	.	.	H	α-helix	trans	-63.7	-38.7	173.5	-69.7	-63.6	-28.4	0	0	111.6	Y882 N890	Y882-Q886 HydrophobicContact CD1-CG 4.25Å; Y882-Q886 HydrophobicContact CE1-CG 3.92Å; Y882-Q886 HydrophobicContact CE2-CG 4.21Å; Y882-Q886 WeakPolarHBondContact O-CB 3.45Å; Y882-Q886 VanDerWaalsContact O-CG 3.24Å; Y882-Q886 WeakPolarHBondContact O-CG 3.48Å; Y882-Q886 PolarHBondContact O-N 3.42Å; Q886-N890 WeakPolarHBondContact O-CB 3.5Å; Q886-N890 PolarHBondContact O-N 2.86Å
887	A	88.3	Confident	88.3	Confident	5 Å²	5	46.3 Å²	46.3	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-44.8	174	0	0	0	0	0	112.4	L536 T545 E883 L884 S885 N890 F891	L536-A887 HydrophobicContact CD2-CB 3.82Å; T545-A887 HydrophobicContact CG2-CB 3.93Å; E883-A887 WeakPolarHBondContact O-CB 3.44Å; E883-A887 PolarHBondContact O-N 2.92Å; L884-A887 PolarHBondContact O-N 3.44Å; S885-A887 VanDerWaalsContact C-N 3.34Å; A887-N890 PolarHBondContact O-N 2.97Å; A887-F891 VanDerWaalsContact O-CD1 3.29Å; A887-F891 WeakPolarHBondContact O-CD1 3.44Å; A887-F891 VanDerWaalsContact O-CG 3.23Å; A887-F891 WeakPolarHBondContact O-CG 3.37Å; A887-F891 PolarHBondContact O-N 3.38Å
888	V	91.3	Very high	89.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.8	-42	178.1	171.8	0	0	0	0	112	L536 P606 F607 L872 L884 S885 F891 H892 M897	L536-V888 HydrophobicContact CD2-CG2 4.42Å; P606-V888 WeakPolarHBondContact O-CG1 3.37Å; F607-V888 HydrophobicContact CB-CG1 3.93Å; L872-V888 HydrophobicContact CD1-CG2 4.16Å; L884-V888 WeakPolarHBondContact O-CG2 3.47Å; L884-V888 PolarHBondContact O-N 3.15Å; S885-V888 PolarHBondContact O-N 2.88Å; V888-F891 PolarHBondContact O-N 3.17Å; V888-H892 PolarHBondContact O-N 2.98Å; V888-H892 PolarHBondContact O-ND1 2.98Å; V888-M897 HydrophobicContact CG1-CE 4.25Å
889	L	91.8	Very high	89.4	Confident	60 Å²	60	50.2 Å²	50.2	31%	0.314	24%	0.242	S	C	.	.	H	α-helix	trans	-60.3	-48.1	173.9	-70.3	173.7	0	0	0	111.3	K605 S885 F891 H892 E893	K605-L889 HydrophobicContact CB-CD2 4.18Å; K605-L889 HydrophobicContact CB-CG 4.24Å; K605-L889 HydrophobicContact CG-CD1 4.23Å; K605-L889 HydrophobicContact CG-CD2 4.27Å; K605-L889 HydrophobicContact CG-CG 4.23Å; S885-L889 WeakPolarHBondContact O-CG 3.37Å; S885-L889 PolarHBondContact O-N 2.86Å; L889-F891 PolarHBondContact O-N 3.35Å; L889-H892 WeakPolarHBondContact O-CA 3.28Å; L889-H892 WeakPolarHBondContact O-CB 3.34Å; L889-H892 PolarHBondContact O-N 2.91Å; L889-E893 PolarHBondContact O-N 3.33Å
890	N	89	Confident	89.9	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-64	-22.3	178.7	-164.8	17.8	0	0	0	113.2	Q886 A887 R894	Q886-N890 WeakPolarHBondContact O-CB 3.5Å; Q886-N890 PolarHBondContact O-N 2.86Å; A887-N890 PolarHBondContact O-N 2.97Å; N890-R894 PolarHBondContact ND2-NH1 2.9Å; N890-R894 PolarHBondContact O-N 3.38Å; N890-R894 PolarHBondContact OD1-NH1 3.34Å; N890-R894 PolarHBondContact OD1-NH2 2.95Å
891	F	90.1	Very high	90.1	Very high	11 Å²	11	49.2 Å²	49.2	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-78	-28.8	170.7	-68.9	-6.6	0	0	0	113.1	L532 L535 L536 L542 A887 V888 L889 G895 I896 M897	L532-F891 HydrophobicContact CD1-CD2 3.89Å; L532-F891 HydrophobicContact CD1-CE2 4.03Å; L535-F891 HydrophobicContact CB-CE2 3.91Å; L535-F891 HydrophobicContact CB-CZ 3.91Å; L536-F891 HydrophobicContact CD2-CD2 4.44Å; L536-F891 HydrophobicContact CD2-CE2 3.62Å; L536-F891 HydrophobicContact CD2-CZ 4.13Å; L536-F891 HydrophobicContact CG-CE2 3.96Å; L542-F891 HydrophobicContact CD2-CE1 4.31Å; A887-F891 VanDerWaalsContact O-CD1 3.29Å; A887-F891 WeakPolarHBondContact O-CD1 3.44Å; A887-F891 VanDerWaalsContact O-CG 3.23Å; A887-F891 WeakPolarHBondContact O-CG 3.37Å; A887-F891 PolarHBondContact O-N 3.38Å; V888-F891 PolarHBondContact O-N 3.17Å; L889-F891 PolarHBondContact O-N 3.35Å; F891-G895 PolarHBondContact O-N 2.87Å; F891-I896 HydrophobicContact CB-CB 4.2Å; F891-I896 HydrophobicContact CD1-CD1 3.83Å; F891-I896 HydrophobicContact CE1-CD1 4.33Å; F891-I896 HydrophobicContact CG-CD1 4.44Å; F891-I896 WeakPolarHBondContact O-CB 3.26Å; F891-I896 PolarHBondContact O-N 2.72Å; F891-M897 HydrophobicContact CB-CE 4.04Å; F891-M897 PolarHBondContact O-N 2.81Å
892	H	91.7	Very high	90.2	Very high	64 Å²	64	51 Å²	51	30%	0.296	25%	0.247	S	C	.	.	H	α-helix	trans	-71.8	-48.4	168.4	-68.6	84.1	0	0	0	110.7	P606 V888 L889 R894 G895	P606-H892 PolarHBondContact O-CE1 3.2Å; P606-H892 VanDerWaalsContact O-CE1 3.26Å; V888-H892 PolarHBondContact O-N 2.98Å; V888-H892 PolarHBondContact O-ND1 2.98Å; L889-H892 WeakPolarHBondContact O-CA 3.28Å; L889-H892 WeakPolarHBondContact O-CB 3.34Å; L889-H892 PolarHBondContact O-N 2.91Å; H892-R894 PolarHBondContact O-N 3.5Å; H892-R894 VanDerWaalsContact O-N 3.14Å; H892-G895 PolarHBondContact O-N 3.1Å
893	E	91.5	Very high	90.2	Very high	158 Å²	158	46.4 Å²	46.4	74%	0.738	23%	0.231	S	C	*	.	H	α-helix	trans	-56.4	-32.2	179.9	-69.8	176.7	178.2	0	0	113.4	L889	L889-E893 PolarHBondContact O-N 3.33Å
894	R	88.9	Confident	90.4	Very high	122 Å²	122	44.8 Å²	44.8	46%	0.46	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	1.3	175.2	-71.9	-155.7	-168	69.5	6.8	115.4	L542 N890 H892 I896	L542-R894 VanDerWaalsContact CD1-CZ 3.47Å; N890-R894 PolarHBondContact ND2-NH1 2.9Å; N890-R894 PolarHBondContact O-N 3.38Å; N890-R894 PolarHBondContact OD1-NH1 3.34Å; N890-R894 PolarHBondContact OD1-NH2 2.95Å; H892-R894 PolarHBondContact O-N 3.5Å; H892-R894 VanDerWaalsContact O-N 3.14Å; R894-I896 HydrophobicContact CB-CD1 4.21Å; R894-I896 HydrophobicContact CB-CG1 4.08Å; R894-I896 PolarHBondContact O-N 2.78Å
895	G	90.4	Very high	90.4	Very high	20 Å²	20	44.7 Å²	44.7	21%	0.206	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	13.2	-175.3	0	0	0	0	0	114.5	F891 H892 M897 E898 T899	F891-G895 PolarHBondContact O-N 2.87Å; H892-G895 PolarHBondContact O-N 3.1Å; G895-M897 PolarHBondContact O-N 3.2Å; G895-E898 WeakPolarHBondContact O-CB 3.44Å; G895-E898 PolarHBondContact O-N 2.98Å; G895-T899 WeakPolarHBondContact O-CG2 3.24Å; G895-T899 PolarHBondContact O-N 2.9Å
896	I	89.1	Confident	89.9	Confident	31 Å²	31	48.5 Å²	48.5	16%	0.159	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-39.6	178.1	-66.8	172.5	0	0	0	109.8	L535 F891 R894 E898 T899 L900	L535-I896 HydrophobicContact CD1-CG2 3.86Å; F891-I896 HydrophobicContact CB-CB 4.2Å; F891-I896 HydrophobicContact CD1-CD1 3.83Å; F891-I896 HydrophobicContact CE1-CD1 4.33Å; F891-I896 HydrophobicContact CG-CD1 4.44Å; F891-I896 WeakPolarHBondContact O-CB 3.26Å; F891-I896 PolarHBondContact O-N 2.72Å; R894-I896 HydrophobicContact CB-CD1 4.21Å; R894-I896 HydrophobicContact CB-CG1 4.08Å; R894-I896 PolarHBondContact O-N 2.78Å; I896-E898 PolarHBondContact O-N 3.25Å; I896-T899 PolarHBondContact O-N 3.42Å; I896-T899 VanDerWaalsContact O-N 3.12Å; I896-T899 PolarHBondContact O-OG1 3.12Å; I896-L900 PolarHBondContact O-N 2.64Å
897	M	91.2	Very high	89.4	Confident	8 Å²	8	48 Å²	48	4%	0.039	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-39.8	177.7	-144.3	65.7	77.3	0	0	112.6	Y528 L532 F607 V888 F891 G895 T899 L900 D901	Y528-M897 HydrophobicContact CE1-SD 4.39Å; Y528-M897 WeakPolarHBondContact OH-CG 3.28Å; Y528-M897 PolarHBondContact OH-SD 2.68Å; L532-M897 HydrophobicContact CD1-CE 4.32Å; L532-M897 HydrophobicContact CD1-SD 4.42Å; F607-M897 HydrophobicContact CB-CE 3.86Å; F607-M897 HydrophobicContact CB-SD 4.42Å; F607-M897 WeakPolarHBondContact O-CE 3.13Å; F607-M897 WeakPolarHBondContact O-CG 3.36Å; F607-M897 VanDerWaalsContact O-SD 3.35Å; V888-M897 HydrophobicContact CG1-CE 4.25Å; F891-M897 HydrophobicContact CB-CE 4.04Å; F891-M897 PolarHBondContact O-N 2.81Å; G895-M897 PolarHBondContact O-N 3.2Å; M897-T899 VanDerWaalsContact C-N 3.32Å; M897-T899 PolarHBondContact O-N 3.38Å; M897-L900 WeakPolarHBondContact O-CB 3.3Å; M897-L900 PolarHBondContact O-N 3.3Å; M897-L900 VanDerWaalsContact O-N 3.1Å; M897-L900 HydrophobicContact SD-CD1 4.02Å; M897-D901 PolarHBondContact O-N 2.78Å
898	E	91.3	Very high	88.4	Confident	134 Å²	134	56.9 Å²	56.9	63%	0.626	27%	0.274	S	S	*	.	H	α-helix	trans	-62.8	-38.6	172.6	-169.3	-169.5	165.9	0	0	111.4	G895 I896 L900 D901 T902	G895-E898 WeakPolarHBondContact O-CB 3.44Å; G895-E898 PolarHBondContact O-N 2.98Å; I896-E898 PolarHBondContact O-N 3.25Å; E898-L900 VanDerWaalsContact C-N 3.26Å; E898-L900 PolarHBondContact O-N 3.21Å; E898-D901 PolarHBondContact O-N 2.77Å; E898-T902 WeakPolarHBondContact O-CB 3.47Å; E898-T902 WeakPolarHBondContact O-CG2 3.39Å; E898-T902 PolarHBondContact O-N 2.67Å; E898-T902 PolarHBondContact O-OG1 2.64Å
899	T	90.7	Very high	87.1	Confident	55 Å²	55	58.6 Å²	58.6	34%	0.337	29%	0.287	S	S	.	.	H	α-helix	trans	-69.7	-19.7	174.8	76.4	0	0	0	0	114	G895 I896 M897 T902 K903	G895-T899 WeakPolarHBondContact O-CG2 3.24Å; G895-T899 PolarHBondContact O-N 2.9Å; I896-T899 PolarHBondContact O-N 3.42Å; I896-T899 VanDerWaalsContact O-N 3.12Å; I896-T899 PolarHBondContact O-OG1 3.12Å; M897-T899 VanDerWaalsContact C-N 3.32Å; M897-T899 PolarHBondContact O-N 3.38Å; T899-T902 WeakPolarHBondContact CA-OG1 3.46Å; T899-T902 PolarHBondContact O-OG1 3Å; T899-K903 WeakPolarHBondContact O-CD 3.46Å; T899-K903 WeakPolarHBondContact O-CE 3.45Å; T899-K903 WeakPolarHBondContact O-CG 3.42Å; T899-K903 PolarHBondContact O-NZ 3.26Å
900	L	91.1	Very high	85.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-81.1	-48.7	171.4	-75.2	167	0	0	0	110.3	F504 Y528 D531 L532 L535 I896 M897 E898 T902 K903 W904	F504-L900 HydrophobicContact CD1-CD2 3.75Å; F504-L900 HydrophobicContact CE1-CD2 3.6Å; F504-L900 HydrophobicContact CE1-CG 4.17Å; Y528-L900 HydrophobicContact CD2-CB 4.03Å; Y528-L900 HydrophobicContact CE1-CD1 4.49Å; Y528-L900 HydrophobicContact CE2-CB 3.55Å; D531-L900 HydrophobicContact CB-CD2 3.79Å; L532-L900 HydrophobicContact CD1-CD1 4.46Å; L535-L900 HydrophobicContact CD1-CD1 4.27Å; I896-L900 PolarHBondContact O-N 2.64Å; M897-L900 WeakPolarHBondContact O-CB 3.3Å; M897-L900 PolarHBondContact O-N 3.3Å; M897-L900 VanDerWaalsContact O-N 3.1Å; M897-L900 HydrophobicContact SD-CD1 4.02Å; E898-L900 VanDerWaalsContact C-N 3.26Å; E898-L900 PolarHBondContact O-N 3.21Å; L900-T902 VanDerWaalsContact C-N 3.31Å; L900-T902 PolarHBondContact O-N 2.9Å; L900-K903 PolarHBondContact O-N 3.32Å; L900-K903 VanDerWaalsContact O-N 3.08Å; L900-W904 PolarHBondContact O-N 3.44Å
901	D	91.2	Very high	84.5	Confident	25 Å²	25	69.7 Å²	69.7	13%	0.134	35%	0.346	C	S	.	.	H	α-helix	trans	-55.3	-45.1	177.4	-78.5	8.8	0	0	0	111.6	Y528 K608 M897 E898 K903 I905 H906	Y528-D901 WeakPolarHBondContact CE2-OD1 3.4Å; Y528-D901 PolarHBondContact OH-OD1 2.86Å; K608-D901 VanDerWaalsContact CD-OD1 3.28Å; K608-D901 WeakPolarHBondContact CD-OD1 3.37Å; K608-D901 VanDerWaalsContact CE-CG 3.49Å; K608-D901 VanDerWaalsContact CE-OD1 3.29Å; K608-D901 WeakPolarHBondContact CE-OD1 3.45Å; K608-D901 WeakPolarHBondContact CE-OD2 3.29Å; K608-D901 IonicContact NZ-OD1 3.58Å; K608-D901 IonicContact NZ-OD2 2.73Å; K608-D901 PolarHBondContact NZ-OD2 2.76Å; M897-D901 PolarHBondContact O-N 2.78Å; E898-D901 PolarHBondContact O-N 2.77Å; D901-K903 VanDerWaalsContact C-N 3.32Å; D901-K903 PolarHBondContact O-N 3.41Å; D901-I905 WeakPolarHBondContact O-CA 3.45Å; D901-I905 WeakPolarHBondContact O-CB 3.26Å; D901-I905 PolarHBondContact O-N 2.99Å; D901-H906 PolarHBondContact O-N 2.95Å
902	T	89.6	Confident	83.5	Confident	73 Å²	73	71 Å²	71	45%	0.448	36%	0.357	S	S	.	.	H	α-helix	trans	-69.6	-21.5	178.5	50.2	0	0	0	0	114.8	E898 T899 L900	E898-T902 WeakPolarHBondContact O-CB 3.47Å; E898-T902 WeakPolarHBondContact O-CG2 3.39Å; E898-T902 PolarHBondContact O-N 2.67Å; E898-T902 PolarHBondContact O-OG1 2.64Å; T899-T902 WeakPolarHBondContact CA-OG1 3.46Å; T899-T902 PolarHBondContact O-OG1 3Å; L900-T902 VanDerWaalsContact C-N 3.31Å; L900-T902 PolarHBondContact O-N 2.9Å
903	K	88.2	Confident	82	Confident	71 Å²	71	76.2 Å²	76.2	31%	0.309	38%	0.381	S	S	.	.	H	α-helix	trans	-93.8	-30.6	179.8	-74.1	174.1	-165.5	142.9	0	114	F504 T899 L900 D901	F504-K903 HydrophobicContact CB-CD 4.05Å; F504-K903 HydrophobicContact CD1-CD 3.91Å; F504-K903 HydrophobicContact CD2-CD 4.02Å; F504-K903 HydrophobicContact CE1-CD 4.4Å; F504-K903 HydrophobicContact CG-CD 3.7Å; T899-K903 WeakPolarHBondContact O-CD 3.46Å; T899-K903 WeakPolarHBondContact O-CE 3.45Å; T899-K903 WeakPolarHBondContact O-CG 3.42Å; T899-K903 PolarHBondContact O-NZ 3.26Å; L900-K903 PolarHBondContact O-N 3.32Å; L900-K903 VanDerWaalsContact O-N 3.08Å; D901-K903 VanDerWaalsContact C-N 3.32Å; D901-K903 PolarHBondContact O-N 3.41Å
904	W	90.5	Very high	80.3	Confident	10 Å²	10	79.5 Å²	79.5	4%	0.038	39%	0.387	C	S	.	.	H	α-helix	trans	-110.3	-35.1	-172.6	-73.9	112.8	0	0	0	114	K505 Y526 Y528 D531 Y850 L900	K505-W904 HydrophobicContact CB-CH2 4Å; K505-W904 HydrophobicContact CB-CZ2 4.06Å; K505-W904 HydrophobicContact CD-CH2 4.19Å; K505-W904 HydrophobicContact CG-CH2 3.68Å; K505-W904 HydrophobicContact CG-CZ2 3.62Å; K505-W904 HydrophobicContact CG-CZ3 4.45Å; Y526-W904 AromaticContact CD2-CH2 3.82Å; Y526-W904 HydrophobicContact CD2-CH2 3.82Å; Y526-W904 HydrophobicContact CD2-CZ3 4.13Å; Y528-W904 HydrophobicContact CD2-CB 3.92Å; Y528-W904 HydrophobicContact CD2-CG 4.26Å; D531-W904 WeakPolarHBondContact OD2-CZ2 3.48Å; D531-W904 PolarHBondContact OD2-NE1 2.96Å; Y850-W904 WeakPolarHBondContact CD2-O 3.46Å; L900-W904 PolarHBondContact O-N 3.44Å
905	I	89.4	Confident	78.7	Confident	1 Å²	1	78.2 Å²	78.2	1%	0.005	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-56.2	-175	-56.7	172.5	0	0	0	110.5	P483 Y528 K608 A846 N849 S853 D901 I907	P483-I905 HydrophobicContact CG-CG1 4.36Å; Y528-I905 HydrophobicContact CE2-CD1 4.24Å; K608-I905 HydrophobicContact CD-CD1 4.4Å; A846-I905 HydrophobicContact CB-CD1 4.32Å; N849-I905 HydrophobicContact CB-CG2 4.04Å; S853-I905 PolarHBondContact OG-O 2.82Å; D901-I905 WeakPolarHBondContact O-CA 3.45Å; D901-I905 WeakPolarHBondContact O-CB 3.26Å; D901-I905 PolarHBondContact O-N 2.99Å; I905-I907 PolarHBondContact O-N 3.15Å
906	H	83.3	Confident	77	Confident	95 Å²	95	85.3 Å²	85.3	44%	0.44	42%	0.42	S	S	.	.	S	Bend	trans	-88.1	57.5	-176.8	-60.8	-64.4	0	0	0	112.2	D901 K908	D901-H906 PolarHBondContact O-N 2.95Å; H906-K908 PolarHBondContact O-N 2.91Å; H906-K908 VanDerWaalsContact O-N 3.12Å
907	I	78.3	Confident	75.3	Confident	56 Å²	56	89 Å²	89	29%	0.287	45%	0.449	S	S	.	.			trans	-64.7	114.6	178.3	-59.1	-179.7	0	0	0	108.7	Y850 I905 S909	Y850-I907 HydrophobicContact CD2-CD1 4.17Å; Y850-I907 HydrophobicContact CE2-CD1 3.7Å; I905-I907 PolarHBondContact O-N 3.15Å; I907-S909 PolarHBondContact O-N 3.49Å
908	K	68.6	Low	73.4	Confident	191 Å²	191	92.2 Å²	92.2	83%	0.83	47%	0.472	S	S	*	.			trans	-73.6	77	171	-67.2	179.4	-177.7	173.6	0	109.4	H906 N910	H906-K908 PolarHBondContact O-N 2.91Å; H906-K908 VanDerWaalsContact O-N 3.12Å; K908-N910 PolarHBondContact O-N 3.33Å
909	S	64.1	Low	71.7	Confident	37 Å²	37	91.2 Å²	91.2	26%	0.259	48%	0.477	S	S	.	.			trans	-63.5	117.1	167.3	-177.4	0	0	0	0	108.5	S853 I907 N911 C912	S853-S909 VanDerWaalsContact O-CB 3.31Å; S853-S909 WeakPolarHBondContact O-CB 3.36Å; I907-S909 PolarHBondContact O-N 3.49Å; S909-N911 PolarHBondContact O-N 3.24Å; S909-C912 PolarHBondContact O-N 3.03Å
910	N	61.3	Low	70.2	Confident	159 Å²	159	91.3 Å²	91.3	85%	0.85	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-14.2	178.1	-72.1	-14	0	0	0	112.9	K908	K908-N910 PolarHBondContact O-N 3.33Å
911	N	64.6	Low	68.8	Low	143 Å²	143	96.9 Å²	96.9	77%	0.765	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-20.8	-176.4	-61	-5.3	0	0	0	113.2	S909 E913	S909-N911 PolarHBondContact O-N 3.24Å; N911-E913 PolarHBondContact O-N 3.31Å
912	C	68.9	Low	67.6	Low	39 Å²	39	99.7 Å²	99.7	26%	0.264	53%	0.532	S	S	.	.	S	Bend	trans	-93.5	79.9	176	-57.2	0	0	0	0	110.1	C856 S909 R914	C856-C912 HydrophobicContact CB-CB 3.99Å; C856-C912 WeakPolarHBondContact CB-SG 3.17Å; C856-C912 WeakPolarHBondContact SG-CA 3.19Å; C856-C912 WeakPolarHBondContact SG-CB 3.23Å; C856-C912 CovalentContact SG-SG 2.04Å; C856-C912 PolarHBondContact SG-SG 2.91Å; S909-C912 PolarHBondContact O-N 3.03Å; C912-R914 PolarHBondContact O-N 3.37Å
913	E	60.2	Low	66.7	Low	173 Å²	173	97.6 Å²	97.6	81%	0.808	53%	0.525	S	S	*	.			trans	-58	124.9	173.1	-155	170.8	-147.1	0	0	109.3	N911 T915	N911-E913 PolarHBondContact O-N 3.31Å; E913-T915 VanDerWaalsContact C-N 3.31Å; E913-T915 PolarHBondContact O-N 3.44Å; E913-T915 PolarHBondContact O-OG1 2.78Å
914	R	55.7	Low	66.2	Low	227 Å²	227	100.9 Å²	100.9	86%	0.857	55%	0.545	S	S	*	.			trans	-68	83.7	-173.2	-86.8	-179.8	160.3	177.8	-9.9	111.2	C912 E916	C912-R914 PolarHBondContact O-N 3.37Å; R914-E916 VanDerWaalsContact C-N 3.26Å; R914-E916 PolarHBondContact O-N 3.16Å
915	T	54.3	Low	65.4	Low	95 Å²	95	105.1 Å²	105.1	58%	0.583	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-69.7	-11.1	-174.5	1.8	0	0	0	0	115.8	E913 S917	E913-T915 VanDerWaalsContact C-N 3.31Å; E913-T915 PolarHBondContact O-N 3.44Å; E913-T915 PolarHBondContact O-OG1 2.78Å; T915-S917 VanDerWaalsContact C-N 3.28Å; T915-S917 PolarHBondContact O-N 3.38Å
916	E	54.4	Low	64.6	Low	168 Å²	168	107.3 Å²	107.3	79%	0.785	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-73.1	-11.4	-164.9	-64.4	-178.9	171	0	0	115.3	R914	R914-E916 VanDerWaalsContact C-N 3.26Å; R914-E916 PolarHBondContact O-N 3.16Å
917	S	53.6	Low	64.5	Low	109 Å²	109	105.9 Å²	105.9	76%	0.762	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-117.3	1.3	-176.1	58.6	0	0	0	0	115.2	T915	T915-S917 VanDerWaalsContact C-N 3.28Å; T915-S917 PolarHBondContact O-N 3.38Å
918	S	53.1	Low	64.8	Low	75 Å²	75	104.6 Å²	104.6	52%	0.524	58%	0.576	S	S	.	*	S	Bend	trans	-105.1	127.3	178.5	-66.8	0	0	0	0	111.3
919	P	55.6	Low	65.6	Low	114 Å²	114	95.9 Å²	95.9	74%	0.74	54%	0.54	S	S	*	.			trans	-59.7	145.7	168.3	28.1	-34	0	0	0	109.2	T921	P919-T921 PolarHBondContact O-N 3.22Å
920	A	58.8	Low	66.7	Low	57 Å²	57	96.1 Å²	96.1	47%	0.471	54%	0.54	S	S	.	.			trans	-46.9	103.6	-170.8	0	0	0	0	0	111.9	L922	A920-L922 PolarHBondContact O-N 3.13Å
921	T	61.1	Low	68	Low	116 Å²	116	93.9 Å²	93.9	71%	0.712	52%	0.523	S	S	*	.			trans	-69.2	122.2	-177.5	48.9	0	0	0	0	108	P919 G923	P919-T921 PolarHBondContact O-N 3.22Å; T921-G923 VanDerWaalsContact C-N 3.27Å; T921-G923 PolarHBondContact O-N 2.82Å
922	L	67	Low	69.2	Low	85 Å²	85	91.8 Å²	91.8	45%	0.445	51%	0.511	S	S	.	.			trans	-70.6	86.1	179.9	-82.8	165.1	0	0	0	109.8	L767 A920 N926 M927	L767-L922 HydrophobicContact CD1-CD1 3.87Å; L767-L922 HydrophobicContact CD2-CD1 4.04Å; L767-L922 HydrophobicContact CD2-CD2 3.87Å; L767-L922 HydrophobicContact CD2-CG 4.07Å; A920-L922 PolarHBondContact O-N 3.13Å; L922-N926 HydrophobicContact CD2-CB 3.82Å; L922-M927 HydrophobicContact CB-CE 4.26Å; L922-M927 HydrophobicContact CD1-CE 3.73Å; L922-M927 HydrophobicContact CD2-CE 3.95Å; L922-M927 HydrophobicContact CG-CE 4.2Å
923	G	69.8	Low	70.1	Confident	28 Å²	28	95.8 Å²	95.8	29%	0.289	53%	0.527	S	S	.	.			trans	-62.3	162	177.5	0	0	0	0	0	112.7	T921 T925 N926 M927	T921-G923 VanDerWaalsContact C-N 3.27Å; T921-G923 PolarHBondContact O-N 2.82Å; G923-T925 PolarHBondContact O-N 3.01Å; G923-T925 VanDerWaalsContact O-N 3.12Å; G923-N926 WeakPolarHBondContact O-CB 3.44Å; G923-N926 PolarHBondContact O-N 2.85Å; G923-M927 PolarHBondContact O-N 2.62Å
924	L	77	Confident	71.7	Confident	140 Å²	140	91.9 Å²	91.9	73%	0.733	51%	0.511	S	S	*	.	H	α-helix	trans	-55.1	-33.3	179.4	-165.5	77.5	0	0	0	112.4	M927 A928 F931	L924-M927 CarbonylContact O-C 3.54Å; L924-M927 PolarHBondContact O-N 3.19Å; L924-A928 PolarHBondContact O-N 3.02Å; L924-F931 HydrophobicContact CD1-CE2 3.8Å; L924-F931 HydrophobicContact CD1-CZ 4.48Å
925	T	74.3	Confident	73.5	Confident	100 Å²	100	83 Å²	83	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-63.1	-40.3	175.1	47.3	0	0	0	0	112.9	G923 M927 A928	G923-T925 PolarHBondContact O-N 3.01Å; G923-T925 VanDerWaalsContact O-N 3.12Å; T925-M927 VanDerWaalsContact C-N 3.28Å; T925-M927 PolarHBondContact O-N 2.77Å; T925-A928 VanDerWaalsContact O-CB 3.24Å; T925-A928 WeakPolarHBondContact O-CB 3.24Å; T925-A928 PolarHBondContact O-N 2.88Å
926	N	73.1	Confident	75.4	Confident	46 Å²	46	84.4 Å²	84.4	25%	0.246	49%	0.491	C	S	.	.	H	α-helix	trans	-67.8	-33.6	179.2	-58.6	-3.7	0	0	0	110.7	S623 L922 G923	S623-N926 WeakPolarHBondContact CB-OD1 3.46Å; S623-N926 PolarHBondContact OG-OD1 3.44Å; L922-N926 HydrophobicContact CD2-CB 3.82Å; G923-N926 WeakPolarHBondContact O-CB 3.44Å; G923-N926 PolarHBondContact O-N 2.85Å
927	M	80.7	Confident	77.2	Confident	66 Å²	66	78.5 Å²	78.5	33%	0.325	48%	0.475	S	S	.	.	H	α-helix	trans	-87.1	-5.1	176.2	-70.2	-66.7	158.1	0	0	114.1	L922 G923 L924 T925 G929 V930 F931	L922-M927 HydrophobicContact CB-CE 4.26Å; L922-M927 HydrophobicContact CD1-CE 3.73Å; L922-M927 HydrophobicContact CD2-CE 3.95Å; L922-M927 HydrophobicContact CG-CE 4.2Å; G923-M927 PolarHBondContact O-N 2.62Å; L924-M927 CarbonylContact O-C 3.54Å; L924-M927 PolarHBondContact O-N 3.19Å; T925-M927 VanDerWaalsContact C-N 3.28Å; T925-M927 PolarHBondContact O-N 2.77Å; M927-G929 VanDerWaalsContact C-N 3.27Å; M927-G929 PolarHBondContact O-N 2.83Å; M927-V930 WeakPolarHBondContact O-CB 3.34Å; M927-V930 PolarHBondContact O-N 3.46Å; M927-V930 HydrophobicContact SD-CG2 4.24Å; M927-F931 HydrophobicContact CB-CD2 4.06Å; M927-F931 HydrophobicContact CB-CE2 3.52Å; M927-F931 HydrophobicContact CB-CZ 4.1Å; M927-F931 VanDerWaalsContact O-CD2 3.26Å; M927-F931 WeakPolarHBondContact O-CD2 3.35Å; M927-F931 PolarHBondContact O-N 2.85Å
928	A	84	Confident	79.2	Confident	28 Å²	28	79.1 Å²	79.1	23%	0.231	47%	0.47	C	S	.	.	H	α-helix	trans	-58.4	-37.2	-176.3	0	0	0	0	0	112.8	L625 L924 T925 V930 F931 I932	L625-A928 HydrophobicContact CD2-CB 3.8Å; L924-A928 PolarHBondContact O-N 3.02Å; T925-A928 VanDerWaalsContact O-CB 3.24Å; T925-A928 WeakPolarHBondContact O-CB 3.24Å; T925-A928 PolarHBondContact O-N 2.88Å; A928-V930 VanDerWaalsContact C-N 3.33Å; A928-V930 PolarHBondContact O-N 3.32Å; A928-F931 PolarHBondContact O-N 3.39Å; A928-I932 WeakPolarHBondContact O-CB 3.25Å; A928-I932 WeakPolarHBondContact O-CD1 3.24Å; A928-I932 WeakPolarHBondContact O-CG1 3.38Å; A928-I932 PolarHBondContact O-N 3.11Å
929	G	85.6	Confident	81.2	Confident	8 Å²	8	77.9 Å²	77.9	8%	0.082	46%	0.464	C	S	.	.	H	α-helix	trans	-60.3	-40	174.8	0	0	0	0	0	113.2	M927 M933	M927-G929 VanDerWaalsContact C-N 3.27Å; M927-G929 PolarHBondContact O-N 2.83Å; G929-M933 WeakPolarHBondContact O-CB 3.43Å; G929-M933 VanDerWaalsContact O-CG 3.31Å; G929-M933 WeakPolarHBondContact O-CG 3.25Å; G929-M933 PolarHBondContact O-N 2.96Å
930	V	87	Confident	83	Confident	43 Å²	43	74.7 Å²	74.7	26%	0.261	45%	0.447	S	S	.	.	H	α-helix	trans	-68.5	-44.3	176.9	-176.6	0	0	0	0	110.6	F628 M927 A928 I932 M933 I934	F628-V930 HydrophobicContact CB-CG2 4.17Å; F628-V930 HydrophobicContact CD1-CG2 3.8Å; F628-V930 HydrophobicContact CD2-CG2 4.16Å; F628-V930 HydrophobicContact CE1-CG2 4.21Å; F628-V930 HydrophobicContact CG-CG2 3.78Å; M927-V930 WeakPolarHBondContact O-CB 3.34Å; M927-V930 PolarHBondContact O-N 3.46Å; M927-V930 HydrophobicContact SD-CG2 4.24Å; A928-V930 VanDerWaalsContact C-N 3.33Å; A928-V930 PolarHBondContact O-N 3.32Å; V930-I932 PolarHBondContact O-N 3.09Å; V930-M933 PolarHBondContact O-N 3.42Å; V930-I934 HydrophobicContact CG1-CD1 3.98Å; V930-I934 WeakPolarHBondContact O-CG1 3.49Å; V930-I934 PolarHBondContact O-N 3.35Å
931	F	89.2	Confident	84.7	Confident	112 Å²	112	73.5 Å²	73.5	49%	0.491	44%	0.44	S	S	.	.	H	α-helix	trans	-63.9	-39.5	176.9	-63.5	-51.1	0	0	0	112.9	L924 M927 A928 I934 G935	L924-F931 HydrophobicContact CD1-CE2 3.8Å; L924-F931 HydrophobicContact CD1-CZ 4.48Å; M927-F931 HydrophobicContact CB-CD2 4.06Å; M927-F931 HydrophobicContact CB-CE2 3.52Å; M927-F931 HydrophobicContact CB-CZ 4.1Å; M927-F931 VanDerWaalsContact O-CD2 3.26Å; M927-F931 WeakPolarHBondContact O-CD2 3.35Å; M927-F931 PolarHBondContact O-N 2.85Å; A928-F931 PolarHBondContact O-N 3.39Å; F931-I934 PolarHBondContact O-N 3.38Å; F931-G935 PolarHBondContact O-N 3.21Å
932	I	89.9	Confident	86.3	Confident	99 Å²	99	70.7 Å²	70.7	51%	0.508	43%	0.429	S	S	.	.	H	α-helix	trans	-62.2	-45.2	173.9	-69.6	163.1	0	0	0	110.3	A928 V930 I934 G935 M936	A928-I932 WeakPolarHBondContact O-CB 3.25Å; A928-I932 WeakPolarHBondContact O-CD1 3.24Å; A928-I932 WeakPolarHBondContact O-CG1 3.38Å; A928-I932 PolarHBondContact O-N 3.11Å; V930-I932 PolarHBondContact O-N 3.09Å; I932-I934 PolarHBondContact O-N 2.95Å; I932-G935 PolarHBondContact O-N 2.91Å; I932-M936 HydrophobicContact CG2-CG 4.47Å; I932-M936 WeakPolarHBondContact O-CB 3.31Å; I932-M936 VanDerWaalsContact O-CG 3.31Å; I932-M936 WeakPolarHBondContact O-CG 3.34Å; I932-M936 PolarHBondContact O-N 3.46Å
933	M	88.6	Confident	87.5	Confident	122 Å²	122	71.8 Å²	71.8	60%	0.601	43%	0.434	S	S	*	.	H	α-helix	trans	-61.3	-43.1	176.6	-76.4	-66.4	-68.7	0	0	112.7	F628 G929 V930 M936 G937	F628-M933 HydrophobicContact CZ-CG 4.15Å; G929-M933 WeakPolarHBondContact O-CB 3.43Å; G929-M933 VanDerWaalsContact O-CG 3.31Å; G929-M933 WeakPolarHBondContact O-CG 3.25Å; G929-M933 PolarHBondContact O-N 2.96Å; V930-M933 PolarHBondContact O-N 3.42Å; M933-M936 PolarHBondContact O-N 3.01Å; M933-G937 PolarHBondContact O-N 2.96Å
934	I	92.6	Very high	88.7	Confident	91 Å²	91	75.7 Å²	75.7	47%	0.467	45%	0.448	S	S	.	.	H	α-helix	trans	-64	-44.7	175.6	-68	167	0	0	0	110.7	V930 F931 I932 M936 G937 L938	V930-I934 HydrophobicContact CG1-CD1 3.98Å; V930-I934 WeakPolarHBondContact O-CG1 3.49Å; V930-I934 PolarHBondContact O-N 3.35Å; F931-I934 PolarHBondContact O-N 3.38Å; I932-I934 PolarHBondContact O-N 2.95Å; I934-M936 VanDerWaalsContact C-N 3.35Å; I934-M936 PolarHBondContact O-N 3.46Å; I934-G937 PolarHBondContact O-N 3.28Å; I934-L938 HydrophobicContact CG2-CD1 3.94Å; I934-L938 HydrophobicContact CG2-CG 4.36Å; I934-L938 WeakPolarHBondContact O-CB 3.28Å; I934-L938 WeakPolarHBondContact O-CG 3.31Å; I934-L938 PolarHBondContact O-N 3.35Å
935	G	93.5	Very high	89.4	Confident	40 Å²	40	72.6 Å²	72.6	41%	0.412	44%	0.435	S	S	.	.	H	α-helix	trans	-59.5	-43.5	176.6	0	0	0	0	0	112.7	F931 I932 A939	F931-G935 PolarHBondContact O-N 3.21Å; I932-G935 PolarHBondContact O-N 2.91Å; G935-A939 WeakPolarHBondContact O-CB 3.43Å; G935-A939 PolarHBondContact O-N 3.01Å
936	M	93.9	Very high	90.2	Very high	125 Å²	125	74.2 Å²	74.2	62%	0.616	43%	0.433	S	S	*	.	H	α-helix	trans	-64.5	-41.9	174.3	-72.3	-63.9	-67.1	0	0	112.3	I932 M933 I934 A939 A940	I932-M936 HydrophobicContact CG2-CG 4.47Å; I932-M936 WeakPolarHBondContact O-CB 3.31Å; I932-M936 VanDerWaalsContact O-CG 3.31Å; I932-M936 WeakPolarHBondContact O-CG 3.34Å; I932-M936 PolarHBondContact O-N 3.46Å; M933-M936 PolarHBondContact O-N 3.01Å; I934-M936 VanDerWaalsContact C-N 3.35Å; I934-M936 PolarHBondContact O-N 3.46Å; M936-A939 PolarHBondContact O-N 3.17Å; M936-A940 WeakPolarHBondContact O-CB 3.47Å; M936-A940 PolarHBondContact O-N 3.46Å
937	G	93.7	Very high	91.1	Very high	44 Å²	44	75.4 Å²	75.4	45%	0.454	44%	0.442	S	S	.	.	H	α-helix	trans	-62.9	-44.7	176.3	0	0	0	0	0	112.9	M933 I934 A940 G941	M933-G937 PolarHBondContact O-N 2.96Å; I934-G937 PolarHBondContact O-N 3.28Å; G937-A940 PolarHBondContact O-N 3.1Å; G937-G941 PolarHBondContact O-N 3.34Å
938	L	95.4	Very high	91.7	Very high	123 Å²	123	78.3 Å²	78.3	64%	0.644	46%	0.455	S	S	*	.	H	α-helix	trans	-63.8	-41.5	175.1	-71.5	171.7	0	0	0	111.9	I934 G941 A942	I934-L938 HydrophobicContact CG2-CD1 3.94Å; I934-L938 HydrophobicContact CG2-CG 4.36Å; I934-L938 WeakPolarHBondContact O-CB 3.28Å; I934-L938 WeakPolarHBondContact O-CG 3.31Å; I934-L938 PolarHBondContact O-N 3.35Å; L938-G941 PolarHBondContact O-N 3.33Å; L938-A942 WeakPolarHBondContact O-CB 3.49Å; L938-A942 PolarHBondContact O-N 3.49Å
939	A	94.1	Very high	92	Very high	48 Å²	48	81.6 Å²	81.6	40%	0.397	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-45.2	175.6	0	0	0	0	0	111.9	G935 M936 A942 I943	G935-A939 WeakPolarHBondContact O-CB 3.43Å; G935-A939 PolarHBondContact O-N 3.01Å; M936-A939 PolarHBondContact O-N 3.17Å; A939-A942 PolarHBondContact O-N 3.33Å; A939-I943 WeakPolarHBondContact O-CD1 3.4Å; A939-I943 VanDerWaalsContact O-CG1 3.28Å; A939-I943 WeakPolarHBondContact O-CG1 3.32Å; A939-I943 PolarHBondContact O-N 2.8Å
940	A	94.5	Very high	92.2	Very high	48 Å²	48	84.3 Å²	84.3	40%	0.397	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-44	175.3	0	0	0	0	0	111.9	M936 G937 I943 L944	M936-A940 WeakPolarHBondContact O-CB 3.47Å; M936-A940 PolarHBondContact O-N 3.46Å; G937-A940 PolarHBondContact O-N 3.1Å; A940-I943 PolarHBondContact O-N 2.96Å; A940-L944 WeakPolarHBondContact O-CB 3.49Å; A940-L944 WeakPolarHBondContact O-CG 3.39Å; A940-L944 PolarHBondContact O-N 3.25Å
941	G	94.3	Very high	92.3	Very high	31 Å²	31	84.9 Å²	84.9	32%	0.32	49%	0.49	S	S	.	.	H	α-helix	trans	-62.5	-41	175.1	0	0	0	0	0	113.2	G937 L938 I943 L944 T945	G937-G941 PolarHBondContact O-N 3.34Å; L938-G941 PolarHBondContact O-N 3.33Å; G941-I943 VanDerWaalsContact C-N 3.34Å; G941-I943 PolarHBondContact O-N 3.13Å; G941-L944 PolarHBondContact O-N 3.03Å; G941-T945 WeakPolarHBondContact O-CB 3.47Å; G941-T945 WeakPolarHBondContact O-CG2 3.33Å; G941-T945 PolarHBondContact O-N 3.22Å; G941-T945 PolarHBondContact O-OG1 2.73Å
942	A	93.7	Very high	92.2	Very high	57 Å²	57	82.3 Å²	82.3	47%	0.471	49%	0.489	S	S	.	.	H	α-helix	trans	-64.4	-37.5	174.3	0	0	0	0	0	112.3	L938 A939 T945 F946	L938-A942 WeakPolarHBondContact O-CB 3.49Å; L938-A942 PolarHBondContact O-N 3.49Å; A939-A942 PolarHBondContact O-N 3.33Å; A942-T945 WeakPolarHBondContact CA-OG1 3.37Å; A942-T945 PolarHBondContact O-OG1 3.38Å; A942-F946 WeakPolarHBondContact O-CB 3.49Å; A942-F946 PolarHBondContact O-N 2.94Å
943	I	93.5	Very high	92.1	Very high	109 Å²	109	83.5 Å²	83.5	56%	0.559	49%	0.49	S	S	*	.	H	α-helix	trans	-68.5	-46.5	174.9	-68.6	163.4	0	0	0	110.7	A939 A940 G941 F946 V947	A939-I943 WeakPolarHBondContact O-CD1 3.4Å; A939-I943 VanDerWaalsContact O-CG1 3.28Å; A939-I943 WeakPolarHBondContact O-CG1 3.32Å; A939-I943 PolarHBondContact O-N 2.8Å; A940-I943 PolarHBondContact O-N 2.96Å; G941-I943 VanDerWaalsContact C-N 3.34Å; G941-I943 PolarHBondContact O-N 3.13Å; I943-F946 PolarHBondContact O-N 2.93Å; I943-V947 HydrophobicContact CG2-CG2 4.47Å; I943-V947 WeakPolarHBondContact O-CB 3.37Å; I943-V947 VanDerWaalsContact O-CG2 3.3Å; I943-V947 WeakPolarHBondContact O-CG2 3.31Å; I943-V947 PolarHBondContact O-N 3.16Å
944	L	93.3	Very high	91.9	Very high	109 Å²	109	85.4 Å²	85.4	57%	0.571	49%	0.491	S	S	*	.	H	α-helix	trans	-61.7	-51	178.9	-74.4	170.9	0	0	0	111.5	A940 G941 F946 V947 E948	A940-L944 WeakPolarHBondContact O-CB 3.49Å; A940-L944 WeakPolarHBondContact O-CG 3.39Å; A940-L944 PolarHBondContact O-N 3.25Å; G941-L944 PolarHBondContact O-N 3.03Å; L944-F946 VanDerWaalsContact C-N 3.3Å; L944-F946 PolarHBondContact O-N 3.23Å; L944-V947 CarbonylContact O-C 3.53Å; L944-V947 PolarHBondContact O-N 3Å; L944-V947 VanDerWaalsContact O-N 3.11Å; L944-E948 WeakPolarHBondContact O-CB 3.49Å; L944-E948 WeakPolarHBondContact O-CG 3.37Å; L944-E948 PolarHBondContact O-N 3.35Å
945	T	91.9	Very high	91.4	Very high	75 Å²	75	89.4 Å²	89.4	46%	0.46	50%	0.5	S	S	.	.	H	α-helix	trans	-61.5	-36.2	176.6	51.7	0	0	0	0	112.4	G941 A942 E948 V949	G941-T945 WeakPolarHBondContact O-CB 3.47Å; G941-T945 WeakPolarHBondContact O-CG2 3.33Å; G941-T945 PolarHBondContact O-N 3.22Å; G941-T945 PolarHBondContact O-OG1 2.73Å; A942-T945 WeakPolarHBondContact CA-OG1 3.37Å; A942-T945 PolarHBondContact O-OG1 3.38Å; T945-E948 PolarHBondContact O-N 2.78Å; T945-V949 WeakPolarHBondContact O-CB 3.22Å; T945-V949 VanDerWaalsContact O-CG2 3.26Å; T945-V949 WeakPolarHBondContact O-CG2 3.39Å; T945-V949 PolarHBondContact O-N 2.57Å
946	F	92.4	Very high	90.7	Very high	134 Å²	134	90.1 Å²	90.1	59%	0.588	50%	0.498	S	S	*	.	H	α-helix	trans	-65.7	-42.2	172.9	-177.5	-106.5	0	0	0	112.3	A942 I943 L944 V949 L950	A942-F946 WeakPolarHBondContact O-CB 3.49Å; A942-F946 PolarHBondContact O-N 2.94Å; I943-F946 PolarHBondContact O-N 2.93Å; L944-F946 VanDerWaalsContact C-N 3.3Å; L944-F946 PolarHBondContact O-N 3.23Å; F946-V949 PolarHBondContact O-N 2.91Å; F946-L950 HydrophobicContact CD1-CD1 3.8Å; F946-L950 HydrophobicContact CD1-CG 4.49Å; F946-L950 HydrophobicContact CE1-CD1 3.41Å; F946-L950 VanDerWaalsContact CE1-CD1 3.41Å; F946-L950 HydrophobicContact CE1-CG 4.25Å; F946-L950 HydrophobicContact CZ-CD1 3.83Å; F946-L950 HydrophobicContact CZ-CG 4.3Å; F946-L950 WeakPolarHBondContact O-CB 3.4Å; F946-L950 VanDerWaalsContact O-CG 3.28Å; F946-L950 WeakPolarHBondContact O-CG 3.39Å; F946-L950 PolarHBondContact O-N 2.85Å
947	V	92.1	Very high	90	Very high	72 Å²	72	88.5 Å²	88.5	44%	0.436	49%	0.489	S	S	.	.	H	α-helix	trans	-64.7	-41.1	174.2	168.6	0	0	0	0	111.2	I943 L944 L950 C951	I943-V947 HydrophobicContact CG2-CG2 4.47Å; I943-V947 WeakPolarHBondContact O-CB 3.37Å; I943-V947 VanDerWaalsContact O-CG2 3.3Å; I943-V947 WeakPolarHBondContact O-CG2 3.31Å; I943-V947 PolarHBondContact O-N 3.16Å; L944-V947 CarbonylContact O-C 3.53Å; L944-V947 PolarHBondContact O-N 3Å; L944-V947 VanDerWaalsContact O-N 3.11Å; V947-L950 PolarHBondContact O-N 3.4Å; V947-C951 VanDerWaalsContact O-CB 3.27Å; V947-C951 WeakPolarHBondContact O-CB 3.38Å; V947-C951 PolarHBondContact O-N 2.94Å; V947-C951 PolarHBondContact O-SG 2.84Å
948	E	92.1	Very high	89.3	Confident	127 Å²	127	92.7 Å²	92.7	59%	0.593	50%	0.497	S	S	*	.	H	α-helix	trans	-64.2	-47.1	175.1	-75.8	179.2	167.5	0	0	111.7	L944 T945 L950 C951 A952	L944-E948 WeakPolarHBondContact O-CB 3.49Å; L944-E948 WeakPolarHBondContact O-CG 3.37Å; L944-E948 PolarHBondContact O-N 3.35Å; T945-E948 PolarHBondContact O-N 2.78Å; E948-L950 VanDerWaalsContact C-N 3.31Å; E948-L950 PolarHBondContact O-N 2.8Å; E948-C951 CarbonylContact O-C 3.52Å; E948-C951 PolarHBondContact O-N 2.69Å; E948-A952 WeakPolarHBondContact O-CB 3.49Å; E948-A952 PolarHBondContact O-N 2.85Å
949	V	90.2	Very high	88.3	Confident	97 Å²	97	93.4 Å²	93.4	59%	0.588	50%	0.495	S	S	*	.	H	α-helix	trans	-62.3	-38.5	175.5	168.5	0	0	0	0	111	T945 F946 K953	T945-V949 WeakPolarHBondContact O-CB 3.22Å; T945-V949 VanDerWaalsContact O-CG2 3.26Å; T945-V949 WeakPolarHBondContact O-CG2 3.39Å; T945-V949 PolarHBondContact O-N 2.57Å; F946-V949 PolarHBondContact O-N 2.91Å; V949-K953 WeakPolarHBondContact O-CB 3.24Å; V949-K953 PolarHBondContact O-N 2.97Å
950	L	90.1	Very high	87.3	Confident	65 Å²	65	97.6 Å²	97.6	34%	0.34	50%	0.504	S	S	.	.	H	α-helix	trans	-65.7	-43.6	172.9	-76.9	176.1	0	0	0	112.3	F946 V947 E948 R954	F946-L950 HydrophobicContact CD1-CD1 3.8Å; F946-L950 HydrophobicContact CD1-CG 4.49Å; F946-L950 HydrophobicContact CE1-CD1 3.41Å; F946-L950 VanDerWaalsContact CE1-CD1 3.41Å; F946-L950 HydrophobicContact CE1-CG 4.25Å; F946-L950 HydrophobicContact CZ-CD1 3.83Å; F946-L950 HydrophobicContact CZ-CG 4.3Å; F946-L950 WeakPolarHBondContact O-CB 3.4Å; F946-L950 VanDerWaalsContact O-CG 3.28Å; F946-L950 WeakPolarHBondContact O-CG 3.39Å; F946-L950 PolarHBondContact O-N 2.85Å; V947-L950 PolarHBondContact O-N 3.4Å; E948-L950 VanDerWaalsContact C-N 3.31Å; E948-L950 PolarHBondContact O-N 2.8Å; L950-R954 WeakPolarHBondContact O-CB 2.98Å; L950-R954 VanDerWaalsContact O-CG 3.25Å; L950-R954 WeakPolarHBondContact O-CG 3.3Å; L950-R954 PolarHBondContact O-N 3.32Å
951	C	89.7	Confident	86.2	Confident	55 Å²	55	102.5 Å²	102.5	37%	0.372	52%	0.516	S	S	.	.	H	α-helix	trans	-67.1	-42.5	177.4	-78.6	0	0	0	0	111.9	V947 E948 R954 R955	V947-C951 VanDerWaalsContact O-CB 3.27Å; V947-C951 WeakPolarHBondContact O-CB 3.38Å; V947-C951 PolarHBondContact O-N 2.94Å; V947-C951 PolarHBondContact O-SG 2.84Å; E948-C951 CarbonylContact O-C 3.52Å; E948-C951 PolarHBondContact O-N 2.69Å; C951-R954 PolarHBondContact O-N 2.94Å; C951-R955 VanDerWaalsContact O-CB 3.28Å; C951-R955 WeakPolarHBondContact O-CB 3.29Å; C951-R955 VanDerWaalsContact O-CG 3.25Å; C951-R955 WeakPolarHBondContact O-CG 3.47Å; C951-R955 PolarHBondContact O-N 3.32Å
952	A	86.8	Confident	85.2	Confident	57 Å²	57	107 Å²	107	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-65.9	-41.9	175.3	0	0	0	0	0	111.1	E948 R955 C956	E948-A952 WeakPolarHBondContact O-CB 3.49Å; E948-A952 PolarHBondContact O-N 2.85Å; A952-R955 PolarHBondContact O-N 3.46Å; A952-C956 WeakPolarHBondContact O-CB 3.49Å; A952-C956 PolarHBondContact O-N 3.47Å
953	K	86.8	Confident	84.2	Confident	124 Å²	124	109.6 Å²	109.6	54%	0.539	53%	0.531	S	S	.	.	H	α-helix	trans	-63.4	-46.2	173.1	-176	174	177.1	179.3	0	111.5	V949 C956 E957	V949-K953 WeakPolarHBondContact O-CB 3.24Å; V949-K953 PolarHBondContact O-N 2.97Å; K953-C956 PolarHBondContact O-N 3.11Å; K953-E957 WeakPolarHBondContact CE-OE1 3.35Å; K953-E957 WeakPolarHBondContact O-CB 3.39Å; K953-E957 WeakPolarHBondContact O-CG 3.42Å; K953-E957 PolarHBondContact O-N 3.45Å
954	R	85.7	Confident	83.1	Confident	162 Å²	162	110.3 Å²	110.3	61%	0.611	54%	0.536	S	S	*	.	H	α-helix	trans	-60.5	-45.4	174.4	-76.1	173.6	179	-178.8	1.3	112	L950 C951 E957 Q958	L950-R954 WeakPolarHBondContact O-CB 2.98Å; L950-R954 VanDerWaalsContact O-CG 3.25Å; L950-R954 WeakPolarHBondContact O-CG 3.3Å; L950-R954 PolarHBondContact O-N 3.32Å; C951-R954 PolarHBondContact O-N 2.94Å; R954-E957 PolarHBondContact O-N 2.92Å; R954-Q958 WeakPolarHBondContact O-CB 3.26Å; R954-Q958 VanDerWaalsContact O-CG 3.28Å; R954-Q958 WeakPolarHBondContact O-CG 3.43Å; R954-Q958 PolarHBondContact O-N 2.78Å
955	R	82.5	Confident	82	Confident	175 Å²	175	108.1 Å²	108.1	66%	0.66	53%	0.529	S	S	*	.	H	α-helix	trans	-64.9	-37.7	175.9	-75.5	175.6	178.8	179.9	0.8	111.9	C951 A952 Q958 K959	C951-R955 VanDerWaalsContact O-CB 3.28Å; C951-R955 WeakPolarHBondContact O-CB 3.29Å; C951-R955 VanDerWaalsContact O-CG 3.25Å; C951-R955 WeakPolarHBondContact O-CG 3.47Å; C951-R955 PolarHBondContact O-N 3.32Å; A952-R955 PolarHBondContact O-N 3.46Å; R955-Q958 PolarHBondContact O-N 2.95Å; R955-K959 WeakPolarHBondContact O-CB 3.36Å; R955-K959 WeakPolarHBondContact O-CG 3.19Å; R955-K959 PolarHBondContact O-N 3.02Å
956	C	78.9	Confident	81.1	Confident	56 Å²	56	107.5 Å²	107.5	38%	0.378	53%	0.525	S	S	.	.	H	α-helix	trans	-70.8	-40	175.9	-174.5	0	0	0	0	111.7	A952 K953 Q958 K959 K960	A952-C956 WeakPolarHBondContact O-CB 3.49Å; A952-C956 PolarHBondContact O-N 3.47Å; K953-C956 PolarHBondContact O-N 3.11Å; C956-Q958 VanDerWaalsContact C-N 3.34Å; C956-K959 PolarHBondContact O-N 2.73Å; C956-K960 WeakPolarHBondContact O-CB 3.23Å; C956-K960 WeakPolarHBondContact O-CG 3.39Å; C956-K960 PolarHBondContact O-N 3.07Å
957	E	78.5	Confident	80.3	Confident	91 Å²	91	103.5 Å²	103.5	43%	0.425	52%	0.517	S	S	.	.	H	α-helix	trans	-65	-37.3	172.1	-75.1	175.6	-166	0	0	111.7	K953 R954 K961	K953-E957 WeakPolarHBondContact CE-OE1 3.35Å; K953-E957 WeakPolarHBondContact O-CB 3.39Å; K953-E957 WeakPolarHBondContact O-CG 3.42Å; K953-E957 PolarHBondContact O-N 3.45Å; R954-E957 PolarHBondContact O-N 2.92Å; E957-K961 WeakPolarHBondContact O-CB 3.32Å; E957-K961 WeakPolarHBondContact O-CG 3.44Å; E957-K961 PolarHBondContact O-N 3.32Å
958	Q	78	Confident	79.4	Confident	131 Å²	131	103.9 Å²	103.9	61%	0.612	52%	0.52	S	S	*	.	H	α-helix	trans	-66.8	-47.4	171.7	-75.8	173.2	-9.7	0	0	111.9	R954 R955 C956 K961 H962	R954-Q958 WeakPolarHBondContact O-CB 3.26Å; R954-Q958 VanDerWaalsContact O-CG 3.28Å; R954-Q958 WeakPolarHBondContact O-CG 3.43Å; R954-Q958 PolarHBondContact O-N 2.78Å; R955-Q958 PolarHBondContact O-N 2.95Å; C956-Q958 VanDerWaalsContact C-N 3.34Å; Q958-K961 PolarHBondContact O-N 2.95Å; Q958-H962 WeakPolarHBondContact O-CB 3.3Å; Q958-H962 PolarHBondContact O-N 3.45Å
959	K	74.7	Confident	78.5	Confident	139 Å²	139	103.8 Å²	103.8	60%	0.604	52%	0.521	S	S	*	.	H	α-helix	trans	-58.6	-48.1	175	-78.8	-173	176.2	-169.2	0	111.4	R955 C956 K961 H962 E963	R955-K959 WeakPolarHBondContact O-CB 3.36Å; R955-K959 WeakPolarHBondContact O-CG 3.19Å; R955-K959 PolarHBondContact O-N 3.02Å; C956-K959 PolarHBondContact O-N 2.73Å; K959-K961 PolarHBondContact O-N 3.17Å; K959-H962 CarbonylContact O-C 3.55Å; K959-H962 WeakPolarHBondContact O-CA 3.24Å; K959-H962 WeakPolarHBondContact O-CB 3.38Å; K959-H962 PolarHBondContact O-N 3.16Å; K959-H962 VanDerWaalsContact O-N 3.07Å; K959-E963 WeakPolarHBondContact O-CB 3.49Å; K959-E963 WeakPolarHBondContact O-CG 3.48Å; K959-E963 PolarHBondContact O-N 3.45Å
960	K	73.6	Confident	77.6	Confident	136 Å²	136	105 Å²	105	59%	0.591	52%	0.52	S	S	*	.	H	α-helix	trans	-61.2	-38.9	175.9	-76.4	-179.8	176.1	179.7	0	113.2	C956 H962 L964	C956-K960 WeakPolarHBondContact O-CB 3.23Å; C956-K960 WeakPolarHBondContact O-CG 3.39Å; C956-K960 PolarHBondContact O-N 3.07Å; K960-H962 VanDerWaalsContact C-N 3.35Å; K960-L964 VanDerWaalsContact O-CB 3.28Å; K960-L964 WeakPolarHBondContact O-CB 3.46Å; K960-L964 PolarHBondContact O-N 3.22Å
961	K	72.1	Confident	77	Confident	150 Å²	150	108.5 Å²	108.5	65%	0.652	54%	0.535	S	S	*	.	H	α-helix	trans	-64.6	-40.3	172.7	-76.8	171.2	-178.1	177.6	0	111.5	E957 Q958 K959 S965	E957-K961 WeakPolarHBondContact O-CB 3.32Å; E957-K961 WeakPolarHBondContact O-CG 3.44Å; E957-K961 PolarHBondContact O-N 3.32Å; Q958-K961 PolarHBondContact O-N 2.95Å; K959-K961 PolarHBondContact O-N 3.17Å; K961-S965 PolarHBondContact O-N 3.34Å; K961-S965 VanDerWaalsContact O-N 3.13Å
962	H	72.9	Confident	76.3	Confident	126 Å²	126	114.7 Å²	114.7	58%	0.583	55%	0.55	S	S	*	*	H	α-helix	trans	-66.8	-48.6	177.1	-158.9	-73	0	0	0	111.5	Q958 K959 K960 L964 S965 T966	Q958-H962 WeakPolarHBondContact O-CB 3.3Å; Q958-H962 PolarHBondContact O-N 3.45Å; K959-H962 CarbonylContact O-C 3.55Å; K959-H962 WeakPolarHBondContact O-CA 3.24Å; K959-H962 WeakPolarHBondContact O-CB 3.38Å; K959-H962 PolarHBondContact O-N 3.16Å; K959-H962 VanDerWaalsContact O-N 3.07Å; K960-H962 VanDerWaalsContact C-N 3.35Å; H962-L964 PolarHBondContact O-N 3.4Å; H962-S965 WeakPolarHBondContact O-CB 3.27Å; H962-S965 PolarHBondContact O-N 3.44Å; H962-S965 VanDerWaalsContact O-N 3.1Å; H962-S965 PolarHBondContact O-OG 3.28Å; H962-T966 PolarHBondContact O-N 2.76Å; H962-T966 PolarHBondContact O-OG1 2.85Å
963	E	71.6	Confident	75.8	Confident	111 Å²	111	118.9 Å²	118.9	52%	0.519	55%	0.554	S	S	.	*	H	α-helix	trans	-59.9	-41.7	177.2	-73.9	162.5	-164.6	0	0	112.3	K959 S965 T966 A967	K959-E963 WeakPolarHBondContact O-CB 3.49Å; K959-E963 WeakPolarHBondContact O-CG 3.48Å; K959-E963 PolarHBondContact O-N 3.45Å; E963-S965 VanDerWaalsContact C-N 3.32Å; E963-S965 PolarHBondContact O-N 2.71Å; E963-T966 WeakPolarHBondContact CA-OG1 3.44Å; E963-T966 PolarHBondContact O-N 2.8Å; E963-T966 PolarHBondContact O-OG1 3.11Å; E963-A967 WeakPolarHBondContact O-CB 3.34Å; E963-A967 PolarHBondContact O-N 3.4Å
964	L	70.8	Confident	75.2	Confident	125 Å²	125	118 Å²	118	65%	0.654	56%	0.555	S	S	*	*	H	α-helix	trans	-65.1	-36.2	175	-163.6	76.6	0	0	0	111.7	K960 H962 T968	K960-L964 VanDerWaalsContact O-CB 3.28Å; K960-L964 WeakPolarHBondContact O-CB 3.46Å; K960-L964 PolarHBondContact O-N 3.22Å; H962-L964 PolarHBondContact O-N 3.4Å; L964-T968 WeakPolarHBondContact O-CG2 3.4Å; L964-T968 PolarHBondContact O-N 3.11Å; L964-T968 VanDerWaalsContact O-N 3.15Å; L964-T968 PolarHBondContact O-OG1 3.34Å
965	S	70.4	Confident	74.7	Confident	62 Å²	62	113.5 Å²	113.5	43%	0.434	55%	0.546	S	S	.	.	H	α-helix	trans	-70	-36.6	175.1	78	0	0	0	0	112.7	K961 H962 E963 T968 M969	K961-S965 PolarHBondContact O-N 3.34Å; K961-S965 VanDerWaalsContact O-N 3.13Å; H962-S965 WeakPolarHBondContact O-CB 3.27Å; H962-S965 PolarHBondContact O-N 3.44Å; H962-S965 VanDerWaalsContact O-N 3.1Å; H962-S965 PolarHBondContact O-OG 3.28Å; E963-S965 VanDerWaalsContact C-N 3.32Å; E963-S965 PolarHBondContact O-N 2.71Å; S965-T968 PolarHBondContact O-OG1 3.21Å; S965-T968 VanDerWaalsContact O-OG1 3.09Å; S965-M969 WeakPolarHBondContact O-CB 3.43Å; S965-M969 PolarHBondContact O-N 3.5Å; S965-M969 VanDerWaalsContact O-N 3.16Å
966	T	73.5	Confident	74.3	Confident	62 Å²	62	107.9 Å²	107.9	38%	0.38	53%	0.531	S	S	.	.	H	α-helix	trans	-73.2	-38.9	176.4	49.1	0	0	0	0	112.2	H962 E963 M969 Q970	H962-T966 PolarHBondContact O-N 2.76Å; H962-T966 PolarHBondContact O-OG1 2.85Å; E963-T966 WeakPolarHBondContact CA-OG1 3.44Å; E963-T966 PolarHBondContact O-N 2.8Å; E963-T966 PolarHBondContact O-OG1 3.11Å; T966-M969 PolarHBondContact O-N 3.45Å; T966-Q970 PolarHBondContact O-N 2.99Å
967	A	75.6	Confident	73.8	Confident	51 Å²	51	110.3 Å²	110.3	42%	0.421	54%	0.537	S	S	.	.	H	α-helix	trans	-65.3	-43.7	177.9	0	0	0	0	0	112.1	E963 M969 Q970 Q971	E963-A967 WeakPolarHBondContact O-CB 3.34Å; E963-A967 PolarHBondContact O-N 3.4Å; A967-M969 VanDerWaalsContact C-N 3.3Å; A967-M969 PolarHBondContact O-N 3Å; A967-Q970 PolarHBondContact O-N 3.47Å; A967-Q971 PolarHBondContact O-N 3.15Å
968	T	73.1	Confident	73.4	Confident	80 Å²	80	113.2 Å²	113.2	49%	0.491	55%	0.548	S	S	.	.	H	α-helix	trans	-64.7	-34.3	174.4	46.9	0	0	0	0	112.3	L964 S965 W972	L964-T968 WeakPolarHBondContact O-CG2 3.4Å; L964-T968 PolarHBondContact O-N 3.11Å; L964-T968 VanDerWaalsContact O-N 3.15Å; L964-T968 PolarHBondContact O-OG1 3.34Å; S965-T968 PolarHBondContact O-OG1 3.21Å; S965-T968 VanDerWaalsContact O-OG1 3.09Å; T968-W972 PolarHBondContact O-N 3.47Å
969	M	72.3	Confident	72.6	Confident	125 Å²	125	115.7 Å²	115.7	62%	0.616	55%	0.552	S	S	*	*	H	α-helix	trans	-69.6	-37.6	175.1	-162.7	-179.5	-161.9	0	0	113.2	S965 T966 A967 R973	S965-M969 WeakPolarHBondContact O-CB 3.43Å; S965-M969 PolarHBondContact O-N 3.5Å; S965-M969 VanDerWaalsContact O-N 3.16Å; T966-M969 PolarHBondContact O-N 3.45Å; A967-M969 VanDerWaalsContact C-N 3.3Å; A967-M969 PolarHBondContact O-N 3Å; M969-R973 PolarHBondContact O-N 3.32Å
970	Q	71.4	Confident	72	Confident	122 Å²	122	114.6 Å²	114.6	57%	0.57	55%	0.549	S	S	*	.	H	α-helix	trans	-66.9	-46	173.7	-80.2	176	-52.3	0	0	111.7	T966 A967 W972 R973 D974	T966-Q970 PolarHBondContact O-N 2.99Å; A967-Q970 PolarHBondContact O-N 3.47Å; Q970-W972 VanDerWaalsContact C-N 3.26Å; Q970-W972 PolarHBondContact O-N 3.07Å; Q970-R973 WeakPolarHBondContact O-CA 3.26Å; Q970-R973 WeakPolarHBondContact O-CB 3.49Å; Q970-R973 PolarHBondContact O-N 3.23Å; Q970-D974 PolarHBondContact O-N 3.37Å
971	Q	78.3	Confident	71.3	Confident	138 Å²	138	113 Å²	113	65%	0.645	55%	0.547	S	S	*	.	H	α-helix	trans	-62	-33.9	180	-162.1	177	21.9	0	0	112.7	A967 T975	A967-Q971 PolarHBondContact O-N 3.15Å; Q971-T975 PolarHBondContact O-N 2.98Å; Q971-T975 PolarHBondContact O-OG1 3.39Å
972	W	75.3	Confident	70.6	Confident	185 Å²	185	110.6 Å²	110.6	70%	0.701	54%	0.541	S	S	*	.	H	α-helix	trans	-66.3	-44	171.3	-173.8	82.6	0	0	0	112.2	T968 Q970 T975 V976	T968-W972 PolarHBondContact O-N 3.47Å; Q970-W972 VanDerWaalsContact C-N 3.26Å; Q970-W972 PolarHBondContact O-N 3.07Å; W972-T975 PolarHBondContact O-N 3Å; W972-V976 HydrophobicContact CD2-CG2 4.19Å; W972-V976 HydrophobicContact CE3-CG2 4.41Å; W972-V976 HydrophobicContact CH2-CG2 4.32Å; W972-V976 HydrophobicContact CZ2-CG2 4.08Å; W972-V976 HydrophobicContact CZ3-CG2 4.47Å; W972-V976 WeakPolarHBondContact O-CG2 3.24Å; W972-V976 PolarHBondContact O-N 3.03Å
973	R	76.7	Confident	69.8	Low	145 Å²	145	114.3 Å²	114.3	55%	0.547	55%	0.55	S	S	.	.	H	α-helix	trans	-59.5	-47.9	178.5	-166.3	-177.2	-64.6	-179.5	0.1	111.7	M969 Q970 T975 V976 Q977	M969-R973 PolarHBondContact O-N 3.32Å; Q970-R973 WeakPolarHBondContact O-CA 3.26Å; Q970-R973 WeakPolarHBondContact O-CB 3.49Å; Q970-R973 PolarHBondContact O-N 3.23Å; R973-T975 VanDerWaalsContact C-N 3.31Å; R973-T975 PolarHBondContact O-N 2.77Å; R973-V976 PolarHBondContact O-N 3.32Å; R973-Q977 WeakPolarHBondContact O-CB 3.3Å; R973-Q977 PolarHBondContact O-N 2.94Å
974	D	74.1	Confident	69.2	Low	105 Å²	105	117.8 Å²	117.8	56%	0.561	56%	0.559	S	S	*	*	H	α-helix	trans	-63.2	-36.8	179.2	-66.2	-15	0	0	0	112.2	Q970 Q977 K978	Q970-D974 PolarHBondContact O-N 3.37Å; D974-Q977 PolarHBondContact O-N 3.1Å; D974-K978 PolarHBondContact O-N 3Å
975	T	74.9	Confident	68.5	Low	69 Å²	69	119.1 Å²	119.1	42%	0.423	56%	0.56	S	S	.	*	H	α-helix	trans	-69	-37.4	178.4	-54.7	0	0	0	0	111.9	Q971 W972 R973 R979	Q971-T975 PolarHBondContact O-N 2.98Å; Q971-T975 PolarHBondContact O-OG1 3.39Å; W972-T975 PolarHBondContact O-N 3Å; R973-T975 VanDerWaalsContact C-N 3.31Å; R973-T975 PolarHBondContact O-N 2.77Å; T975-R979 WeakPolarHBondContact O-CG 3.24Å; T975-R979 PolarHBondContact O-N 3.07Å
976	V	73.8	Confident	67.7	Low	57 Å²	57	122.4 Å²	122.4	35%	0.345	57%	0.572	S	S	.	*	H	α-helix	trans	-68.1	-42.5	174.2	172.4	0	0	0	0	110.7	W972 R973 R979 Q980	W972-V976 HydrophobicContact CD2-CG2 4.19Å; W972-V976 HydrophobicContact CE3-CG2 4.41Å; W972-V976 HydrophobicContact CH2-CG2 4.32Å; W972-V976 HydrophobicContact CZ2-CG2 4.08Å; W972-V976 HydrophobicContact CZ3-CG2 4.47Å; W972-V976 WeakPolarHBondContact O-CG2 3.24Å; W972-V976 PolarHBondContact O-N 3.03Å; R973-V976 PolarHBondContact O-N 3.32Å; V976-R979 PolarHBondContact O-N 3.25Å; V976-Q980 PolarHBondContact O-N 3.39Å
977	Q	68.4	Low	66.6	Low	107 Å²	107	126.2 Å²	126.2	50%	0.5	59%	0.591	S	S	.	*	H	α-helix	trans	-69.8	-36.1	-178.1	-162.4	161	-17.9	0	0	112.5	R973 D974 Q980 N981	R973-Q977 WeakPolarHBondContact O-CB 3.3Å; R973-Q977 PolarHBondContact O-N 2.94Å; D974-Q977 PolarHBondContact O-N 3.1Å; Q977-Q980 PolarHBondContact O-N 3.31Å; Q977-N981 PolarHBondContact O-N 2.84Å
978	K	69.6	Low	65.6	Low	151 Å²	151	126.7 Å²	126.7	66%	0.657	60%	0.595	S	S	*	*	H	α-helix	trans	-57.6	-48.9	168.8	-103.2	-176.3	173.6	178.9	0	112.4	D974 Q980 N981 D982	D974-K978 PolarHBondContact O-N 3Å; K978-Q980 PolarHBondContact O-N 2.72Å; K978-N981 PolarHBondContact O-N 3.09Å; K978-D982 PolarHBondContact O-N 3.33Å
979	R	61.9	Low	64.6	Low	184 Å²	184	127.1 Å²	127.1	69%	0.694	60%	0.597	S	S	*	*	H	α-helix	trans	-63.8	-24	179.4	-72.8	-178.8	-178.8	177.6	2.4	113.9	T975 V976	T975-R979 WeakPolarHBondContact O-CG 3.24Å; T975-R979 PolarHBondContact O-N 3.07Å; V976-R979 PolarHBondContact O-N 3.25Å
980	Q	62.7	Low	63.4	Low	116 Å²	116	128.5 Å²	128.5	54%	0.542	61%	0.607	S	S	.	*	H	α-helix	trans	-77.6	-48	171.7	-74.8	-178.3	-24.9	0	0	111.2	V976 Q977 K978 D982 R983 Y984	V976-Q980 PolarHBondContact O-N 3.39Å; Q977-Q980 PolarHBondContact O-N 3.31Å; K978-Q980 PolarHBondContact O-N 2.72Å; Q980-D982 PolarHBondContact O-N 3.14Å; Q980-R983 PolarHBondContact O-N 3.24Å; Q980-R983 VanDerWaalsContact O-N 3.15Å; Q980-Y984 WeakPolarHBondContact O-CD2 3.2Å; Q980-Y984 PolarHBondContact O-N 3.24Å
981	N	58.4	Low	62.2	Low	101 Å²	101	131.9 Å²	131.9	54%	0.54	62%	0.62	S	S	.	*	H	α-helix	trans	-63.1	-39.1	-179.9	-76.4	0.6	0	0	0	112.9	Q977 K978 R983 Y984 F985	Q977-N981 PolarHBondContact O-N 2.84Å; K978-N981 PolarHBondContact O-N 3.09Å; N981-R983 PolarHBondContact O-N 3.34Å; N981-Y984 PolarHBondContact O-N 3.33Å; N981-Y984 VanDerWaalsContact O-N 3.09Å; N981-F985 PolarHBondContact O-N 2.8Å
982	D	56.5	Low	60.6	Low	100 Å²	100	133.9 Å²	133.9	54%	0.535	63%	0.629	S	S	.	*	H	α-helix	trans	-62.3	-29.4	176.8	-66	-23.1	0	0	0	112.5	K978 Q980 L986	K978-D982 PolarHBondContact O-N 3.33Å; Q980-D982 PolarHBondContact O-N 3.14Å; D982-L986 PolarHBondContact O-N 3.26Å
983	R	57	Low	58.9	Low	204 Å²	204	134.1 Å²	134.1	77%	0.77	64%	0.64	S	S	*	*	H	α-helix	trans	-76.7	-27.3	174.5	-82.4	-174.1	173.4	-172.8	-1.3	113.8	Q980 N981	Q980-R983 PolarHBondContact O-N 3.24Å; Q980-R983 VanDerWaalsContact O-N 3.15Å; N981-R983 PolarHBondContact O-N 3.34Å
984	Y	58.7	Low	57.2	Low	184 Å²	184	135.3 Å²	135.3	72%	0.722	65%	0.652	S	S	*	*	H	α-helix	trans	-80.3	-34.6	173.7	-80.9	-78.8	0	0	0	111.8	Q980 N981 N987	Q980-Y984 WeakPolarHBondContact O-CD2 3.2Å; Q980-Y984 PolarHBondContact O-N 3.24Å; N981-Y984 PolarHBondContact O-N 3.33Å; N981-Y984 VanDerWaalsContact O-N 3.09Å; Y984-N987 PolarHBondContact O-N 3.2Å
985	F	55.4	Low	55.5	Low	153 Å²	153	137.7 Å²	137.7	67%	0.671	66%	0.664	S	S	*	*	H	α-helix	trans	-68.5	-38.2	-179.4	-159.1	-104.9	0	0	0	113	N981 N987 A988 T989	N981-F985 PolarHBondContact O-N 2.8Å; F985-N987 VanDerWaalsContact C-N 3.27Å; F985-N987 PolarHBondContact O-N 3.44Å; F985-A988 PolarHBondContact O-N 3.07Å; F985-T989 HydrophobicContact CD1-CG2 4.5Å; F985-T989 HydrophobicContact CE1-CG2 4.24Å
986	L	54.4	Low	53.5	Low	131 Å²	131	140.1 Å²	140.1	69%	0.686	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-17.8	177.7	-91.5	162.6	0	0	0	115.1	D982	D982-L986 PolarHBondContact O-N 3.26Å
987	N	50.9	Low	51.5	Low	143 Å²	143	144.8 Å²	144.8	77%	0.765	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-6.3	175.3	-77.1	-19.4	0	0	0	113.2	Y984 F985	Y984-N987 PolarHBondContact O-N 3.2Å; F985-N987 VanDerWaalsContact C-N 3.27Å; F985-N987 PolarHBondContact O-N 3.44Å
988	A	54.2	Low	49.8	Very low	61 Å²	61	145.6 Å²	145.6	50%	0.504	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.3	-20.3	-177.1	0	0	0	0	0	113.5	F985 D990	F985-A988 PolarHBondContact O-N 3.07Å; A988-D990 PolarHBondContact O-N 3.27Å
989	T	52.4	Low	48	Very low	89 Å²	89	144 Å²	144	55%	0.546	71%	0.711	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.7	-7.2	-173.1	43.9	0	0	0	0	115.3	F985	F985-T989 HydrophobicContact CD1-CG2 4.5Å; F985-T989 HydrophobicContact CE1-CG2 4.24Å
990	D	45.6	Very low	46.5	Very low	154 Å²	154	143.3 Å²	143.3	82%	0.824	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	7.1	-178.6	-161.2	40.6	0	0	0	114	A988	A988-D990 PolarHBondContact O-N 3.27Å
991	K	46.7	Very low	45.2	Very low	192 Å²	192	144.7 Å²	144.7	84%	0.835	73%	0.725	S	S	*	*	S	Bend	trans	-130.6	0.2	-169.2	-103.7	-177.1	179	179.3	0	118.5
992	Q	45	Very low	43.8	Very low	181 Å²	181	144.7 Å²	144.7	85%	0.846	73%	0.733	S	S	*	*			trans	-144.6	38.5	-174.3	-116.7	164.1	-13.7	0	0	115	Q994	Q992-Q994 VanDerWaalsContact C-N 3.25Å; Q992-Q994 PolarHBondContact O-N 2.89Å
993	M	38.7	Very low	42.5	Very low	190 Å²	190	148.4 Å²	148.4	94%	0.936	75%	0.745	S	S	*	*			trans	-88.8	37.8	172.4	-163.6	166.8	176.3	0	0	112.7
994	Q	42.9	Very low	41.2	Very low	169 Å²	169	145.2 Å²	145.2	79%	0.79	74%	0.743	S	S	*	*			trans	-147	135.9	-179.1	-96.8	172.2	-9.1	0	0	112	Q992	Q992-Q994 VanDerWaalsContact C-N 3.25Å; Q992-Q994 PolarHBondContact O-N 2.89Å
995	L	38.5	Very low	39.8	Very low	156 Å²	156	143.4 Å²	143.4	82%	0.817	75%	0.746	S	S	*	*			trans	68	104.3	-175.2	-73.3	70.3	0	0	0	114.2
996	C	32.2	Very low	38.9	Very low	119 Å²	119	141.3 Å²	141.3	80%	0.804	75%	0.745	S	S	*	*				64.2	141.2	64.9	-64.6	0	0	0	0	112.2
997	H	31.6	Very low	38.1	Very low	155 Å²	155	142 Å²	142	72%	0.718	75%	0.748	S	S	*	*			cis	172.1	149.6	-10	-148.7	-68.6	0	0	0	102.2
998	N	32.6	Very low	37.2	Very low	125 Å²	125	142.7 Å²	142.7	67%	0.668	75%	0.746	S	S	*	*			trans	73.3	119.6	160.6	-64	-17.5	0	0	0	121.8
999	T	30.8	Very low	36.1	Very low	116 Å²	116	146.8 Å²	146.8	71%	0.712	76%	0.755	S	S	*	*				73.5	122.8	127.4	58.3	0	0	0	0	123
1000	E	31.5	Very low	35.1	Very low	170 Å²	170	146.8 Å²	146.8	79%	0.794	76%	0.758	S	S	*	*				99.7	132.7	127.6	-87.9	177.6	-179.7	0	0	122.6
1001	I	35.1	Very low	34.4	Very low	146 Å²	146	146.2 Å²	146.2	75%	0.749	76%	0.76	S	S	*	*			trans	98.2	95.2	151.9	-60.6	148.3	0	0	0	120.6
1002	S	28.5	Very low	33.8	Very low	100 Å²	100	141.1 Å²	141.1	70%	0.699	75%	0.754	S	S	*	*				57.6	152.3	129.3	83.2	0	0	0	0	126.6
1003	F	29.6	Very low	32.9	Very low	179 Å²	179	140 Å²	140	79%	0.785	75%	0.752	S	S	*	*			trans	95.1	116.1	161.4	-100.2	-103.2	0	0	0	118.5
1004	D	30.9	Very low	32.6	Very low	136 Å²	136	136.3 Å²	136.3	73%	0.727	74%	0.736	S	S	*	*			trans	57.1	133.2	162.9	-48	-18	0	0	0	120.2
1005	D	29.3	Very low	32	Very low	147 Å²	147	135.6 Å²	135.6	79%	0.786	73%	0.73	S	S	*	*			cis	-160.8	153.5	-17.7	-148.9	-7.7	0	0	0	111.6
1006	V	36.5	Very low	32.2	Very low	109 Å²	109	134.4 Å²	134.4	66%	0.661	73%	0.725	S	S	*	*			trans	64.8	103.9	163	-171.1	0	0	0	0	123.3
1007	I	36.1	Very low	32.4	Very low	146 Å²	146	135.2 Å²	135.2	75%	0.749	72%	0.721	S	S	*	*			trans	54.8	113.5	134.5	-60.8	176.1	0	0	0	119.7
1008	H	33.3	Very low	32.6	Very low	156 Å²	156	134.4 Å²	134.4	72%	0.722	72%	0.722	S	S	*	*				62.6	154.4	73.7	-75.2	-128.4	0	0	0	115.5
1009	H	29.9	Very low	32.4	Very low	148 Å²	148	135.1 Å²	135.1	69%	0.685	73%	0.725	S	S	*	*			cis	-146.7	126.8	2.4	-115.8	-71	0	0	0	108.1
1010	S	31.7	Very low	32.3	Very low	88 Å²	88	134.6 Å²	134.6	62%	0.615	73%	0.726	S	S	*	*				63.4	119.3	101.7	86.3	0	0	0	0	117.9
1011	V	32	Very low	32.2	Very low	142 Å²	142	131.1 Å²	131.1	86%	0.861	72%	0.721	S	S	*	*				85.3	150	89.1	171.1	0	0	0	0	115
1012	A	34.3	Very low	31.9	Very low	86 Å²	86	128.4 Å²	128.4	71%	0.711	72%	0.72	S	S	*	*			trans	-63	-166.9	-179.2	0	0	0	0	0	115.6
1013	I	25.4	Very low	32	Very low	156 Å²	156	130.2 Å²	130.2	80%	0.8	72%	0.721	S	S	*	*			trans	92.1	97.8	-177.6	-54.6	170.7	0	0	0	110.2
1014	D	31.4	Very low	31.9	Very low	114 Å²	114	132 Å²	132	61%	0.61	72%	0.724	S	S	*	*				80.9	134.4	59.1	-171.5	25.9	0	0	0	112.6
1015	K	31.1	Very low	31.8	Very low	153 Å²	153	130.1 Å²	130.1	67%	0.665	72%	0.721	S	S	*	*			trans	57.3	121.3	173.5	-73.7	136.9	-163.3	156.6	0	120
1016	N	41.9	Very low	31.8	Very low	131 Å²	131	129.5 Å²	129.5	70%	0.701	72%	0.723	S	S	*	*				36	129	116.7	-46.7	-11	0	0	0	118
1017	N	36.1	Very low	31.3	Very low	136 Å²	136	130.7 Å²	130.7	73%	0.727	73%	0.725	S	S	*	*				176.7	150.2	94.5	-96.4	-36.8	0	0	0	114.4
1018	L	35.7	Very low	30.9	Very low	139 Å²	139	130.4 Å²	130.4	73%	0.728	72%	0.723	S	S	*	*			trans	56	133.9	150.3	-82.8	75.4	0	0	0	117.6
1019	N	29.1	Very low	30.6	Very low	140 Å²	140	130.7 Å²	130.7	75%	0.749	72%	0.722	S	S	*	*				-156.2	146	54.2	-110.2	-40.9	0	0	0	114.2
1020	S	29.2	Very low	30.6	Very low	104 Å²	104	129.2 Å²	129.2	73%	0.727	72%	0.719	S	S	*	*			trans	61.7	129	144	-160.3	0	0	0	0	119.7
1021	S	29.8	Very low	30.5	Very low	98 Å²	98	133.1 Å²	133.1	69%	0.685	73%	0.725	S	S	*	*			cis	-168.9	152.3	-17	41	0	0	0	0	107.9
1022	A	29	Very low	30.3	Very low	88 Å²	88	133.9 Å²	133.9	73%	0.727	72%	0.719	S	S	*	*			trans	62.5	146.6	151.5	0	0	0	0	0	119
1023	I	28.8	Very low	30.1	Very low	139 Å²	139	134 Å²	134	71%	0.713	71%	0.714	S	S	*	*			cis	-162	137.5	-8.7	-119.2	174.1	0	0	0	108.2
1024	Y	29.2	Very low	30.2	Very low	216 Å²	216	132.9 Å²	132.9	85%	0.847	71%	0.71	S	S	*	*			trans	73.8	151.6	156.9	-74.6	-116.9	0	0	0	121.8
1025	S	29	Very low	30.2	Very low	96 Å²	96	134.4 Å²	134.4	67%	0.671	72%	0.718	S	S	*	*			trans	-82.8	146.7	-179.1	56.4	0	0	0	0	114.3
1026	T	28.2	Very low	30.3	Very low	135 Å²	135	132.9 Å²	132.9	83%	0.828	72%	0.724	S	S	*	*			trans	-119.3	125.5	143.1	48.1	0	0	0	0	105.6
1027	N	26.2	Very low	30	Very low	133 Å²	133	134.9 Å²	134.9	71%	0.711	73%	0.727	S	S	*	*			cis	55	95.2	32.3	-151.3	11	0	0	0	112.2
1028	M	27.2	Very low	30	Very low	141 Å²	141	134.4 Å²	134.4	70%	0.695	73%	0.731	S	S	*	*			trans	67.9	132.8	164.1	-65.6	-129.9	178.5	0	0	119.3
1029	K	27.9	Very low	29.6	Very low	161 Å²	161	134.3 Å²	134.3	70%	0.7	73%	0.731	S	S	*	*			trans	74.6	132.7	131.4	-77.5	177	179	175.9	0	120.6
1030	D	29.4	Very low	29.8	Very low	117 Å²	117	137.2 Å²	137.2	63%	0.626	74%	0.738	S	S	*	*				66.2	132.2	128.2	-62.7	-24.4	0	0	0	120.7
1031	K	29.4	Very low	29.9	Very low	170 Å²	170	136.4 Å²	136.4	74%	0.739	73%	0.732	S	S	*	*			trans	76.9	120.8	137	-75.9	174.7	-177.1	176.2	0	116.9
1032	Q	29.1	Very low	30.1	Very low	158 Å²	158	139 Å²	139	74%	0.738	74%	0.735	S	S	*	*				94.8	137.8	61.1	-175.6	179.4	37.6	0	0	110.4
1033	S	28.3	Very low	30.3	Very low	88 Å²	88	140.6 Å²	140.6	62%	0.615	73%	0.731	S	S	*	*			trans	82	128.4	158.6	-88.2	0	0	0	0	121.8
1034	N	28.6	Very low	30.6	Very low	133 Å²	133	141.4 Å²	141.4	71%	0.711	73%	0.734	S	S	*	*			trans	80.9	116.9	138.6	-57.4	-12.5	0	0	0	117.5
1035	N	30.7	Very low	30.8	Very low	146 Å²	146	139 Å²	139	78%	0.781	73%	0.728	S	S	*	*				67.2	146.8	75.4	-81.6	-24.6	0	0	0	113.2
1036	P	33.8	Very low	31	Very low	121 Å²	121	141.7 Å²	141.7	79%	0.786	73%	0.729	S	S	*	*			cis	-136.5	-179	21.3	39.3	-19.9	0	0	0	117
1037	K	35.5	Very low	31.2	Very low	174 Å²	174	143 Å²	143	76%	0.757	72%	0.724	S	S	*	*			trans	-68.6	171.6	164.1	-50.4	176.7	177.4	179.7	0	111.1
1038	P	35.2	Very low	31.7	Very low	125 Å²	125	146.1 Å²	146.1	81%	0.812	73%	0.727	S	S	*	*				-146.6	156.4	83.8	37.1	-19	0	0	0	117.7
1039	N	28.7	Very low	31.8	Very low	137 Å²	137	144.3 Å²	144.3	73%	0.733	73%	0.728	S	S	*	*			trans	-35.7	147.5	168.1	-41.6	-27.8	0	0	0	118
1040	F	33.7	Very low	32	Very low	202 Å²	202	142.9 Å²	142.9	89%	0.886	73%	0.733	S	S	*	*				-149.1	157.3	123.3	-149.7	-100.7	0	0	0	111.4
1041	S	31	Very low	32.1	Very low	86 Å²	86	145.2 Å²	145.2	60%	0.601	74%	0.744	S	S	*	*			trans	-117	158.7	-170.5	56.2	0	0	0	0	112.8
1042	M	34.2	Very low	32.3	Very low	154 Å²	154	146 Å²	146	76%	0.759	75%	0.75	S	S	*	*				176.2	133.9	118.4	-105.9	-173.8	154	0	0	114.5
1043	N	32.4	Very low	32.3	Very low	120 Å²	120	145.2 Å²	145.2	64%	0.642	75%	0.751	S	S	*	*			trans	73	117.5	136.5	-68.8	-3.8	0	0	0	124.2
1044	M	34.1	Very low	32.5	Very low	156 Å²	156	148.5 Å²	148.5	77%	0.768	76%	0.761	S	S	*	*				116.1	107	123.6	-85.4	-167.7	-149.5	0	0	121.1
1045	K	33.8	Very low	32.6	Very low	166 Å²	166	148.5 Å²	148.5	72%	0.722	76%	0.761	S	S	*	*			trans	86	114.6	135.6	-67.9	-173.3	174.4	-166.5	0	121.9
1046	E	34.2	Very low	32.7	Very low	152 Å²	152	149.1 Å²	149.1	71%	0.71	76%	0.763	S	S	*	*			trans	62.7	134.7	131.4	-66.8	178.7	103.2	0	0	119.2
1047	K	32.4	Very low	32.6	Very low	164 Å²	164	147.2 Å²	147.2	71%	0.713	75%	0.752	S	S	*	*			cis	-161	145.3	14.9	-119	-176.4	-178.6	-177.3	0	112.6
1048	Y	35.9	Very low	32.5	Very low	197 Å²	197	144.3 Å²	144.3	77%	0.773	75%	0.749	S	S	*	*			trans	58.7	130.1	154	-72.3	-73.4	0	0	0	126.5
1049	S	30.1	Very low	32.3	Very low	104 Å²	104	147.8 Å²	147.8	73%	0.727	75%	0.752	S	S	*	*			trans	73.7	146.6	133.9	60.8	0	0	0	0	123
1050	V	31.1	Very low	32.5	Very low	130 Å²	130	144.8 Å²	144.8	79%	0.788	75%	0.753	S	S	*	*			cis	-157.1	160.4	-39.6	176.2	0	0	0	0	104.5
1051	I	31.5	Very low	32.4	Very low	167 Å²	167	145.8 Å²	145.8	86%	0.856	75%	0.751	S	S	*	*			trans	88.1	113.3	171.3	-46	-178.1	0	0	0	113.1
1052	E	33.3	Very low	32.6	Very low	186 Å²	186	147.3 Å²	147.3	87%	0.869	75%	0.752	S	S	*	*			trans	-116.4	137.9	175.8	-164.4	166.5	-147.2	0	0	107.1
1053	D	30.7	Very low	32.6	Very low	142 Å²	142	145 Å²	145	76%	0.759	74%	0.742	S	S	*	*			trans	-62.4	162.7	170.5	-65.8	-68.9	0	0	0	110.8
1054	D	32.6	Very low	32.6	Very low	156 Å²	156	149 Å²	149	83%	0.834	75%	0.749	S	S	*	*				-153.4	147.8	107.2	-134.5	-21.2	0	0	0	114.7
1055	L	30.6	Very low	32.6	Very low	134 Å²	134	148.3 Å²	148.3	70%	0.702	74%	0.741	S	S	*	*			trans	-69.9	161.5	174.1	-93.2	64.4	0	0	0	111.9
1056	L	32.7	Very low	32.5	Very low	159 Å²	159	150.1 Å²	150.1	83%	0.832	74%	0.743	S	S	*	*				160.5	141.9	128.1	-85.5	157.6	0	0	0	108.6
1057	S	30.5	Very low	32.4	Very low	80 Å²	80	151.7 Å²	151.7	56%	0.559	75%	0.748	S	S	*	*			cis	-171.4	153.4	-1.2	-167.8	0	0	0	0	110.8
1058	T	33.3	Very low	32.4	Very low	113 Å²	113	148.3 Å²	148.3	69%	0.693	75%	0.751	S	S	*	*			trans	59.8	157.1	148.1	47.3	0	0	0	0	121.6
1059	K	32.2	Very low	32.2	Very low	198 Å²	198	144 Å²	144	86%	0.861	75%	0.749	S	S	*	*			cis	-173.6	133.5	-36.1	-117.2	178.5	-169.2	163.9	0	107.7
1060	G	32.6	Very low	32.1	Very low	74 Å²	74	145.6 Å²	145.6	76%	0.763	75%	0.75	S	S	*	*			trans	91.5	162.9	152.9	0	0	0	0	0	117.1
1061	R	31	Very low	32.2	Very low	223 Å²	223	149.9 Å²	149.9	84%	0.842	75%	0.753	S	S	*	*			cis	-176.6	132	-13.8	-138	-174.5	169	-175.3	-3.2	106.8
1062	I	35.9	Very low	32.1	Very low	119 Å²	119	146.7 Å²	146.7	61%	0.61	75%	0.745	S	S	*	*				95.9	128.8	127.4	-111.8	172.8	0	0	0	122.4
1063	N	33.4	Very low	31.8	Very low	106 Å²	106	142.9 Å²	142.9	57%	0.567	74%	0.738	S	S	*	*			trans	77.8	116.1	145.1	-73.1	-18.4	0	0	0	120.6
1064	R	33.2	Very low	31.7	Very low	204 Å²	204	144 Å²	144	77%	0.77	75%	0.745	S	S	*	*				76.3	139.7	80.9	-79.1	-178.7	175.7	162.9	-4.2	112.2
1065	K	33.1	Very low	31.7	Very low	140 Å²	140	140 Å²	140	61%	0.609	74%	0.74	S	S	*	*			cis	-177.6	144.3	34.4	-131.5	169.1	-179.3	177.7	0	110.1
1066	R	32.3	Very low	31.7	Very low	205 Å²	205	140.2 Å²	140.2	77%	0.774	74%	0.741	S	S	*	*			trans	59	154.2	143.7	-69.5	171.7	-177.5	-179.4	-3	118.2
1067	K	31.9	Very low	31.7	Very low	185 Å²	185	138.6 Å²	138.6	80%	0.804	73%	0.734	S	S	*	*			cis	-159.9	145.7	9.1	-134.5	-179.5	176.4	-163.4	0	110.4
1068	A	32.5	Very low	31.8	Very low	93 Å²	93	141.5 Å²	141.5	77%	0.769	74%	0.743	S	S	*	*			trans	-6.5	140.2	154.1	0	0	0	0	0	120.9
1069	S	31.5	Very low	31.8	Very low	106 Å²	106	141.5 Å²	141.5	74%	0.741	75%	0.748	S	S	*	*				178.2	135.6	83.1	55.9	0	0	0	0	114.8
1070	D	29	Very low	31.8	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	75%	0.745	S	S	*	*			trans	46.5	142.3	143.4	-56.8	-8.5	0	0	0	126.1
1071	Y	32.1	Very low	31.9	Very low	219 Å²	219	143.7 Å²	143.7	86%	0.859	75%	0.752	S	S	*	*			trans	84.1	119.4	153	-72	-65.9	0	0	0	123.9
1072	S	29.2	Very low	32	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	75%	0.751	S	S	*	*				82.7	105.7	125.4	-168.5	0	0	0	0	122.3
1073	C	26.6	Very low	31.9	Very low	107 Å²	107	137.7 Å²	137.7	72%	0.723	76%	0.756	S	S	*	*			trans	44.9	132	133	-62.3	0	0	0	0	123.6
1074	D	30.6	Very low	32	Very low	166 Å²	166	138.6 Å²	138.6	89%	0.888	76%	0.761	S	S	*	*			trans	61.9	133	149.1	-59.7	-18.8	0	0	0	120.7
1075	G	31.1	Very low	32	Very low	71 Å²	71	136.7 Å²	136.7	73%	0.732	77%	0.766	S	S	*	*			trans	145.1	80.8	163.7	0	0	0	0	0	115.6
1076	N	31.5	Very low	32	Very low	138 Å²	138	134 Å²	134	74%	0.738	77%	0.77	S	S	*	*			trans	45.5	133.2	140.3	-81.4	48.1	0	0	0	123.5
1077	D	31.5	Very low	32.1	Very low	125 Å²	125	132.1 Å²	132.1	67%	0.668	77%	0.774	S	S	*	*			trans	77	138.6	132.3	-54.7	-17.2	0	0	0	122.3
1078	D	33.8	Very low	32.1	Very low	141 Å²	141	130.1 Å²	130.1	75%	0.754	77%	0.772	S	S	*	*			trans	78.2	99.6	147.8	-60.8	-15.2	0	0	0	122.6
1079	S	32	Very low	32	Very low	114 Å²	114	129.9 Å²	129.9	80%	0.797	77%	0.765	S	S	*	*				77.7	138.4	121.7	62.9	0	0	0	0	121.9
1080	D	33.4	Very low	32.2	Very low	148 Å²	148	129.7 Å²	129.7	79%	0.791	76%	0.764	S	S	*	*			trans	-57.4	153.5	167.7	-63.2	-69.2	0	0	0	113.6
1081	D	34.2	Very low	32.3	Very low	170 Å²	170	130.5 Å²	130.5	91%	0.909	77%	0.767	S	S	*	*				-175.9	144.7	119.6	-94.5	-25	0	0	0	110.5
1082	G	33.7	Very low	32.3	Very low	80 Å²	80	124.7 Å²	124.7	83%	0.825	76%	0.759	S	S	*	*			trans	-174.7	49.6	-170	0	0	0	0	0	114.5
1083	D	34	Very low	32.4	Very low	136 Å²	136	129.4 Å²	129.4	73%	0.727	77%	0.767	S	S	*	*			trans	-61.5	152.3	-177.3	-104.7	-23.1	0	0	0	115.5
1084	N	34.6	Very low	32.8	Very low	124 Å²	124	128 Å²	128	66%	0.663	76%	0.763	S	S	*	*			trans	25.4	136.8	136.7	-48.6	-40.5	0	0	0	120.2
1085	D	34.2	Very low	32.8	Very low	164 Å²	164	126.6 Å²	126.6	88%	0.877	76%	0.755	S	S	*	*				-173	161.1	91.6	-108.2	-33.2	0	0	0	115
1086	A	33.2	Very low	32.9	Very low	83 Å²	83	131.3 Å²	131.3	69%	0.686	76%	0.757	S	S	*	*			trans	-87.1	169.5	-177	0	0	0	0	0	114
1087	L	34.5	Very low	32.9	Very low	167 Å²	167	128.4 Å²	128.4	87%	0.874	75%	0.752	S	S	*	*			trans	-179.5	98.5	136.5	-97.8	155.4	0	0	0	113.7
1088	D	31.2	Very low	32.9	Very low	142 Å²	142	127 Å²	127	76%	0.759	75%	0.752	S	S	*	*				50.7	145.4	117.5	-153.3	18.9	0	0	0	124.5
1089	S	31.2	Very low	33	Very low	88 Å²	88	128 Å²	128	62%	0.615	75%	0.752	S	S	*	*			trans	93.6	120.5	143.1	82	0	0	0	0	122.9
1090	S	35.3	Very low	33	Very low	102 Å²	102	128.8 Å²	128.8	71%	0.713	75%	0.748	S	S	*	*				111	118.7	122.4	77.3	0	0	0	0	122.3
1091	L	30.9	Very low	32.9	Very low	155 Å²	155	128 Å²	128	81%	0.812	74%	0.744	S	S	*	*			trans	62.6	113.1	134.1	-93.5	81.6	0	0	0	123.3
1092	S	32.8	Very low	32.8	Very low	98 Å²	98	127.6 Å²	127.6	69%	0.685	74%	0.741	S	S	*	*				125.2	133.9	96.8	68.7	0	0	0	0	120.3
1093	F	31.2	Very low	32.7	Very low	199 Å²	199	131.8 Å²	131.8	87%	0.873	74%	0.736	S	S	*	*			trans	61.4	109.6	139.8	-91.5	-113.8	0	0	0	122.2
1094	A	34.2	Very low	32.7	Very low	76 Å²	76	134.9 Å²	134.9	63%	0.628	75%	0.746	S	S	*	*				124	112.8	96.6	0	0	0	0	0	120.7
1095	L	30.2	Very low	32.6	Very low	137 Å²	137	135.1 Å²	135.1	72%	0.717	75%	0.746	S	S	*	*				78.8	129.7	122.8	-69.9	171.7	0	0	0	123.7
1096	H	32.5	Very low	32.5	Very low	171 Å²	171	130.5 Å²	130.5	79%	0.792	74%	0.737	S	S	*	*			trans	70.2	143.8	145.4	-73	-48.5	0	0	0	119.3
1097	A	32.5	Very low	32.6	Very low	76 Å²	76	133.6 Å²	133.6	63%	0.628	74%	0.737	S	S	*	*			cis	-169.9	167.5	-11.6	0	0	0	0	0	110.6
1098	S	30.3	Very low	32.5	Very low	96 Å²	96	131.8 Å²	131.8	67%	0.671	72%	0.722	S	S	*	*			trans	66.4	124.8	147.7	172.9	0	0	0	0	117.2
1099	Q	36	Very low	32.6	Very low	162 Å²	162	134.2 Å²	134.2	76%	0.757	72%	0.722	S	S	*	*				-174.8	132.7	57.2	-142.9	156.8	49.1	0	0	114.1
1100	N	33	Very low	32.6	Very low	130 Å²	130	136 Å²	136	70%	0.695	73%	0.733	S	S	*	*			trans	41.6	124.3	137.4	-62.5	-16.6	0	0	0	125.6
1101	N	31.2	Very low	32.5	Very low	132 Å²	132	136.9 Å²	136.9	71%	0.706	73%	0.734	S	S	*	*				56	126.6	121.2	-58.7	-34.9	0	0	0	123
1102	L	32.8	Very low	32.7	Very low	162 Å²	162	136.3 Å²	136.3	85%	0.848	74%	0.737	S	S	*	*				-177.5	117.2	98.4	-111	108.9	0	0	0	109.1
1103	K	31.8	Very low	32.6	Very low	167 Å²	167	136.9 Å²	136.9	73%	0.726	74%	0.737	S	S	*	*				59.8	115	80.2	-90.6	-166.6	178.9	-174.8	0	117.2	I1105	K1103-I1105 HydrophobicContact CD-CD1 4.06Å; K1103-I1105 HydrophobicContact CG-CD1 4.37Å
1104	Q	33.2	Very low	32.8	Very low	201 Å²	201	138 Å²	138	94%	0.939	74%	0.737	S	S	*	*				-141.7	155.3	128.2	-115.3	-177	9.1	0	0	111
1105	I	32.2	Very low	32.5	Very low	130 Å²	130	145.1 Å²	145.1	67%	0.667	75%	0.747	S	S	*	*			trans	-143.4	147.3	-161.9	-72.3	168.5	0	0	0	109.6	K1103	K1103-I1105 HydrophobicContact CD-CD1 4.06Å; K1103-I1105 HydrophobicContact CG-CD1 4.37Å
1106	G	33.1	Very low	32.3	Very low	66 Å²	66	143.4 Å²	143.4	68%	0.68	75%	0.746	S	S	*	*			trans	-150.2	101.1	153.1	0	0	0	0	0	108.5
1107	E	34.1	Very low	32	Very low	149 Å²	149	142.2 Å²	142.2	70%	0.696	75%	0.745	S	S	*	*				76.4	135.9	88.4	-73.1	-158.6	154.8	0	0	113.9
1108	K	32.8	Very low	31.8	Very low	129 Å²	129	147.5 Å²	147.5	56%	0.561	76%	0.757	S	S	*	*			cis	-175.3	148.4	-7.1	-120.9	169.4	179.1	164.9	0	111.6
1109	Y	33.9	Very low	31.7	Very low	193 Å²	193	148.5 Å²	148.5	76%	0.757	76%	0.758	S	S	*	*			trans	61.6	152.2	157.9	-55.6	-52	0	0	0	118.6
1110	C	30.9	Very low	31.4	Very low	126 Å²	126	147.4 Å²	147.4	85%	0.851	76%	0.758	S	S	*	*			cis	-140.8	175.8	22.9	-136.9	0	0	0	0	114.3
1111	V	32	Very low	31.1	Very low	120 Å²	120	148 Å²	148	73%	0.727	76%	0.761	S	S	*	*			trans	-123	141.2	-167.5	168.6	0	0	0	0	111.4
1112	T	35.3	Very low	31.1	Very low	143 Å²	143	151.7 Å²	151.7	88%	0.877	77%	0.766	S	S	*	*			trans	-170.7	154.6	132.2	24.2	0	0	0	0	114.1
1113	T	30.4	Very low	31	Very low	109 Å²	109	151.4 Å²	151.4	67%	0.669	76%	0.761	S	S	*	*			trans	-90.9	153.8	-172.3	51.4	0	0	0	0	114.4
1114	Y	35.6	Very low	31	Very low	223 Å²	223	151.5 Å²	151.5	88%	0.875	77%	0.769	S	S	*	*				-178.4	105.7	124.2	-99.2	-67.6	0	0	0	114.8
1115	R	28.3	Very low	30.8	Very low	226 Å²	226	147.9 Å²	147.9	85%	0.853	76%	0.756	S	S	*	*			trans	22.8	127.2	137.1	-163.8	170.9	-166.9	155.6	4.7	123.3
1116	C	26.1	Very low	30.7	Very low	101 Å²	101	149 Å²	149	68%	0.682	76%	0.764	S	S	*	*			trans	78.6	137	147.2	-78	0	0	0	0	122.3
1117	D	27.1	Very low	30.6	Very low	146 Å²	146	155.4 Å²	155.4	78%	0.781	77%	0.773	S	S	*	*			trans	75.7	111.8	156.9	-57.5	-15.4	0	0	0	121.1
1118	Q	28.6	Very low	30.6	Very low	186 Å²	186	154.6 Å²	154.6	87%	0.869	78%	0.778	S	S	*	*			trans	76.1	129.5	148.2	-69.8	-166.5	-9.6	0	0	121.1
1119	V	28.2	Very low	30.3	Very low	117 Å²	117	155 Å²	155	71%	0.709	78%	0.782	S	S	*	*			trans	84.2	114.7	150.1	175.3	0	0	0	0	118.8
1120	N	28.1	Very low	30.2	Very low	139 Å²	139	153.9 Å²	153.9	74%	0.743	79%	0.788	S	S	*	*			trans	75.8	130.6	151.6	-64.2	-1.9	0	0	0	122.6
1121	N	28	Very low	30.4	Very low	142 Å²	142	156.6 Å²	156.6	76%	0.759	79%	0.788	S	S	*	*			trans	44	115.4	150.2	-63.5	2.3	0	0	0	119.7
1122	Y	30	Very low	30.4	Very low	210 Å²	210	158.7 Å²	158.7	82%	0.824	79%	0.787	S	S	*	*				-157.5	114.9	129.8	-100.8	-72.2	0	0	0	110.9
1123	E	31.7	Very low	30.2	Very low	156 Å²	156	159.3 Å²	159.3	73%	0.729	78%	0.78	S	S	*	*			trans	32.5	119	131.4	-59.3	177	157	0	0	120.5
1124	N	31.7	Very low	30.3	Very low	170 Å²	170	161.6 Å²	161.6	91%	0.909	78%	0.783	S	S	*	*			trans	-153.8	61.7	142.6	-105.8	-33.1	0	0	0	108
1125	N	28.9	Very low	30.3	Very low	124 Å²	124	158.2 Å²	158.2	66%	0.663	78%	0.776	S	S	*	*			trans	-92	106.2	176.4	-79.5	22	0	0	0	109.7
1126	D	30.3	Very low	30.4	Very low	155 Å²	155	154.3 Å²	154.3	83%	0.829	77%	0.767	S	S	*	*	S	Bend	trans	-161.3	114.7	156.7	-105.4	-35	0	0	0	107.1
1127	K	31.3	Very low	30.8	Very low	200 Å²	200	155 Å²	155	87%	0.87	77%	0.768	S	S	*	*	S	Bend	trans	85.5	41.3	179.2	-49.9	178.6	173.2	-179.2	0	120.3
1128	V	32.7	Very low	31	Very low	131 Å²	131	149.3 Å²	149.3	79%	0.794	74%	0.744	S	S	*	*			trans	-147.7	75.5	147.1	-170.6	0	0	0	0	109.3
1129	E	27.3	Very low	31.2	Very low	138 Å²	138	146.7 Å²	146.7	65%	0.645	73%	0.732	S	S	*	*			trans	-146.5	83	-172.2	-150.1	157.3	-128.1	0	0	109.8
1130	L	31.3	Very low	31.3	Very low	170 Å²	170	148.9 Å²	148.9	89%	0.89	73%	0.734	S	S	*	*	S	Bend	trans	-174.9	-9.7	168.1	-109.3	161.8	0	0	0	113.9
1131	E	34.9	Very low	31.5	Very low	182 Å²	182	143.7 Å²	143.7	85%	0.85	71%	0.714	S	S	*	*	S	Bend	trans	-116.9	18	-179	-72.8	-176.8	140	0	0	114.2
1132	K	32.5	Very low	32	Very low	164 Å²	164	142.9 Å²	142.9	71%	0.713	70%	0.701	S	S	*	*	S	Bend	trans	-134.1	0.9	-177.4	-75.2	-160.9	171.8	-166.9	0	118.1
1133	E	30.5	Very low	32.2	Very low	157 Å²	157	140.3 Å²	140.3	73%	0.734	70%	0.697	S	S	*	*	S	Bend	trans	-100.8	-2.1	175.8	-70.5	-171.3	133.9	0	0	114.2
1134	Q	34.2	Very low	32.4	Very low	156 Å²	156	140 Å²	140	73%	0.729	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-6	174.8	-75	-173.6	-26	0	0	114.7
1135	E	34.4	Very low	32.8	Very low	153 Å²	153	138 Å²	138	72%	0.715	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-16.3	178	-74.5	-171.5	139.8	0	0	114.5
1136	Q	32	Very low	33.3	Very low	143 Å²	143	139 Å²	139	67%	0.668	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-29.3	178.8	-73.5	-168.6	-54.7	0	0	114.4	G1138 Q1139	Q1136-G1138 PolarHBondContact O-N 3.31Å; Q1136-Q1139 PolarHBondContact O-N 2.61Å
1137	V	33.2	Very low	33.6	Very low	115 Å²	115	138.7 Å²	138.7	70%	0.697	68%	0.675	S	S	*	*	H	α-helix	trans	-70.5	-19.9	170.5	-175.8	0	0	0	0	111.4	Q1139	V1137-Q1139 VanDerWaalsContact C-N 3.34Å
1138	G	31.7	Very low	34	Very low	28 Å²	28	136.1 Å²	136.1	29%	0.289	67%	0.666	S	S	.	*	H	α-helix	trans	-88.5	15.3	172	0	0	0	0	0	115.2	Q1136 Y1142	Q1136-G1138 PolarHBondContact O-N 3.31Å; G1138-Y1142 WeakPolarHBondContact O-CD2 3.45Å; G1138-Y1142 WeakPolarHBondContact O-CE2 3.43Å
1139	Q	33.1	Very low	34.4	Very low	131 Å²	131	137.2 Å²	137.2	61%	0.612	66%	0.662	S	S	*	*	H	α-helix	trans	-113.4	-28.7	170.3	-69.3	-167.9	-68.1	0	0	112.8	Q1136 V1137 G1141 Y1142	Q1136-Q1139 PolarHBondContact O-N 2.61Å; V1137-Q1139 VanDerWaalsContact C-N 3.34Å; Q1139-G1141 VanDerWaalsContact C-N 3.31Å; Q1139-Y1142 PolarHBondContact O-N 2.93Å
1140	E	30.2	Very low	35.1	Very low	162 Å²	162	138 Å²	138	76%	0.757	67%	0.666	S	S	*	*	H	α-helix	trans	-76.9	-15.2	173.8	-67.3	-178.3	151.7	0	0	113
1141	G	31.4	Very low	35.5	Very low	31 Å²	31	137.4 Å²	137.4	32%	0.32	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.2	-12.6	170.7	0	0	0	0	0	115.1	Q1139 E1145	Q1139-G1141 VanDerWaalsContact C-N 3.31Å; G1141-E1145 PolarHBondContact O-N 3.42Å
1142	Y	39.2	Very low	35.9	Very low	124 Å²	124	135.8 Å²	135.8	49%	0.486	65%	0.651	S	S	.	*	H	α-helix	trans	-84	-18.6	-179.8	-88.9	-114.7	0	0	0	112.8	G1138 Q1139	G1138-Y1142 WeakPolarHBondContact O-CD2 3.45Å; G1138-Y1142 WeakPolarHBondContact O-CE2 3.43Å; Q1139-Y1142 PolarHBondContact O-N 2.93Å
1143	E	34.8	Very low	36.3	Very low	157 Å²	157	134.7 Å²	134.7	73%	0.734	65%	0.648	S	S	*	*	H	α-helix	trans	-85.6	-16	172.4	-67.4	-174.8	155.4	0	0	112.4
1144	E	35.6	Very low	36.8	Very low	149 Å²	149	134.1 Å²	134.1	70%	0.696	64%	0.644	S	S	*	*	H	α-helix	trans	-90.6	-34.1	173	-71.4	-174	149.4	0	0	112.7	E1147 E1148	E1144-E1147 PolarHBondContact O-N 3.01Å; E1144-E1148 PolarHBondContact O-N 3.15Å
1145	E	38.8	Very low	37.1	Very low	129 Å²	129	129.5 Å²	129.5	60%	0.603	63%	0.629	S	S	*	*	H	α-helix	trans	-73.3	-31	174.6	-75.4	-176.9	157	0	0	113.3	G1141 E1147 E1148 E1149	G1141-E1145 PolarHBondContact O-N 3.42Å; E1145-E1147 VanDerWaalsContact C-N 3.34Å; E1145-E1148 PolarHBondContact O-N 3.34Å; E1145-E1149 PolarHBondContact O-N 2.81Å
1146	E	40.3	Very low	37.4	Very low	144 Å²	144	128.7 Å²	128.7	67%	0.673	63%	0.625	S	S	*	*	H	α-helix	trans	-69.8	-26.5	172.7	-82.8	-171.1	155.3	0	0	112.5	E1150	E1146-E1150 PolarHBondContact O-N 3.24Å
1147	E	37.3	Very low	37.8	Very low	148 Å²	148	127.1 Å²	127.1	69%	0.692	62%	0.621	S	S	*	*	H	α-helix	trans	-78.4	-33.2	172.9	-74.1	-165.4	154.3	0	0	112.6	E1144 E1145 E1151	E1144-E1147 PolarHBondContact O-N 3.01Å; E1145-E1147 VanDerWaalsContact C-N 3.34Å; E1147-E1151 PolarHBondContact O-N 2.98Å
1148	E	38.2	Very low	38.2	Very low	147 Å²	147	126.8 Å²	126.8	69%	0.687	61%	0.614	S	S	*	*	H	α-helix	trans	-75	-37.3	174.6	-74.8	-165.6	149.6	0	0	113.3	E1144 E1145 E1151 E1152	E1144-E1148 PolarHBondContact O-N 3.15Å; E1145-E1148 PolarHBondContact O-N 3.34Å; E1148-E1151 PolarHBondContact O-N 2.86Å; E1148-E1152 PolarHBondContact O-N 2.85Å
1149	E	41.8	Very low	38.6	Very low	153 Å²	153	133.7 Å²	133.7	72%	0.715	64%	0.638	S	S	*	*	H	α-helix	trans	-68.2	-35.2	173.5	-78.6	-162.4	150.4	0	0	112.4	E1145 E1153	E1145-E1149 PolarHBondContact O-N 2.81Å; E1149-E1153 PolarHBondContact O-N 3.47Å
1150	E	41.8	Very low	38.8	Very low	155 Å²	155	137.7 Å²	137.7	72%	0.724	65%	0.648	S	S	*	*	H	α-helix	trans	-67.8	-34.8	172.5	-78.8	-158.5	163.4	0	0	112.3	E1146 F1154	E1146-E1150 PolarHBondContact O-N 3.24Å; E1150-F1154 WeakPolarHBondContact O-CB 3.48Å; E1150-F1154 PolarHBondContact O-N 2.9Å; E1150-F1154 VanDerWaalsContact O-N 3.14Å
1151	E	40.6	Very low	39.1	Very low	157 Å²	157	135 Å²	135	73%	0.734	65%	0.646	S	S	*	*	H	α-helix	trans	-71.2	-38.5	173.5	-76.8	-152.2	146.1	0	0	113.2	E1147 E1148 S1155	E1147-E1151 PolarHBondContact O-N 2.98Å; E1148-E1151 PolarHBondContact O-N 2.86Å; E1151-S1155 WeakPolarHBondContact O-CB 3.27Å; E1151-S1155 PolarHBondContact O-N 3.48Å
1152	E	41.6	Very low	39	Very low	149 Å²	149	136.5 Å²	136.5	70%	0.696	66%	0.662	S	S	*	*	H	α-helix	trans	-67.7	-42.7	175.6	-77.1	-150.4	143	0	0	112.4	E1148 F1154 S1155 E1156	E1148-E1152 PolarHBondContact O-N 2.85Å; E1152-F1154 VanDerWaalsContact C-N 3.33Å; E1152-F1154 PolarHBondContact O-N 3.37Å; E1152-S1155 WeakPolarHBondContact O-CB 3.32Å; E1152-S1155 PolarHBondContact O-N 2.91Å; E1152-S1155 VanDerWaalsContact O-N 3.08Å; E1152-S1155 PolarHBondContact O-OG 3.4Å; E1152-E1156 PolarHBondContact O-N 2.93Å
1153	E	41	Very low	38.5	Very low	140 Å²	140	137.1 Å²	137.1	65%	0.654	68%	0.679	S	S	*	*	H	α-helix	trans	-66.3	-34.9	177.4	-159.1	178.5	-145.1	0	0	111.5	E1149 S1155 L1157	E1149-E1153 PolarHBondContact O-N 3.47Å; E1153-S1155 VanDerWaalsContact C-N 3.32Å; E1153-S1155 PolarHBondContact O-N 2.88Å; E1153-L1157 HydrophobicContact CG-CD1 4.26Å; E1153-L1157 WeakPolarHBondContact O-CB 3.31Å; E1153-L1157 WeakPolarHBondContact O-CD1 3.39Å; E1153-L1157 WeakPolarHBondContact O-CG 3.33Å; E1153-L1157 PolarHBondContact O-N 3.35Å
1154	F	40.8	Very low	38.4	Very low	146 Å²	146	136.2 Å²	136.2	64%	0.64	68%	0.684	S	S	*	*	H	α-helix	trans	-65	-35.5	171.4	-141.7	-102.5	0	0	0	112	E1150 E1152 I1158	E1150-F1154 WeakPolarHBondContact O-CB 3.48Å; E1150-F1154 PolarHBondContact O-N 2.9Å; E1150-F1154 VanDerWaalsContact O-N 3.14Å; E1152-F1154 VanDerWaalsContact C-N 3.33Å; E1152-F1154 PolarHBondContact O-N 3.37Å; F1154-I1158 HydrophobicContact CD1-CD1 3.6Å; F1154-I1158 HydrophobicContact CD1-CG1 4.43Å; F1154-I1158 HydrophobicContact CE1-CD1 3.9Å; F1154-I1158 WeakPolarHBondContact O-CB 3.46Å; F1154-I1158 WeakPolarHBondContact O-CD1 3.39Å; F1154-I1158 VanDerWaalsContact O-CG1 3.25Å; F1154-I1158 WeakPolarHBondContact O-CG1 3.28Å; F1154-I1158 PolarHBondContact O-N 2.83Å; F1154-I1158 VanDerWaalsContact O-N 3.07Å
1155	S	41.7	Very low	38.2	Very low	59 Å²	59	135 Å²	135	41%	0.413	69%	0.687	S	S	.	*	H	α-helix	trans	-70.3	-41.2	178	87.9	0	0	0	0	113.2	E1151 E1152 E1153 I1158 H1159	E1151-S1155 WeakPolarHBondContact O-CB 3.27Å; E1151-S1155 PolarHBondContact O-N 3.48Å; E1152-S1155 WeakPolarHBondContact O-CB 3.32Å; E1152-S1155 PolarHBondContact O-N 2.91Å; E1152-S1155 VanDerWaalsContact O-N 3.08Å; E1152-S1155 PolarHBondContact O-OG 3.4Å; E1153-S1155 VanDerWaalsContact C-N 3.32Å; E1153-S1155 PolarHBondContact O-N 2.88Å; S1155-I1158 PolarHBondContact O-N 3.26Å; S1155-H1159 PolarHBondContact O-N 3.38Å; S1155-H1159 VanDerWaalsContact O-N 3.14Å
1156	E	40.3	Very low	38	Very low	135 Å²	135	135.1 Å²	135.1	63%	0.631	70%	0.697	S	S	*	*	H	α-helix	trans	-68.6	-37.7	174.9	-81.6	-138.7	131.8	0	0	111.9	E1152 H1159 R1160	E1152-E1156 PolarHBondContact O-N 2.93Å; E1156-H1159 PolarHBondContact O-N 3.47Å; E1156-R1160 PolarHBondContact O-N 3.46Å
1157	L	39.7	Very low	37.8	Very low	111 Å²	111	136.6 Å²	136.6	58%	0.581	70%	0.703	S	S	*	*	H	α-helix	trans	-66.9	-35.7	176.2	-79.6	165.6	0	0	0	112.7	E1153 R1160 S1161	E1153-L1157 HydrophobicContact CG-CD1 4.26Å; E1153-L1157 WeakPolarHBondContact O-CB 3.31Å; E1153-L1157 WeakPolarHBondContact O-CD1 3.39Å; E1153-L1157 WeakPolarHBondContact O-CG 3.33Å; E1153-L1157 PolarHBondContact O-N 3.35Å; L1157-R1160 PolarHBondContact O-N 2.95Å; L1157-S1161 PolarHBondContact O-OG 2.91Å
1158	I	41.8	Very low	37.7	Very low	108 Å²	108	136.3 Å²	136.3	55%	0.554	71%	0.707	S	S	*	*	H	α-helix	trans	-67.8	-35.1	173.3	-73.7	169.1	0	0	0	111.3	F1154 S1155 R1160	F1154-I1158 HydrophobicContact CD1-CD1 3.6Å; F1154-I1158 HydrophobicContact CD1-CG1 4.43Å; F1154-I1158 HydrophobicContact CE1-CD1 3.9Å; F1154-I1158 WeakPolarHBondContact O-CB 3.46Å; F1154-I1158 WeakPolarHBondContact O-CD1 3.39Å; F1154-I1158 VanDerWaalsContact O-CG1 3.25Å; F1154-I1158 WeakPolarHBondContact O-CG1 3.28Å; F1154-I1158 PolarHBondContact O-N 2.83Å; F1154-I1158 VanDerWaalsContact O-N 3.07Å; S1155-I1158 PolarHBondContact O-N 3.26Å; I1158-R1160 VanDerWaalsContact C-N 3.35Å; I1158-R1160 PolarHBondContact O-N 2.95Å
1159	H	40	Very low	37.6	Very low	173 Å²	173	136.1 Å²	136.1	80%	0.801	71%	0.71	S	S	*	*	H	α-helix	trans	-76.3	-14	177.5	-98.7	-69.5	0	0	0	115.3	S1155 E1156	S1155-H1159 PolarHBondContact O-N 3.38Å; S1155-H1159 VanDerWaalsContact O-N 3.14Å; E1156-H1159 PolarHBondContact O-N 3.47Å
1160	R	38.1	Very low	37.4	Very low	215 Å²	215	136.3 Å²	136.3	81%	0.811	71%	0.713	S	S	*	*	H	α-helix	trans	-104.1	-4.4	-176.7	-118.7	172.2	179.1	160	0.9	116.5	E1156 L1157 I1158	E1156-R1160 PolarHBondContact O-N 3.46Å; L1157-R1160 PolarHBondContact O-N 2.95Å; I1158-R1160 VanDerWaalsContact C-N 3.35Å; I1158-R1160 PolarHBondContact O-N 2.95Å
1161	S	35.4	Very low	37.1	Very low	104 Å²	104	135.2 Å²	135.2	73%	0.727	71%	0.712	S	S	*	*	S	Bend	trans	-108.8	8.5	-175	64.5	0	0	0	0	115.7	L1157	L1157-S1161 PolarHBondContact O-OG 2.91Å
1162	G	29.9	Very low	36.8	Very low	64 Å²	64	134.5 Å²	134.5	66%	0.66	71%	0.713	S	S	*	*			trans	-108.3	40.8	-163.6	0	0	0	0	0	119.3
1163	T	29.5	Very low	36.6	Very low	137 Å²	137	135.3 Å²	135.3	84%	0.84	72%	0.721	S	S	*	*			trans	-153.3	80.4	172.2	48.2	0	0	0	0	115.9
1164	V	32.6	Very low	36.2	Very low	137 Å²	137	135.1 Å²	135.1	83%	0.83	72%	0.724	S	S	*	*			trans	-144.8	136.7	152	-158.8	0	0	0	0	111.2
1165	T	31.4	Very low	35.9	Very low	124 Å²	124	135.6 Å²	135.6	76%	0.761	73%	0.728	S	S	*	*			trans	73	99.6	175.7	71.1	0	0	0	0	118.1
1166	T	34.6	Very low	35.6	Very low	131 Å²	131	141.3 Å²	141.3	80%	0.804	74%	0.742	S	S	*	*				-167.5	135.4	113.2	21.5	0	0	0	0	112.3
1167	H	36	Very low	35.2	Very low	176 Å²	176	142.9 Å²	142.9	82%	0.815	75%	0.749	S	S	*	*			trans	55.9	114.5	156.8	-78.2	-81.4	0	0	0	123.4
1168	N	35.3	Very low	35	Very low	142 Å²	142	147.9 Å²	147.9	76%	0.759	77%	0.766	S	S	*	*			trans	-38.5	128.6	151.1	-52.6	-38.1	0	0	0	114.2
1169	N	36.4	Very low	34.7	Very low	143 Å²	143	147.1 Å²	147.1	77%	0.765	77%	0.77	S	S	*	*				173	147.1	104.6	-98.6	-26.6	0	0	0	114.6
1170	M	37	Very low	34.4	Very low	156 Å²	156	145.4 Å²	145.4	77%	0.768	77%	0.767	S	S	*	*			trans	67.7	104	152.6	-68.9	-177.4	174.5	0	0	121.4
1171	N	36.5	Very low	34.6	Very low	132 Å²	132	143.2 Å²	143.2	71%	0.706	77%	0.77	S	S	*	*				68.5	118.8	120.2	-61.5	-11.9	0	0	0	122.2
1172	N	34.1	Very low	34.8	Very low	142 Å²	142	145 Å²	145	76%	0.759	77%	0.77	S	S	*	*				64.1	108.9	129.7	-72.4	-6.5	0	0	0	120.3
1173	I	36.7	Very low	34.9	Very low	166 Å²	166	147.3 Å²	147.3	85%	0.851	78%	0.776	S	S	*	*				172.9	139.7	104.5	-90.4	148.4	0	0	0	112
1174	N	32.4	Very low	35.3	Very low	137 Å²	137	145.1 Å²	145.1	73%	0.733	77%	0.772	S	S	*	*			trans	-74.9	147.7	173.4	-57.3	-39.4	0	0	0	112.2
1175	H	34.7	Very low	35.5	Very low	155 Å²	155	149.2 Å²	149.2	72%	0.718	80%	0.796	S	S	*	*				172.1	129	113.2	-107.2	-92.6	0	0	0	115.4
1176	Y	35.6	Very low	35.7	Very low	179 Å²	179	150.5 Å²	150.5	70%	0.702	80%	0.798	S	S	*	*			trans	48.6	119	133.7	-88.4	-107.3	0	0	0	123.6
1177	Q	32.6	Very low	35.8	Very low	169 Å²	169	151.5 Å²	151.5	79%	0.79	80%	0.798	S	S	*	*			trans	33.1	125.2	130.8	-66.5	-176.3	-46.5	0	0	120.9
1178	K	34.6	Very low	35.8	Very low	215 Å²	215	150.1 Å²	150.1	94%	0.935	80%	0.797	S	S	*	*				-158.4	159.8	124	-119.1	173.1	-175.9	179.3	0	114
1179	S	34.8	Very low	35.8	Very low	92 Å²	92	150.6 Å²	150.6	64%	0.643	80%	0.799	S	S	*	*			trans	-109.8	160.9	-166.3	56.1	0	0	0	0	114.5
1180	N	34.4	Very low	35.8	Very low	137 Å²	137	151.1 Å²	151.1	73%	0.733	80%	0.801	S	S	*	*			trans	67	106.6	149.2	-62.6	2.1	0	0	0	120.9
1181	I	43.1	Very low	35.7	Very low	170 Å²	170	150.7 Å²	150.7	87%	0.872	80%	0.803	S	S	*	*			trans	-146.8	102.3	141.4	-59.8	178.6	0	0	0	103.2
1182	I	38.2	Very low	35.6	Very low	142 Å²	142	152.1 Å²	152.1	73%	0.728	81%	0.81	S	S	*	*				57.7	108.7	63.2	-60.9	-175.1	0	0	0	115
1183	S	32.4	Very low	35.7	Very low	112 Å²	112	152.8 Å²	152.8	78%	0.783	81%	0.814	S	S	*	*			trans	69.4	108	150.3	-178.6	0	0	0	0	119.6
1184	A	38.9	Very low	35.7	Very low	91 Å²	91	151.8 Å²	151.8	75%	0.752	81%	0.811	S	S	*	*				171.6	96.1	104.1	0	0	0	0	0	113.3
1185	V	36.3	Very low	36	Very low	222 Å²	222	153.1 Å²	153.1	100%	1.345	82%	0.818	S	S	*	*				-150.4	0	127.1	167.5	0	0	0	0	105.3

Retrieved 1,185 of 1,185 residues in 1504.9 ms (Link to these results)

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